data_1dr2_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 1dr2 _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 3.0 m . . . . . 0 N--CA 1.481 1.104 0 N-CA-C 108.451 -0.944 . . . . 70.89 108.451 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . . . -53.87 -50.94 65.16 Favored 'General case' 0 C--O 1.254 1.337 0 N-CA-C 114.353 1.242 . . . . 68.96 114.353 -177.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' SER . . . . . 0.427 ' CA ' ' CD1' ' A' ' 129' ' ' ILE . 97.3 p -160.37 164.48 32.39 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.674 0.749 . . . . 55.44 112.095 -175.278 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 86.6 mt -118.03 159.61 22.9 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 113.928 -1.487 . . . . 40.38 107.135 178.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -133.94 137.94 45.17 Favored 'General case' 0 C--N 1.29 -1.979 0 O-C-N 129.055 3.972 . . . . 31.11 104.739 173.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 28.7 m -131.11 141.1 50.1 Favored 'General case' 0 C--N 1.291 -1.941 0 O-C-N 128.105 3.378 . . . . 25.93 102.89 177.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 15.3 tt -133.06 136.62 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 1 O-C-N 129.615 4.322 . . . . 23.84 106.087 179.01 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.8 p -154.73 156.94 4.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 O-C-N 126.688 2.492 . . . . 24.73 107.924 179.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -117.55 133.81 55.55 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 126.865 2.603 . . . . 25.43 104.879 170.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.3 m -135.46 146.39 30.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 C-N-CA 123.621 0.769 . . . . 29.61 109.966 -179.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.2 p -97.08 -179.24 4.47 Favored 'General case' 0 C--O 1.256 1.418 0 O-C-N 126.036 2.085 . . . . 36.9 107.998 175.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.438 2.0 mt-30 -54.47 -33.36 59.53 Favored 'General case' 0 C--O 1.257 1.48 0 N-CA-C 115.312 1.597 . . . . 60.66 115.312 -172.76 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -88.53 9.71 22.87 Favored 'General case' 0 C--O 1.256 1.434 0 CA-C-O 117.051 -1.452 . . . . 51.71 112.732 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 74.4 mmm 71.75 17.09 5.53 Favored 'General case' 0 C--O 1.249 1.078 0 C-N-CA 124.456 1.102 . . . . 45.95 113.243 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -80.02 146.85 28.42 Favored Glycine 0 N--CA 1.515 3.933 0 N-CA-C 107.057 -2.417 . . . . 27.72 107.057 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.4 pt -127.12 -3.53 4.38 Favored 'Isoleucine or valine' 0 C--O 1.251 1.148 0 O-C-N 124.36 0.683 . . . . 27.65 111.091 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -165.1 162.4 35.66 Favored Glycine 0 C--O 1.266 2.123 0 N-CA-C 117.646 1.818 . . . . 28.17 117.646 -178.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . 0.464 ' NZ ' ' O ' ' A' ' 607' ' ' HOH . 1.1 tptt -160.02 127.22 4.51 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 114.199 -1.001 . . . . 54.28 109.636 -179.594 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 50.58 42.47 26.87 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 124.617 1.198 . . . . 55.76 111.076 176.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 75.79 12.93 83.53 Favored Glycine 0 C--O 1.25 1.109 0 CA-C-O 119.192 -0.782 . . . . 42.57 112.251 175.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . 0.4 ' O ' ' N ' ' A' ' 18' ' ' LYS . 63.9 t30 -141.48 -171.73 3.37 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 116.86 -1.543 . . . . 71.76 109.419 177.147 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 40.5 mt -78.49 149.75 75.58 Favored Pre-proline 0 C--N 1.304 -1.386 0 O-C-N 126.977 2.673 . . . . 31.78 107.183 176.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -72.66 -23.46 19.54 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 O-C-N 126.39 2.784 . . . . 30.69 112.433 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 22.2 p90 -112.47 161.05 28.07 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 125.298 1.624 . . . . 33.71 108.339 -177.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -68.89 170.07 16.34 Favored 'Trans proline' 0 C--N 1.321 -0.9 0 N-CA-C 106.338 -2.216 . . . . 30.44 106.338 178.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -61.35 134.26 50.87 Favored 'Trans proline' 0 CA--C 1.509 -0.754 0 C-N-CA 122.087 1.858 . . . . 35.62 114.726 -174.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 58.3 mt -119.71 113.75 21.12 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.541 1.936 . . . . 37.74 106.244 173.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . . . -60.67 -54.55 43.88 Favored 'General case' 0 C--O 1.261 1.663 0 CA-C-O 123.907 1.813 . . . . 64.47 113.895 -175.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . 0.367 51.9 m-80 -58.75 -40.76 84.81 Favored 'General case' 0 C--O 1.255 1.362 0 CA-C-N 113.487 -1.688 . . . . 61.98 112.442 -178.164 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -67.67 -38.36 83.64 Favored 'General case' 0 C--O 1.256 1.444 0 C-N-CA 119.023 -1.071 . . . . 64.04 109.684 179.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -63.16 -49.48 74.15 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 123.553 0.741 . . . . 64.58 111.574 179.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LYS . . . . . 0.47 ' NZ ' ' CB ' ' A' ' 32' ' ' LYS . 4.0 mtmp? -56.26 -38.88 71.74 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 107.778 -1.193 . . . . 64.07 107.778 -179.704 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -58.9 -46.14 88.61 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 123.819 1.771 . . . . 47.94 110.108 -177.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -65.26 -42.46 93.21 Favored 'General case' 0 C--O 1.252 1.219 0 CA-C-N 111.8 -2.455 . . . . 33.13 109.708 -177.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLN . . . . . 0.607 ' NE2' ' NH1' ' A' ' 70' ' ' ARG . 5.5 mm-40 -63.43 -49.71 72.64 Favored 'General case' 0 C--O 1.261 1.69 0 CA-C-O 122.778 1.275 . . . . 61.2 110.487 179.869 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . . . -60.54 -49.55 77.11 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 114.281 -1.327 . . . . 58.06 111.381 -178.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 94.1 mmm -60.95 -46.45 90.67 Favored 'General case' 0 C--O 1.245 0.831 0 N-CA-C 112.567 0.58 . . . . 44.79 112.567 -179.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 75.8 p -79.5 -26.91 41.48 Favored 'General case' 0 C--O 1.256 1.44 0 N-CA-C 114.35 1.241 . . . . 29.62 114.35 -174.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.7 m -84.86 -33.66 22.79 Favored 'General case' 0 C--O 1.261 1.673 0 N-CA-C 116.023 1.861 . . . . 43.7 116.023 -178.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . 0.681 ' O ' ' CE ' ' A' ' 111' ' ' MET . 30.2 m -70.16 117.14 11.34 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 115.495 1.665 . . . . 39.22 115.495 -177.367 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 30.9 t -104.16 145.38 30.29 Favored 'General case' 0 C--O 1.25 1.121 0 C-N-CA 125.637 1.575 . . . . 55.55 108.749 175.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' HIS . . . . . 0.696 ' C ' ' O ' ' A' ' 653' ' ' HOH . 27.9 m80 -104.45 39.04 1.74 Allowed 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 109.613 -0.514 . . . . 70.81 109.613 -178.554 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . 1.077 ' N ' ' O ' ' A' ' 653' ' ' HOH . 18.1 t -163.42 123.38 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 O-C-N 124.883 1.364 . . . . 62.3 108.518 -177.331 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . 0.34 17.8 pt-20 -68.13 140.22 56.18 Favored 'General case' 0 C--O 1.248 0.995 0 CA-C-O 123.031 1.395 . . . . 88.25 110.556 -179.989 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.16 3.35 88.96 Favored Glycine 0 C--O 1.248 0.969 0 CA-C-N 113.075 -1.875 . . . . 65.96 111.19 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 35.6 mttt -119.6 161.41 20.69 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 124.933 1.019 . . . . 58.51 111.078 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -134.56 161.99 33.53 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 124.216 0.948 . . . . 62.14 108.464 179.391 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -86.46 155.66 20.45 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 125.09 1.494 . . . . 36.64 108.995 176.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -111.51 135.83 51.53 Favored 'General case' 0 C--O 1.252 1.218 0 O-C-N 127.021 2.701 . . . . 33.82 107.569 175.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 23.2 m -114.99 133.43 61.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 114.211 -1.359 . . . . 30.84 107.635 175.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 31.2 mt -115.4 135.25 56.01 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 O-C-N 125.426 1.704 . . . . 29.29 108.989 176.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 14.5 ptp -152.95 158.72 42.51 Favored 'General case' 0 C--O 1.238 0.491 0 O-C-N 126.283 2.239 . . . . 29.05 111.315 -178.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.72 168.87 54.49 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-N 111.318 -2.674 . . . . 29.44 108.493 179.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LYS . . . . . 0.464 ' NZ ' ' O1X' ' A' ' 191' ' ' TAP . 23.8 ttpt -59.85 -47.5 85.48 Favored 'General case' 0 C--O 1.261 1.7 0 O-C-N 125.558 1.387 . . . . 31.14 112.382 -178.284 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LYS . . . . . 0.57 ' NZ ' ' O ' ' A' ' 613' ' ' HOH 0.25 28.6 mtpt -62.39 -41.93 99.03 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 115.121 -0.945 . . . . 53.96 109.171 -175.627 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 53.6 m -61.29 -47.62 85.15 Favored 'General case' 0 C--O 1.271 2.233 0 CA-C-N 113.506 -1.679 . . . . 27.79 111.259 -179.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 45.0 t-105 -55.42 -47.16 76.36 Favored 'General case' 0 N--CA 1.485 1.32 0 CA-C-O 122.393 1.092 . . . . 30.32 109.988 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . 0.321 69.0 m-85 -69.13 -18.13 63.92 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-O 118.117 -0.945 . . . . 31.74 112.522 -178.19 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.4 p -76.73 -15.03 59.88 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 124.529 1.143 . . . . 34.67 110.41 -179.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 21.4 mt -83.93 130.67 54.18 Favored Pre-proline 0 N--CA 1.49 1.573 0 N-CA-C 106.722 -1.585 . . . . 35.24 106.722 -178.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -53.23 132.62 48.98 Favored 'Trans proline' 0 N--CA 1.488 1.175 0 O-C-N 127.241 3.232 . . . . 32.61 106.286 178.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -48.89 -41.8 34.69 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 125.761 1.624 . . . . 70.51 114.253 -174.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.38 -19.9 63.82 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-N 115.95 -0.568 . . . . 52.51 111.732 -179.628 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -92.54 11.54 26.09 Favored 'General case' 0 C--O 1.259 1.571 0 CA-C-O 118.562 -0.732 . . . . 50.4 111.945 179.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 48.1 mtt180 -108.7 147.7 36.3 Favored Pre-proline 0 N--CA 1.475 0.808 0 CA-C-N 119.104 0.865 . . . . 40.71 112.043 -179.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -77.92 170.56 70.23 Favored 'Cis proline' 0 C--O 1.254 1.317 0 N-CA-C 108.954 -1.21 . . . . 33.28 108.954 -9.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 46.5 mt -58.58 114.89 2.69 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 105.694 -1.965 . . . . 33.21 105.694 178.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.7 tttm -55.5 138.4 46.49 Favored 'General case' 0 C--N 1.306 -1.308 0 O-C-N 125.366 1.667 . . . . 65.59 111.854 -177.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 73.77 12.35 4.46 Favored 'General case' 0 C--O 1.256 1.416 0 C-N-CA 125.842 1.657 . . . . 57.21 114.772 176.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ARG . . . . . 0.607 ' NH1' ' NE2' ' A' ' 35' ' ' GLN . 18.6 mtm180 -134.18 153.78 51.63 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 105.728 -1.953 . . . . 32.05 105.728 176.554 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 18.5 mt -84.06 114.8 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 125.961 2.038 . . . . 42.51 106.231 174.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ASN . . . . . 0.446 ' N ' ' ND1' ' A' ' 87' ' ' HIS . 0.7 OUTLIER -89.54 119.81 30.3 Favored 'General case' 0 C--O 1.255 1.354 0 O-C-N 124.541 1.151 . . . . 34.92 109.676 -178.43 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 61.2 mt -116.3 122.4 69.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-N 114.334 -1.303 . . . . 34.04 107.635 174.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 91.1 t -107.59 135.34 46.52 Favored 'Isoleucine or valine' 0 C--O 1.252 1.191 0 O-C-N 126.531 2.394 . . . . 32.05 109.507 177.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 54.2 mt -101.99 139.52 37.51 Favored 'General case' 0 C--O 1.254 1.319 0 O-C-N 125.565 1.791 . . . . 31.54 108.418 176.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 13.7 t -168.27 139.8 2.8 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 105.734 -1.951 . . . . 36.48 105.734 177.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . . . -89.23 -16.36 31.46 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 127.296 2.872 . . . . 58.08 107.045 176.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -94.54 -41.12 9.51 Favored 'General case' 0 C--O 1.258 1.513 0 N-CA-C 119.629 3.196 . . . . 48.88 119.629 -175.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.1 mt -71.45 149.72 45.62 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 118.554 0.615 . . . . 44.86 110.576 -176.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -94.12 -28.58 15.61 Favored 'General case' 0 C--O 1.257 1.456 0 O-C-N 127.412 2.945 . . . . 83.68 110.925 -179.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . . . -145.73 155.71 43.14 Favored 'General case' 0 C--O 1.246 0.875 0 O-C-N 121.888 -0.508 . . . . 60.28 110.775 176.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -54.25 137.14 59.21 Favored Pre-proline 0 N--CA 1.476 0.851 0 CA-C-N 114.854 -1.066 . . . . 48.83 108.967 178.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -62.28 153.33 70.85 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 N-CA-C 106.443 -2.176 . . . . 45.15 106.443 177.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . . . -54.4 113.95 1.47 Allowed 'General case' 0 C--N 1.305 -1.348 0 CA-C-N 112.92 -1.946 . . . . 63.63 108.984 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 103.74 -17.54 49.34 Favored Glycine 0 C--O 1.258 1.653 0 CA-C-N 113.133 -1.848 . . . . 41.19 114.235 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -81.0 148.92 29.52 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 104.8 -2.296 . . . . 36.1 104.8 -178.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HIS . . . . . 0.446 ' ND1' ' N ' ' A' ' 72' ' ' ASN . 30.8 m80 -79.5 -39.16 32.7 Favored 'General case' 0 C--O 1.268 2.033 0 O-C-N 127.125 2.766 . . . . 40.23 114.012 178.853 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -150.65 156.13 40.74 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 123.547 0.529 . . . . 53.41 109.699 -179.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.8 tp -124.33 137.13 54.52 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 102.385 -3.191 . . . . 41.77 102.385 178.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 69.5 m -134.53 151.76 51.33 Favored 'General case' 0 C--N 1.298 -1.655 1 O-C-N 129.465 4.228 . . . . 45.29 104.422 179.598 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.16 -17.33 25.06 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 127.944 3.278 . . . . 67.24 112.108 -176.827 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 88.0 p -156.5 168.89 25.98 Favored 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 106.564 -1.643 . . . . 32.86 106.564 176.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 61.0 tp -61.38 -46.37 90.47 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 128.55 3.656 . . . . 42.33 108.68 178.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASP . . . . . 0.405 ' OD2' ' NZ ' ' A' ' 127' ' ' LYS . 6.1 m-20 -50.12 -50.66 47.79 Favored 'General case' 0 C--O 1.246 0.912 0 CA-C-N 113.639 -1.619 . . . . 56.36 110.971 177.45 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -56.74 -44.62 81.87 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 125.091 1.494 . . . . 60.23 109.423 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.13 -44.18 96.3 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 114.259 -1.337 . . . . 39.57 107.57 -179.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . 0.417 49.7 mt -58.18 -50.82 72.18 Favored 'General case' 0 C--O 1.266 1.931 0 O-C-N 125.185 1.553 . . . . 44.12 110.47 -179.612 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -55.51 -47.1 76.77 Favored 'General case' 0 C--O 1.255 1.36 0 CA-C-O 122.541 1.163 . . . . 50.9 110.569 177.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 25.9 tp -50.03 -52.1 36.86 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 114.209 -1.359 . . . . 48.58 109.015 -178.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 20.4 mt -54.03 -45.94 71.71 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-N 113.426 -1.715 . . . . 56.23 110.695 -176.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -66.76 -15.92 63.89 Favored 'General case' 0 C--O 1.248 0.975 0 O-C-N 126.099 2.124 . . . . 73.78 109.729 -179.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . 0.286 0.2 OUTLIER -55.66 155.16 11.3 Favored Pre-proline 0 N--CA 1.489 1.521 0 O-C-N 124.995 1.434 . . . . 76.42 107.566 -179.678 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -57.22 -56.35 1.92 Allowed 'Trans proline' 0 C--O 1.248 0.976 0 C-N-CA 123.89 3.06 . . . . 81.5 113.262 -176.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . . . -48.15 -45.13 32.95 Favored 'General case' 0 C--O 1.248 1.008 0 CA-C-N 114.837 -1.074 . . . . 85.68 111.511 179.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LEU . . . . . 0.421 ' O ' ' N ' ' A' ' 108' ' ' LYS . 4.1 mt -83.02 -51.99 7.06 Favored 'General case' 0 C--O 1.24 0.6 0 O-C-N 123.857 0.723 . . . . 79.0 112.204 -177.53 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . . . -36.12 -48.06 0.59 Allowed 'General case' 0 C--O 1.25 1.108 0 O-C-N 125.11 1.506 . . . . 72.58 111.624 -176.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 19.2 p -81.81 -16.49 50.74 Favored 'General case' 0 C--O 1.263 1.768 0 O-C-N 124.776 1.298 . . . . 70.22 114.116 -177.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . 0.421 ' N ' ' O ' ' A' ' 105' ' ' LEU . . . -93.15 -17.46 23.73 Favored 'General case' 0 C--O 1.254 1.298 0 N-CA-C 113.778 1.029 . . . . 56.67 113.778 -177.515 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 77.3 t -109.2 135.35 48.38 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.006 0 N-CA-C 117.185 2.291 . . . . 47.45 117.185 -173.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -92.44 -85.44 0.26 Allowed 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 114.752 -1.113 . . . . 42.88 108.627 176.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' MET . . . . . 0.681 ' CE ' ' O ' ' A' ' 40' ' ' THR . 7.9 mtm -107.26 146.8 31.02 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.501 0.72 . . . . 49.48 111.783 -175.59 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 43.1 t -103.38 126.68 57.75 Favored 'Isoleucine or valine' 0 C--O 1.242 0.663 0 C-N-CA 125.005 1.322 . . . . 31.54 108.673 176.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -120.5 133.06 55.46 Favored 'General case' 0 C--O 1.257 1.492 0 O-C-N 126.855 2.597 . . . . 30.79 108.679 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 49.0 mm -100.25 119.72 48.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 O-C-N 127.421 2.951 . . . . 30.38 104.688 178.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . 0.341 12.8 m -112.05 17.74 7.64 Favored 'Isoleucine or valine' 0 C--O 1.268 2.037 0 O-C-N 127.964 3.29 . . . . 26.76 115.031 -178.145 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 88.56 -176.03 44.42 Favored Glycine 0 C--O 1.26 1.727 0 O-C-N 124.413 1.07 . . . . 24.27 113.74 173.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -81.27 -154.06 11.04 Favored Glycine 0 N--CA 1.429 -1.797 1 C-N-CA 131.689 4.471 . . . . 25.21 114.996 3.388 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 62.9 m -39.0 -65.89 0.33 Allowed 'General case' 0 C--O 1.252 1.234 0 C-N-CA 127.481 2.312 . . . . 29.43 114.486 -174.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -57.23 -35.19 69.38 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 125.716 1.885 . . . . 29.01 111.453 -178.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 41.6 t -68.72 -45.75 80.71 Favored 'Isoleucine or valine' 0 C--O 1.253 1.251 0 CA-C-O 121.96 0.886 . . . . 27.36 112.309 -179.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -59.4 -48.0 83.29 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.961 -1.018 . . . . 28.03 108.48 179.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 44.5 tttm -56.19 -51.14 69.11 Favored 'General case' 0 C--O 1.246 0.88 0 O-C-N 125.443 1.715 . . . . 65.96 113.024 -176.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -56.68 -46.11 81.36 Favored 'General case' 0 C--O 1.246 0.889 0 CA-C-N 113.869 -1.514 . . . . 32.09 110.723 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.6 -36.59 84.18 Favored 'General case' 0 C--O 1.251 1.137 0 O-C-N 123.561 0.538 . . . . 32.14 110.418 -178.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . 0.274 68.5 mtm -67.66 -30.14 69.61 Favored 'General case' 0 C--O 1.251 1.184 0 O-C-N 125.149 1.531 . . . . 56.82 113.449 -178.775 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -78.43 -21.71 48.78 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 113.889 1.07 . . . . 59.86 113.889 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LYS . . . . . 0.405 ' NZ ' ' OD2' ' A' ' 94' ' ' ASP . 25.9 mmtp -63.68 130.76 94.58 Favored Pre-proline 0 C--N 1.31 -1.121 0 N-CA-C 108.043 -1.095 . . . . 64.74 108.043 178.839 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -78.07 67.08 8.2 Favored 'Trans proline' 0 C--O 1.245 0.83 0 O-C-N 124.988 2.046 . . . . 46.04 107.951 179.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ILE . . . . . 0.498 ' C ' ' CG2' ' A' ' 186' ' ' VAL . 0.1 OUTLIER -139.36 151.67 23.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-N 113.44 -1.709 . . . . 47.15 109.586 179.353 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -53.98 129.87 35.67 Favored 'General case' 0 C--O 1.253 1.279 0 O-C-N 125.785 1.928 . . . . 52.48 106.019 175.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 -150.9 133.59 15.72 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 112.869 -1.969 . . . . 34.44 109.304 -173.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 33.9 mtm-85 -114.83 129.12 56.64 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 107.09 -1.448 . . . . 69.85 107.09 175.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 29.9 tp -115.26 118.57 33.66 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 112.615 -2.084 . . . . 28.06 107.667 -177.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -103.89 113.16 26.5 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 126.4 2.313 . . . . 33.23 105.657 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 30.1 t -115.55 129.96 70.97 Favored 'Isoleucine or valine' 0 C--O 1.253 1.284 0 O-C-N 127.083 2.739 . . . . 30.35 113.456 -179.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 29.3 m -103.4 114.5 28.83 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 105.776 -1.935 . . . . 28.07 105.776 169.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' ARG . . . . . 0.415 ' NH2' ' O ' ' A' ' 622' ' ' HOH . 6.5 mmt180 -91.99 109.64 20.99 Favored 'General case' 0 C--O 1.257 1.462 0 O-C-N 125.998 2.061 . . . . 44.47 109.224 -179.934 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 75.7 mt -90.38 114.97 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 126.687 2.492 . . . . 29.29 105.671 178.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' LEU . . . . . 0.586 ' C ' ' CD2' ' A' ' 140' ' ' HIS . 39.8 mt -75.46 48.64 0.45 Allowed 'General case' 0 C--O 1.257 1.465 0 CA-C-N 113.249 -1.796 . . . . 31.65 115.043 -173.029 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HIS . . . . . 0.586 ' CD2' ' C ' ' A' ' 139' ' ' LEU . 36.3 m-70 -158.54 164.22 36.31 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 105.566 -2.013 . . . . 46.14 105.566 -179.785 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -111.09 142.0 43.83 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 125.694 1.871 . . . . 70.3 108.726 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -138.21 143.42 40.17 Favored 'General case' 0 C--O 1.261 1.678 0 O-C-N 126.544 2.403 . . . . 45.24 104.666 178.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -61.17 127.37 31.18 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 127.519 3.012 . . . . 84.47 107.935 176.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' SER . . . . . 0.553 ' N ' ' O ' ' A' ' 623' ' ' HOH . 4.3 m -131.58 153.08 50.26 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 113.751 -1.568 . . . . 32.27 109.082 -178.442 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 25.1 p30 -120.59 -3.79 9.82 Favored 'General case' 0 C--N 1.315 -0.932 0 O-C-N 125.091 1.494 . . . . 40.58 108.541 176.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 32.6 m -132.81 139.02 47.31 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 125.752 1.908 . . . . 33.27 107.639 -179.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -130.71 157.11 43.7 Favored 'General case' 0 CA--C 1.511 -0.553 0 O-C-N 126.32 2.262 . . . . 31.87 115.828 -175.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -77.44 134.7 66.0 Favored Pre-proline 0 C--O 1.253 1.261 0 CA-C-N 110.939 -2.846 . . . . 27.83 106.459 176.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -62.03 164.85 15.76 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 O-C-N 124.82 1.958 . . . . 32.41 107.935 177.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -74.25 134.03 42.65 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 123.578 0.751 . . . . 62.33 110.876 177.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -97.9 135.57 31.98 Favored 'Isoleucine or valine' 0 C--O 1.253 1.282 0 N-CA-C 109.182 -0.673 . . . . 48.38 109.182 179.781 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -75.95 98.41 4.24 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 108.795 -0.817 . . . . 43.85 108.795 176.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . 0.264 16.4 m-30 -60.67 -15.36 27.92 Favored 'General case' 0 C--O 1.258 1.546 0 O-C-N 126.031 2.082 . . . . 40.62 112.42 -179.006 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 8.8 mtmm -81.39 -25.84 35.93 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 125.033 1.458 . . . . 45.59 112.179 176.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -93.48 -48.26 6.47 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 125.208 1.403 . . . . 52.56 111.734 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -93.02 105.64 17.71 Favored 'General case' 0 C--O 1.259 1.589 0 O-C-N 126.469 2.356 . . . . 36.86 108.34 -176.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -92.02 128.03 37.71 Favored 'General case' 0 C--N 1.308 -1.217 0 O-C-N 123.704 0.627 . . . . 68.13 109.556 177.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 28.4 tp -68.25 126.13 28.6 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 115.823 -2.037 . . . . 42.13 106.67 178.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 52.5 mt -80.83 152.45 28.21 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 126.708 2.505 . . . . 48.43 105.712 176.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 27.4 p -95.46 -9.31 32.95 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 125.349 1.655 . . . . 59.73 109.336 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' GLU . . . . . 0.468 ' CG ' ' N ' ' A' ' 162' ' ' TYR . 10.8 tt0 -162.53 149.14 13.06 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 124.684 1.194 . . . . 80.21 110.465 178.877 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' TYR . . . . . 0.468 ' N ' ' CG ' ' A' ' 161' ' ' GLU . 35.1 t80 -153.12 133.7 7.86 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 113.217 -1.811 . . . . 49.41 108.564 176.801 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -53.31 109.13 0.32 Allowed 'Trans proline' 0 N--CA 1.448 -1.164 0 O-C-N 127.176 3.198 . . . . 54.96 114.614 178.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 91.34 10.16 62.49 Favored Glycine 0 C--O 1.262 1.852 0 CA-C-N 113.722 -1.581 . . . . 63.27 114.474 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 45.7 t -116.55 114.68 40.05 Favored Pre-proline 0 N--CA 1.477 0.895 0 N-CA-C 106.437 -1.69 . . . . 53.15 106.437 177.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.66 146.29 95.76 Favored 'Trans proline' 0 C--N 1.321 -0.918 0 O-C-N 125.668 2.404 . . . . 45.89 107.742 -177.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' ALA . . . . . . . . . . . . . . . -90.27 -40.38 12.18 Favored 'General case' 0 C--O 1.253 1.274 0 O-C-N 124.679 1.237 . . . . 56.13 113.419 -177.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -62.98 165.73 6.56 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 122.952 1.358 . . . . 75.99 111.594 -175.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' ILE . . . . . . . . . . . . . 11.0 mt -75.89 130.17 36.42 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 CA-C-N 111.196 -2.729 . . . . 46.52 105.021 171.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' GLN . . . . . . . . . . . . . 57.0 mm-40 -97.62 155.05 17.16 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 112.801 -2.0 . . . . 52.91 106.085 179.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -141.57 146.26 36.07 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 125.132 1.52 . . . . 64.09 107.503 177.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -169.23 135.06 1.61 Allowed 'General case' 0 C--N 1.302 -1.461 0 O-C-N 126.57 2.419 . . . . 56.88 105.454 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 53.81 37.21 25.9 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 115.477 -2.201 . . . . 48.64 109.574 -177.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . 70.91 9.44 66.17 Favored Glycine 0 C--O 1.262 1.893 0 O-C-N 126.506 2.379 . . . . 29.68 113.129 177.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' ILE . . . . . . . . . . . . . 30.9 mm -111.37 140.22 31.77 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.271 0 N-CA-C 108.249 -1.019 . . . . 41.32 108.249 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -107.79 150.08 27.44 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 124.474 1.109 . . . . 31.69 109.746 176.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 44.6 p90 -155.04 166.54 33.25 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 106.674 -1.602 . . . . 41.89 106.674 175.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' LYS . . . . . 0.674 ' NZ ' ' OE2' ' A' ' 180' ' ' GLU . 2.7 pttt -137.19 145.97 44.34 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 126.361 2.288 . . . . 73.88 110.268 175.493 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -92.89 141.42 28.44 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-N 112.173 -2.285 . . . . 35.54 106.667 175.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' GLU . . . . . 0.674 ' OE2' ' NZ ' ' A' ' 178' ' ' LYS . 75.8 mt-10 -145.4 144.24 30.54 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 104.832 -2.284 . . . . 43.2 104.832 179.719 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' VAL . . . . . . . . . . . . . 6.7 t -123.78 126.71 73.15 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.28 0 O-C-N 127.595 3.059 . . . . 29.72 106.181 177.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -114.54 146.0 41.27 Favored 'General case' 0 C--N 1.312 -1.059 0 O-C-N 126.849 2.593 . . . . 30.69 106.69 175.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -135.68 132.5 37.04 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 128.212 3.445 . . . . 56.4 112.682 -175.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 21.3 tttt -117.83 123.44 45.92 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 112.902 -1.954 . . . . 39.83 107.357 177.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 9.3 m -105.64 118.41 36.5 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 113.145 -1.843 . . . . 56.93 110.043 -179.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' VAL . . . . . 0.498 ' CG2' ' C ' ' A' ' 129' ' ' ILE . 2.1 t . . . . . 0 C--O 1.268 2.033 0 CA-C-O 113.527 -3.13 . . . . 67.64 108.75 179.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' TAP . . . . . 0.464 ' O1X' ' NZ ' ' A' ' 54' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 279' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 295' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 367' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 383' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 392' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 393' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 604' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 605' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 606' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 607' ' ' HOH . . . . . 0.464 ' O ' ' NZ ' ' A' ' 18' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 610' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 611' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 612' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 613' ' ' HOH . . . . . 0.57 ' O ' ' NZ ' ' A' ' 55' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 615' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 622' ' ' HOH . . . . . 0.415 ' O ' ' NH2' ' A' ' 137' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 623' ' ' HOH . . . . . 0.553 ' O ' ' N ' ' A' ' 144' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 625' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 630' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 637' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 644' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 647' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 648' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 652' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 653' ' ' HOH . . . . . 1.077 ' O ' ' N ' ' A' ' 43' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 655' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 677' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 731' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 732' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 734' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 736' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 737' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 743' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 746' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 749' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 750' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 758' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' VAL . . . . . 0.586 HG12 ' OD1' ' A' ' 101' ' ' ASP . 3.0 m . . . . . 0 N--CA 1.481 1.104 0 N-CA-C 108.451 -0.944 . . . . 70.89 108.451 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . . . -53.87 -50.94 65.16 Favored 'General case' 0 C--O 1.254 1.337 0 N-CA-C 114.353 1.242 . . . . 68.96 114.353 -177.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' SER . . . . . 0.705 ' HA ' ' CD1' ' A' ' 129' ' ' ILE . 97.3 p -160.37 164.48 32.39 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.674 0.749 . . . . 55.44 112.095 -175.278 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' A' ' 131' ' ' HIS . 86.6 mt -118.03 159.61 22.9 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 113.928 -1.487 . . . . 40.38 107.135 178.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -133.94 137.94 45.17 Favored 'General case' 0 C--N 1.29 -1.979 0 O-C-N 129.055 3.972 . . . . 31.11 104.739 173.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 28.7 m -131.11 141.1 50.1 Favored 'General case' 0 C--N 1.291 -1.941 0 O-C-N 128.105 3.378 . . . . 25.93 102.89 177.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 15.3 tt -133.06 136.62 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 1 O-C-N 129.615 4.322 . . . . 23.84 106.087 179.01 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.8 p -154.73 156.94 4.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 O-C-N 126.688 2.492 . . . . 24.73 107.924 179.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -117.55 133.81 55.55 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 126.865 2.603 . . . . 25.43 104.879 170.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . 0.67 HG12 HG22 ' A' ' 16' ' ' ILE . 33.3 m -135.46 146.39 30.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 C-N-CA 123.621 0.769 . . . . 29.61 109.966 -179.254 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' CYS . . . . . 0.519 ' HB2' ' O ' ' A' ' 140' ' ' HIS . 27.2 p -97.08 -179.24 4.47 Favored 'General case' 0 C--O 1.256 1.418 0 O-C-N 126.036 2.085 . . . . 36.9 107.998 175.169 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.438 11.4 mt-30 -54.47 -33.36 59.53 Favored 'General case' 0 C--O 1.257 1.48 0 N-CA-C 115.312 1.597 . . . . 60.66 115.312 -172.76 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -88.53 9.71 22.87 Favored 'General case' 0 C--O 1.256 1.434 0 CA-C-O 117.051 -1.452 . . . . 51.71 112.732 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 74.4 mmm 71.75 17.09 5.53 Favored 'General case' 0 C--O 1.249 1.078 0 C-N-CA 124.456 1.102 . . . . 45.95 113.243 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -80.02 146.85 28.42 Favored Glycine 0 N--CA 1.515 3.933 0 N-CA-C 107.057 -2.417 . . . . 27.72 107.057 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ILE . . . . . 0.674 ' O ' ' H2N' ' A' ' 191' ' ' TAP . 38.4 pt -127.12 -3.53 4.38 Favored 'Isoleucine or valine' 0 C--O 1.251 1.148 0 O-C-N 124.36 0.683 . . . . 27.65 111.091 177.854 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -165.1 162.4 35.66 Favored Glycine 0 C--O 1.266 2.123 0 N-CA-C 117.646 1.818 . . . . 28.17 117.646 -178.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . 0.542 ' HD3' ' HG3' ' A' ' 143' ' ' GLU . 1.1 tptt -160.02 127.22 4.51 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 114.199 -1.001 . . . . 54.28 109.636 -179.594 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 50.58 42.47 26.87 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 124.617 1.198 . . . . 55.76 111.076 176.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 75.79 12.93 83.53 Favored Glycine 0 C--O 1.25 1.109 0 CA-C-O 119.192 -0.782 . . . . 42.57 112.251 175.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . 0.524 ' CG ' ' H ' ' A' ' 22' ' ' LEU . 63.9 t30 -141.48 -171.73 3.37 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 116.86 -1.543 . . . . 71.76 109.419 177.147 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LEU . . . . . 0.524 ' H ' ' CG ' ' A' ' 21' ' ' ASN . 40.5 mt -78.49 149.75 75.58 Favored Pre-proline 0 C--N 1.304 -1.386 0 O-C-N 126.977 2.673 . . . . 31.78 107.183 176.132 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 22' ' ' LEU . 18.7 Cg_exo -72.66 -23.46 19.54 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 O-C-N 126.39 2.784 . . . . 30.69 112.433 -178.033 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 22.2 p90 -112.47 161.05 28.07 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 125.298 1.624 . . . . 33.71 108.339 -177.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -68.89 170.07 16.34 Favored 'Trans proline' 0 C--N 1.321 -0.9 0 N-CA-C 106.338 -2.216 . . . . 30.44 106.338 178.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -61.35 134.26 50.87 Favored 'Trans proline' 0 CA--C 1.509 -0.754 0 C-N-CA 122.087 1.858 . . . . 35.62 114.726 -174.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 58.3 mt -119.71 113.75 21.12 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.541 1.936 . . . . 37.74 106.244 173.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . . . -60.67 -54.55 43.88 Favored 'General case' 0 C--O 1.261 1.663 0 CA-C-O 123.907 1.813 . . . . 64.47 113.895 -175.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASN . . . . . 0.832 ' HA ' ' HZ2' ' A' ' 32' ' ' LYS 0.367 51.9 m-80 -58.75 -40.76 84.81 Favored 'General case' 0 C--O 1.255 1.362 0 CA-C-N 113.487 -1.688 . . . . 61.98 112.442 -178.164 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . 0.426 ' O ' ' HB3' ' A' ' 33' ' ' TYR . 6.0 tm-20 -67.67 -38.36 83.64 Favored 'General case' 0 C--O 1.256 1.444 0 C-N-CA 119.023 -1.071 . . . . 64.04 109.684 179.436 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -63.16 -49.48 74.15 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 123.553 0.741 . . . . 64.58 111.574 179.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LYS . . . . . 0.832 ' HZ2' ' HA ' ' A' ' 29' ' ' ASN . 4.0 mtmp? -56.26 -38.88 71.74 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 107.778 -1.193 . . . . 64.07 107.778 -179.704 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' TYR . . . . . 0.455 ' O ' ' HG2' ' A' ' 37' ' ' MET . 84.9 t80 -58.9 -46.14 88.61 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 123.819 1.771 . . . . 47.94 110.108 -177.026 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -65.26 -42.46 93.21 Favored 'General case' 0 C--O 1.252 1.219 0 CA-C-N 111.8 -2.455 . . . . 33.13 109.708 -177.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLN . . . . . 0.557 ' HA ' ' OE1' ' A' ' 35' ' ' GLN . 14.2 mm100 -63.43 -49.71 72.64 Favored 'General case' 0 C--O 1.261 1.69 0 CA-C-O 122.778 1.275 . . . . 61.2 110.487 179.869 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . . . -60.54 -49.55 77.11 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 114.281 -1.327 . . . . 58.06 111.381 -178.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' MET . . . . . 0.455 ' HG2' ' O ' ' A' ' 33' ' ' TYR . 94.1 mmm -60.95 -46.45 90.67 Favored 'General case' 0 C--O 1.245 0.831 0 N-CA-C 112.567 0.58 . . . . 44.79 112.567 -179.638 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 75.8 p -79.5 -26.91 41.48 Favored 'General case' 0 C--O 1.256 1.44 0 N-CA-C 114.35 1.241 . . . . 29.62 114.35 -174.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.7 m -84.86 -33.66 22.79 Favored 'General case' 0 C--O 1.261 1.673 0 N-CA-C 116.023 1.861 . . . . 43.7 116.023 -178.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . 0.681 ' O ' ' CE ' ' A' ' 111' ' ' MET . 30.2 m -70.16 117.14 11.34 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 115.495 1.665 . . . . 39.22 115.495 -177.367 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 30.9 t -104.16 145.38 30.29 Favored 'General case' 0 C--O 1.25 1.121 0 C-N-CA 125.637 1.575 . . . . 55.55 108.749 175.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' HIS . . . . . 0.696 ' C ' ' O ' ' A' ' 653' ' ' HOH . 71.8 m-70 -104.45 39.04 1.74 Allowed 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 109.613 -0.514 . . . . 70.81 109.613 -178.554 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . 1.077 ' N ' ' O ' ' A' ' 653' ' ' HOH . 18.1 t -163.42 123.38 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 O-C-N 124.883 1.364 . . . . 62.3 108.518 -177.331 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . 0.34 17.8 pt-20 -68.13 140.22 56.18 Favored 'General case' 0 C--O 1.248 0.995 0 CA-C-O 123.031 1.395 . . . . 88.25 110.556 -179.989 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.16 3.35 88.96 Favored Glycine 0 C--O 1.248 0.969 0 CA-C-N 113.075 -1.875 . . . . 65.96 111.19 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . 0.812 ' HD2' HG11 ' A' ' 43' ' ' VAL . 35.6 mttt -119.6 161.41 20.69 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 124.933 1.019 . . . . 58.51 111.078 178.872 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 69' ' ' ASP . 4.1 mt-30 -134.56 161.99 33.53 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 124.216 0.948 . . . . 62.14 108.464 179.391 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -86.46 155.66 20.45 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 125.09 1.494 . . . . 36.64 108.995 176.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -111.51 135.83 51.53 Favored 'General case' 0 C--O 1.252 1.218 0 O-C-N 127.021 2.701 . . . . 33.82 107.569 175.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 23.2 m -114.99 133.43 61.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 114.211 -1.359 . . . . 30.84 107.635 175.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 31.2 mt -115.4 135.25 56.01 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 O-C-N 125.426 1.704 . . . . 29.29 108.989 176.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 14.5 ptp -152.95 158.72 42.51 Favored 'General case' 0 C--O 1.238 0.491 0 O-C-N 126.283 2.239 . . . . 29.05 111.315 -178.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.72 168.87 54.49 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-N 111.318 -2.674 . . . . 29.44 108.493 179.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.8 ttpt -59.85 -47.5 85.48 Favored 'General case' 0 C--O 1.261 1.7 0 O-C-N 125.558 1.387 . . . . 31.14 112.382 -178.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LYS . . . . . 0.57 ' NZ ' ' O ' ' A' ' 613' ' ' HOH 0.25 28.6 mtpt -62.39 -41.93 99.03 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 115.121 -0.945 . . . . 53.96 109.171 -175.627 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 56' ' ' THR . . . . . 0.442 ' OG1' ' H6N' ' A' ' 191' ' ' TAP . 53.6 m -61.29 -47.62 85.15 Favored 'General case' 0 C--O 1.271 2.233 0 CA-C-N 113.506 -1.679 . . . . 27.79 111.259 -179.125 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' TRP . . . . . 0.477 ' CE2' ' HD3' ' A' ' 65' ' ' ARG . 45.0 t-105 -55.42 -47.16 76.36 Favored 'General case' 0 N--CA 1.485 1.32 0 CA-C-O 122.393 1.092 . . . . 30.32 109.988 179.034 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . 0.321 69.0 m-85 -69.13 -18.13 63.92 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-O 118.117 -0.945 . . . . 31.74 112.522 -178.19 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.4 p -76.73 -15.03 59.88 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 124.529 1.143 . . . . 34.67 110.41 -179.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 21.4 mt -83.93 130.67 54.18 Favored Pre-proline 0 N--CA 1.49 1.573 0 N-CA-C 106.722 -1.585 . . . . 35.24 106.722 -178.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -53.23 132.62 48.98 Favored 'Trans proline' 0 N--CA 1.488 1.175 0 O-C-N 127.241 3.232 . . . . 32.61 106.286 178.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -48.89 -41.8 34.69 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 125.761 1.624 . . . . 70.51 114.253 -174.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . 0.505 ' HD3' ' N ' ' A' ' 63' ' ' LYS . 0.5 OUTLIER -69.38 -19.9 63.82 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-N 115.95 -0.568 . . . . 52.51 111.732 -179.628 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -92.54 11.54 26.09 Favored 'General case' 0 C--O 1.259 1.571 0 CA-C-O 118.562 -0.732 . . . . 50.4 111.945 179.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ARG . . . . . 0.477 ' HD3' ' CE2' ' A' ' 57' ' ' TRP . 48.1 mtt180 -108.7 147.7 36.3 Favored Pre-proline 0 N--CA 1.475 0.808 0 CA-C-N 119.104 0.865 . . . . 40.71 112.043 -179.221 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -77.92 170.56 70.23 Favored 'Cis proline' 0 C--O 1.254 1.317 0 N-CA-C 108.954 -1.21 . . . . 33.28 108.954 -9.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 46.5 mt -58.58 114.89 2.69 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 105.694 -1.965 . . . . 33.21 105.694 178.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LYS . . . . . 0.414 ' HG2' ' OD2' ' A' ' 69' ' ' ASP . 12.7 tttm -55.5 138.4 46.49 Favored 'General case' 0 C--N 1.306 -1.308 0 O-C-N 125.366 1.667 . . . . 65.59 111.854 -177.333 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ASP . . . . . 0.49 ' O ' ' HG2' ' A' ' 47' ' ' GLN . 65.1 m-20 73.77 12.35 4.46 Favored 'General case' 0 C--O 1.256 1.416 0 C-N-CA 125.842 1.657 . . . . 57.21 114.772 176.378 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -134.18 153.78 51.63 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 105.728 -1.953 . . . . 32.05 105.728 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ILE . . . . . 0.556 HD12 HG22 ' A' ' 109' ' ' VAL . 18.5 mt -84.06 114.8 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 125.961 2.038 . . . . 42.51 106.231 174.182 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ASN . . . . . 0.531 HD22 ' N ' ' A' ' 72' ' ' ASN . 0.7 OUTLIER -89.54 119.81 30.3 Favored 'General case' 0 C--O 1.255 1.354 0 O-C-N 124.541 1.151 . . . . 34.92 109.676 -178.43 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 61.2 mt -116.3 122.4 69.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-N 114.334 -1.303 . . . . 34.04 107.635 174.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 91.1 t -107.59 135.34 46.52 Favored 'Isoleucine or valine' 0 C--O 1.252 1.191 0 O-C-N 126.531 2.394 . . . . 32.05 109.507 177.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . 0.423 ' HA ' ' O ' ' A' ' 90' ' ' SER . 54.2 mt -101.99 139.52 37.51 Favored 'General case' 0 C--O 1.254 1.319 0 O-C-N 125.565 1.791 . . . . 31.54 108.418 176.803 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 13.7 t -168.27 139.8 2.8 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 105.734 -1.951 . . . . 36.48 105.734 177.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . . . -89.23 -16.36 31.46 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 127.296 2.872 . . . . 58.08 107.045 176.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -94.54 -41.12 9.51 Favored 'General case' 0 C--O 1.258 1.513 0 N-CA-C 119.629 3.196 . . . . 48.88 119.629 -175.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.1 mt -71.45 149.72 45.62 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 118.554 0.615 . . . . 44.86 110.576 -176.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -94.12 -28.58 15.61 Favored 'General case' 0 C--O 1.257 1.456 0 O-C-N 127.412 2.945 . . . . 83.68 110.925 -179.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . . . -145.73 155.71 43.14 Favored 'General case' 0 C--O 1.246 0.875 0 O-C-N 121.888 -0.508 . . . . 60.28 110.775 176.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -54.25 137.14 59.21 Favored Pre-proline 0 N--CA 1.476 0.851 0 CA-C-N 114.854 -1.066 . . . . 48.83 108.967 178.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -62.28 153.33 70.85 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 N-CA-C 106.443 -2.176 . . . . 45.15 106.443 177.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . . . -54.4 113.95 1.47 Allowed 'General case' 0 C--N 1.305 -1.348 0 CA-C-N 112.92 -1.946 . . . . 63.63 108.984 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 103.74 -17.54 49.34 Favored Glycine 0 C--O 1.258 1.653 0 CA-C-N 113.133 -1.848 . . . . 41.19 114.235 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -81.0 148.92 29.52 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 104.8 -2.296 . . . . 36.1 104.8 -178.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 30.8 m80 -79.5 -39.16 32.7 Favored 'General case' 0 C--O 1.268 2.033 0 O-C-N 127.125 2.766 . . . . 40.23 114.012 178.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -150.65 156.13 40.74 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 123.547 0.529 . . . . 53.41 109.699 -179.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.8 tp -124.33 137.13 54.52 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 102.385 -3.191 . . . . 41.77 102.385 178.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . 0.423 ' O ' ' HA ' ' A' ' 75' ' ' LEU . 69.5 m -134.53 151.76 51.33 Favored 'General case' 0 C--N 1.298 -1.655 1 O-C-N 129.465 4.228 . . . . 45.29 104.422 179.598 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 279' ' ' HOH . 0.2 OUTLIER -92.16 -17.33 25.06 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 127.944 3.278 . . . . 67.24 112.108 -176.827 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 88.0 p -156.5 168.89 25.98 Favored 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 106.564 -1.643 . . . . 32.86 106.564 176.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 61.0 tp -61.38 -46.37 90.47 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 128.55 3.656 . . . . 42.33 108.68 178.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -50.12 -50.66 47.79 Favored 'General case' 0 C--O 1.246 0.912 0 CA-C-N 113.639 -1.619 . . . . 56.36 110.971 177.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -56.74 -44.62 81.87 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 125.091 1.494 . . . . 60.23 109.423 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.13 -44.18 96.3 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 114.259 -1.337 . . . . 39.57 107.57 -179.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . 0.417 49.7 mt -58.18 -50.82 72.18 Favored 'General case' 0 C--O 1.266 1.931 0 O-C-N 125.185 1.553 . . . . 44.12 110.47 -179.612 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -55.51 -47.1 76.77 Favored 'General case' 0 C--O 1.255 1.36 0 CA-C-O 122.541 1.163 . . . . 50.9 110.569 177.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 102' ' ' SER . 25.9 tp -50.03 -52.1 36.86 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 114.209 -1.359 . . . . 48.58 109.015 -178.465 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LEU . . . . . 0.417 HD13 ' CG2' ' A' ' 112' ' ' VAL . 20.4 mt -54.03 -45.94 71.71 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-N 113.426 -1.715 . . . . 56.23 110.695 -176.707 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASP . . . . . 0.586 ' OD1' HG12 ' A' ' 1' ' ' VAL . 82.5 m-20 -66.76 -15.92 63.89 Favored 'General case' 0 C--O 1.248 0.975 0 O-C-N 126.099 2.124 . . . . 73.78 109.729 -179.309 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' SER . . . . . 0.4 ' HB3' ' O ' ' A' ' 99' ' ' LEU 0.286 0.2 OUTLIER -55.66 155.16 11.3 Favored Pre-proline 0 N--CA 1.489 1.521 0 O-C-N 124.995 1.434 . . . . 76.42 107.566 -179.678 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -57.22 -56.35 1.92 Allowed 'Trans proline' 0 C--O 1.248 0.976 0 C-N-CA 123.89 3.06 . . . . 81.5 113.262 -176.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . . . -48.15 -45.13 32.95 Favored 'General case' 0 C--O 1.248 1.008 0 CA-C-N 114.837 -1.074 . . . . 85.68 111.511 179.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LEU . . . . . 0.401 ' O ' ' N ' ' A' ' 108' ' ' LYS . 4.1 mt -83.02 -51.99 7.06 Favored 'General case' 0 C--O 1.24 0.6 0 O-C-N 123.857 0.723 . . . . 79.0 112.204 -177.53 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . . . -36.12 -48.06 0.59 Allowed 'General case' 0 C--O 1.25 1.108 0 O-C-N 125.11 1.506 . . . . 72.58 111.624 -176.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 19.2 p -81.81 -16.49 50.74 Favored 'General case' 0 C--O 1.263 1.768 0 O-C-N 124.776 1.298 . . . . 70.22 114.116 -177.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' A' ' 105' ' ' LEU . . . -93.15 -17.46 23.73 Favored 'General case' 0 C--O 1.254 1.298 0 N-CA-C 113.778 1.029 . . . . 56.67 113.778 -177.515 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . 0.556 HG22 HD12 ' A' ' 71' ' ' ILE . 77.3 t -109.2 135.35 48.38 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.006 0 N-CA-C 117.185 2.291 . . . . 47.45 117.185 -173.152 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -92.44 -85.44 0.26 Allowed 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 114.752 -1.113 . . . . 42.88 108.627 176.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' MET . . . . . 0.681 ' CE ' ' O ' ' A' ' 40' ' ' THR . 7.9 mtm -107.26 146.8 31.02 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.501 0.72 . . . . 49.48 111.783 -175.59 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' VAL . . . . . 0.417 ' CG2' HD13 ' A' ' 100' ' ' LEU . 43.1 t -103.38 126.68 57.75 Favored 'Isoleucine or valine' 0 C--O 1.242 0.663 0 C-N-CA 125.005 1.322 . . . . 31.54 108.673 176.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -120.5 133.06 55.46 Favored 'General case' 0 C--O 1.257 1.492 0 O-C-N 126.855 2.597 . . . . 30.79 108.679 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 49.0 mm -100.25 119.72 48.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 O-C-N 127.421 2.951 . . . . 30.38 104.688 178.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . 0.341 12.8 m -112.05 17.74 7.64 Favored 'Isoleucine or valine' 0 C--O 1.268 2.037 0 O-C-N 127.964 3.29 . . . . 26.76 115.031 -178.145 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 88.56 -176.03 44.42 Favored Glycine 0 C--O 1.26 1.727 0 O-C-N 124.413 1.07 . . . . 24.27 113.74 173.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -81.27 -154.06 11.04 Favored Glycine 0 N--CA 1.429 -1.797 1 C-N-CA 131.689 4.471 . . . . 25.21 114.996 3.388 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 62.9 m -39.0 -65.89 0.33 Allowed 'General case' 0 C--O 1.252 1.234 0 C-N-CA 127.481 2.312 . . . . 29.43 114.486 -174.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -57.23 -35.19 69.38 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 125.716 1.885 . . . . 29.01 111.453 -178.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 41.6 t -68.72 -45.75 80.71 Favored 'Isoleucine or valine' 0 C--O 1.253 1.251 0 CA-C-O 121.96 0.886 . . . . 27.36 112.309 -179.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -59.4 -48.0 83.29 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.961 -1.018 . . . . 28.03 108.48 179.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 44.5 tttm -56.19 -51.14 69.11 Favored 'General case' 0 C--O 1.246 0.88 0 O-C-N 125.443 1.715 . . . . 65.96 113.024 -176.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -56.68 -46.11 81.36 Favored 'General case' 0 C--O 1.246 0.889 0 CA-C-N 113.869 -1.514 . . . . 32.09 110.723 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.6 -36.59 84.18 Favored 'General case' 0 C--O 1.251 1.137 0 O-C-N 123.561 0.538 . . . . 32.14 110.418 -178.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . 0.274 68.5 mtm -67.66 -30.14 69.61 Favored 'General case' 0 C--O 1.251 1.184 0 O-C-N 125.149 1.531 . . . . 56.82 113.449 -178.775 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -78.43 -21.71 48.78 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 113.889 1.07 . . . . 59.86 113.889 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LYS . . . . . 0.61 ' HB3' HG23 ' A' ' 129' ' ' ILE . 25.9 mmtp -63.68 130.76 94.58 Favored Pre-proline 0 C--N 1.31 -1.121 0 N-CA-C 108.043 -1.095 . . . . 64.74 108.043 178.839 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' PRO . . . . . 0.436 ' O ' HG11 ' A' ' 186' ' ' VAL . 61.7 Cg_endo -78.07 67.08 8.2 Favored 'Trans proline' 0 C--O 1.245 0.83 0 O-C-N 124.988 2.046 . . . . 46.04 107.951 179.09 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ILE . . . . . 0.705 ' CD1' ' HA ' ' A' ' 3' ' ' SER . 0.1 OUTLIER -139.36 151.67 23.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-N 113.44 -1.709 . . . . 47.15 109.586 179.353 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ASN . . . . . 0.465 ' O ' HG13 ' A' ' 129' ' ' ILE . 3.3 m120 -53.98 129.87 35.67 Favored 'General case' 0 C--O 1.253 1.279 0 O-C-N 125.785 1.928 . . . . 52.48 106.019 175.874 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HIS . . . . . 0.438 ' HA ' ' O ' ' A' ' 4' ' ' LEU . 4.1 t-160 -150.9 133.59 15.72 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 112.869 -1.969 . . . . 34.44 109.304 -173.201 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 33.9 mtm-85 -114.83 129.12 56.64 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 107.09 -1.448 . . . . 69.85 107.09 175.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 29.9 tp -115.26 118.57 33.66 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 112.615 -2.084 . . . . 28.06 107.667 -177.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -103.89 113.16 26.5 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 126.4 2.313 . . . . 33.23 105.657 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 30.1 t -115.55 129.96 70.97 Favored 'Isoleucine or valine' 0 C--O 1.253 1.284 0 O-C-N 127.083 2.739 . . . . 30.35 113.456 -179.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 29.3 m -103.4 114.5 28.83 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 105.776 -1.935 . . . . 28.07 105.776 169.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' ARG . . . . . 0.473 ' HD3' ' O ' ' A' ' 603' ' ' HOH . 6.5 mmt180 -91.99 109.64 20.99 Favored 'General case' 0 C--O 1.257 1.462 0 O-C-N 125.998 2.061 . . . . 44.47 109.224 -179.934 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 75.7 mt -90.38 114.97 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 126.687 2.492 . . . . 29.29 105.671 178.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 39.8 mt -75.46 48.64 0.45 Allowed 'General case' 0 C--O 1.257 1.465 0 CA-C-N 113.249 -1.796 . . . . 31.65 115.043 -173.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HIS . . . . . 0.519 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 30.9 m80 -158.54 164.22 36.31 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 105.566 -2.013 . . . . 46.14 105.566 -179.785 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -111.09 142.0 43.83 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 125.694 1.871 . . . . 70.3 108.726 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -138.21 143.42 40.17 Favored 'General case' 0 C--O 1.261 1.678 0 O-C-N 126.544 2.403 . . . . 45.24 104.666 178.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' GLU . . . . . 0.542 ' HG3' ' HD3' ' A' ' 18' ' ' LYS . 20.1 pt-20 -61.17 127.37 31.18 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 127.519 3.012 . . . . 84.47 107.935 176.998 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 4.3 m -131.58 153.08 50.26 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 113.751 -1.568 . . . . 32.27 109.082 -178.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 25.1 p30 -120.59 -3.79 9.82 Favored 'General case' 0 C--N 1.315 -0.932 0 O-C-N 125.091 1.494 . . . . 40.58 108.541 176.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 32.6 m -132.81 139.02 47.31 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 125.752 1.908 . . . . 33.27 107.639 -179.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -130.71 157.11 43.7 Favored 'General case' 0 CA--C 1.511 -0.553 0 O-C-N 126.32 2.262 . . . . 31.87 115.828 -175.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' PHE . . . . . 0.475 ' CD1' ' HD2' ' A' ' 149' ' ' PRO . 37.4 t80 -77.44 134.7 66.0 Favored Pre-proline 0 C--O 1.253 1.261 0 CA-C-N 110.939 -2.846 . . . . 27.83 106.459 176.727 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 149' ' ' PRO . . . . . 0.475 ' HD2' ' CD1' ' A' ' 148' ' ' PHE . 18.5 Cg_endo -62.03 164.85 15.76 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 O-C-N 124.82 1.958 . . . . 32.41 107.935 177.074 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -74.25 134.03 42.65 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 123.578 0.751 . . . . 62.33 110.876 177.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ILE . . . . . 0.519 HG12 ' CE1' ' A' ' 153' ' ' TYR . 0.1 OUTLIER -97.9 135.57 31.98 Favored 'Isoleucine or valine' 0 C--O 1.253 1.282 0 N-CA-C 109.182 -0.673 . . . . 48.38 109.182 179.781 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -75.95 98.41 4.24 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 108.795 -0.817 . . . . 43.85 108.795 176.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' TYR . . . . . 0.519 ' CE1' HG12 ' A' ' 151' ' ' ILE 0.264 16.4 m-30 -60.67 -15.36 27.92 Favored 'General case' 0 C--O 1.258 1.546 0 O-C-N 126.031 2.082 . . . . 40.62 112.42 -179.006 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 154' ' ' LYS . . . . . 0.431 ' O ' ' HE2' ' A' ' 157' ' ' LYS . 8.8 mtmm -81.39 -25.84 35.93 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 125.033 1.458 . . . . 45.59 112.179 176.374 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -93.48 -48.26 6.47 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 125.208 1.403 . . . . 52.56 111.734 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -93.02 105.64 17.71 Favored 'General case' 0 C--O 1.259 1.589 0 O-C-N 126.469 2.356 . . . . 36.86 108.34 -176.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' LYS . . . . . 0.431 ' HE2' ' O ' ' A' ' 154' ' ' LYS . 10.8 mmtt -92.02 128.03 37.71 Favored 'General case' 0 C--N 1.308 -1.217 0 O-C-N 123.704 0.627 . . . . 68.13 109.556 177.232 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 28.4 tp -68.25 126.13 28.6 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 115.823 -2.037 . . . . 42.13 106.67 178.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 52.5 mt -80.83 152.45 28.21 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 126.708 2.505 . . . . 48.43 105.712 176.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 27.4 p -95.46 -9.31 32.95 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 125.349 1.655 . . . . 59.73 109.336 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' GLU . . . . . 0.508 ' HG2' ' N ' ' A' ' 162' ' ' TYR . 10.8 tt0 -162.53 149.14 13.06 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 124.684 1.194 . . . . 80.21 110.465 178.877 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 162' ' ' TYR . . . . . 0.508 ' N ' ' HG2' ' A' ' 161' ' ' GLU . 35.1 t80 -153.12 133.7 7.86 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 113.217 -1.811 . . . . 49.41 108.564 176.801 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -53.31 109.13 0.32 Allowed 'Trans proline' 0 N--CA 1.448 -1.164 0 O-C-N 127.176 3.198 . . . . 54.96 114.614 178.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 91.34 10.16 62.49 Favored Glycine 0 C--O 1.262 1.852 0 CA-C-N 113.722 -1.581 . . . . 63.27 114.474 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 45.7 t -116.55 114.68 40.05 Favored Pre-proline 0 N--CA 1.477 0.895 0 N-CA-C 106.437 -1.69 . . . . 53.15 106.437 177.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.66 146.29 95.76 Favored 'Trans proline' 0 C--N 1.321 -0.918 0 O-C-N 125.668 2.404 . . . . 45.89 107.742 -177.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' ALA . . . . . . . . . . . . . . . -90.27 -40.38 12.18 Favored 'General case' 0 C--O 1.253 1.274 0 O-C-N 124.679 1.237 . . . . 56.13 113.419 -177.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -62.98 165.73 6.56 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 122.952 1.358 . . . . 75.99 111.594 -175.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' ILE . . . . . . . . . . . . . 11.0 mt -75.89 130.17 36.42 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 CA-C-N 111.196 -2.729 . . . . 46.52 105.021 171.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' GLN . . . . . . . . . . . . . 57.0 mm-40 -97.62 155.05 17.16 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 112.801 -2.0 . . . . 52.91 106.085 179.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -141.57 146.26 36.07 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 125.132 1.52 . . . . 64.09 107.503 177.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' GLU . . . . . 0.711 ' OE1' ' HB2' ' A' ' 29' ' ' ASN . 44.9 tt0 -169.23 135.06 1.61 Allowed 'General case' 0 C--N 1.302 -1.461 0 O-C-N 126.57 2.419 . . . . 56.88 105.454 -179.405 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 53.81 37.21 25.9 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 115.477 -2.201 . . . . 48.64 109.574 -177.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . 70.91 9.44 66.17 Favored Glycine 0 C--O 1.262 1.893 0 O-C-N 126.506 2.379 . . . . 29.68 113.129 177.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' ILE . . . . . . . . . . . . . 30.9 mm -111.37 140.22 31.77 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.271 0 N-CA-C 108.249 -1.019 . . . . 41.32 108.249 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 176' ' ' GLN . . . . . 0.414 ' H ' ' CE1' ' A' ' 140' ' ' HIS . 67.0 mt-30 -107.79 150.08 27.44 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 124.474 1.109 . . . . 31.69 109.746 176.996 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 44.6 p90 -155.04 166.54 33.25 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 106.674 -1.602 . . . . 41.89 106.674 175.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' LYS . . . . . 0.649 ' NZ ' ' OE2' ' A' ' 180' ' ' GLU . 2.7 pttt -137.19 145.97 44.34 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 126.361 2.288 . . . . 73.88 110.268 175.493 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 179' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -92.89 141.42 28.44 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-N 112.173 -2.285 . . . . 35.54 106.667 175.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 180' ' ' GLU . . . . . 0.649 ' OE2' ' NZ ' ' A' ' 178' ' ' LYS . 75.8 mt-10 -145.4 144.24 30.54 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 104.832 -2.284 . . . . 43.2 104.832 179.719 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 181' ' ' VAL . . . . . . . . . . . . . 6.7 t -123.78 126.71 73.15 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.28 0 O-C-N 127.595 3.059 . . . . 29.72 106.181 177.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -114.54 146.0 41.27 Favored 'General case' 0 C--N 1.312 -1.059 0 O-C-N 126.849 2.593 . . . . 30.69 106.69 175.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -135.68 132.5 37.04 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 128.212 3.445 . . . . 56.4 112.682 -175.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 21.3 tttt -117.83 123.44 45.92 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 112.902 -1.954 . . . . 39.83 107.357 177.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 9.3 m -105.64 118.41 36.5 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 113.145 -1.843 . . . . 56.93 110.043 -179.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 186' ' ' VAL . . . . . 0.625 HG21 ' C ' ' A' ' 129' ' ' ILE . 2.1 t . . . . . 0 C--O 1.268 2.033 0 CA-C-O 113.527 -3.13 . . . . 67.64 108.75 179.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 191' ' ' TAP . . . . . 0.674 ' H2N' ' O ' ' A' ' 16' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . 0.419 ' O ' ' HE3' ' A' ' 111' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 279' ' ' HOH . . . . . 0.403 ' O ' ' HG3' ' A' ' 91' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 295' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 367' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 383' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 392' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 393' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 603' ' ' HOH . . . . . 0.473 ' O ' ' HD3' ' A' ' 137' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 604' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 605' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 606' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 607' ' ' HOH . . . . . 0.464 ' O ' ' NZ ' ' A' ' 18' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 610' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 611' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 612' ' ' HOH . . . . . 0.511 ' O ' HG23 ' A' ' 151' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 613' ' ' HOH . . . . . 0.57 ' O ' ' NZ ' ' A' ' 55' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 615' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 622' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 625' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 630' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 637' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 644' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 647' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 648' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 652' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 653' ' ' HOH . . . . . 1.077 ' O ' ' N ' ' A' ' 43' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 655' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 677' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 731' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 732' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 734' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 736' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 737' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 743' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 746' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 749' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 750' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 758' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.586 HG12 ' OD1' ' A' ' 101' ' ' ASP . 3.0 m . . . . . 0 N--CA 1.481 1.104 0 N-CA-C 108.451 -0.944 . . . . 70.89 108.451 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . . . -53.87 -50.94 65.16 Favored 'General case' 0 C--O 1.254 1.337 0 N-CA-C 114.353 1.242 . . . . 68.96 114.353 -177.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' SER . . . . . 0.705 ' HA ' ' CD1' ' A' ' 129' ' ' ILE . 97.3 p -160.37 164.48 32.39 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.674 0.749 . . . . 55.44 112.095 -175.278 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' A' ' 131' ' ' HIS . 86.6 mt -118.03 159.61 22.9 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 113.928 -1.487 . . . . 40.38 107.135 178.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -133.94 137.94 45.17 Favored 'General case' 0 C--N 1.29 -1.979 0 O-C-N 129.055 3.972 . . . . 31.11 104.739 173.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 28.7 m -131.11 141.1 50.1 Favored 'General case' 0 C--N 1.291 -1.941 0 O-C-N 128.105 3.378 . . . . 25.93 102.89 177.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 15.3 tt -133.06 136.62 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 1 O-C-N 129.615 4.322 . . . . 23.84 106.087 179.01 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.8 p -154.73 156.94 4.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 O-C-N 126.688 2.492 . . . . 24.73 107.924 179.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -117.55 133.81 55.55 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 126.865 2.603 . . . . 25.43 104.879 170.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.67 HG12 HG22 ' A' ' 16' ' ' ILE . 33.3 m -135.46 146.39 30.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 C-N-CA 123.621 0.769 . . . . 29.61 109.966 -179.254 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.519 ' HB2' ' O ' ' A' ' 140' ' ' HIS . 27.2 p -97.08 -179.24 4.47 Favored 'General case' 0 C--O 1.256 1.418 0 O-C-N 126.036 2.085 . . . . 36.9 107.998 175.169 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.438 2.0 mt-30 -54.47 -33.36 59.53 Favored 'General case' 0 C--O 1.257 1.48 0 N-CA-C 115.312 1.597 . . . . 60.66 115.312 -172.76 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.48 HD22 ' HG2' ' A' ' 141' ' ' GLU . 1.8 p30 -88.53 9.71 22.87 Favored 'General case' 0 C--O 1.256 1.434 0 CA-C-O 117.051 -1.452 . . . . 51.71 112.732 179.701 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 74.4 mmm 71.75 17.09 5.53 Favored 'General case' 0 C--O 1.249 1.078 0 C-N-CA 124.456 1.102 . . . . 45.95 113.243 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -80.02 146.85 28.42 Favored Glycine 0 N--CA 1.515 3.933 0 N-CA-C 107.057 -2.417 . . . . 27.72 107.057 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.674 ' O ' ' H2N' ' A' ' 191' ' ' TAP . 38.4 pt -127.12 -3.53 4.38 Favored 'Isoleucine or valine' 0 C--O 1.251 1.148 0 O-C-N 124.36 0.683 . . . . 27.65 111.091 177.854 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -165.1 162.4 35.66 Favored Glycine 0 C--O 1.266 2.123 0 N-CA-C 117.646 1.818 . . . . 28.17 117.646 -178.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.542 ' HD3' ' HG3' ' A' ' 143' ' ' GLU . 1.1 tptt -160.02 127.22 4.51 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 114.199 -1.001 . . . . 54.28 109.636 -179.594 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 50.58 42.47 26.87 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 124.617 1.198 . . . . 55.76 111.076 176.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 75.79 12.93 83.53 Favored Glycine 0 C--O 1.25 1.109 0 CA-C-O 119.192 -0.782 . . . . 42.57 112.251 175.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.524 ' CG ' ' H ' ' A' ' 22' ' ' LEU . 63.9 t30 -141.48 -171.73 3.37 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 116.86 -1.543 . . . . 71.76 109.419 177.147 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.524 ' H ' ' CG ' ' A' ' 21' ' ' ASN . 40.5 mt -78.49 149.75 75.58 Favored Pre-proline 0 C--N 1.304 -1.386 0 O-C-N 126.977 2.673 . . . . 31.78 107.183 176.132 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 22' ' ' LEU . 18.7 Cg_exo -72.66 -23.46 19.54 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 O-C-N 126.39 2.784 . . . . 30.69 112.433 -178.033 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 22.2 p90 -112.47 161.05 28.07 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 125.298 1.624 . . . . 33.71 108.339 -177.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -68.89 170.07 16.34 Favored 'Trans proline' 0 C--N 1.321 -0.9 0 N-CA-C 106.338 -2.216 . . . . 30.44 106.338 178.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -61.35 134.26 50.87 Favored 'Trans proline' 0 CA--C 1.509 -0.754 0 C-N-CA 122.087 1.858 . . . . 35.62 114.726 -174.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 58.3 mt -119.71 113.75 21.12 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.541 1.936 . . . . 37.74 106.244 173.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . . . -60.67 -54.55 43.88 Favored 'General case' 0 C--O 1.261 1.663 0 CA-C-O 123.907 1.813 . . . . 64.47 113.895 -175.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.832 ' HA ' ' HZ2' ' A' ' 32' ' ' LYS 0.367 51.9 m-80 -58.75 -40.76 84.81 Favored 'General case' 0 C--O 1.255 1.362 0 CA-C-N 113.487 -1.688 . . . . 61.98 112.442 -178.164 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.426 ' O ' ' HB3' ' A' ' 33' ' ' TYR . 6.0 tm-20 -67.67 -38.36 83.64 Favored 'General case' 0 C--O 1.256 1.444 0 C-N-CA 119.023 -1.071 . . . . 64.04 109.684 179.436 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -63.16 -49.48 74.15 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 123.553 0.741 . . . . 64.58 111.574 179.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.832 ' HZ2' ' HA ' ' A' ' 29' ' ' ASN . 4.0 mtmp? -56.26 -38.88 71.74 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 107.778 -1.193 . . . . 64.07 107.778 -179.704 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.455 ' O ' ' HG2' ' A' ' 37' ' ' MET . 84.9 t80 -58.9 -46.14 88.61 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 123.819 1.771 . . . . 47.94 110.108 -177.026 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -65.26 -42.46 93.21 Favored 'General case' 0 C--O 1.252 1.219 0 CA-C-N 111.8 -2.455 . . . . 33.13 109.708 -177.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLN . . . . . 1.002 HE22 HH12 ' A' ' 70' ' ' ARG . 5.5 mm-40 -63.43 -49.71 72.64 Favored 'General case' 0 C--O 1.261 1.69 0 CA-C-O 122.778 1.275 . . . . 61.2 110.487 179.869 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . . . -60.54 -49.55 77.11 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 114.281 -1.327 . . . . 58.06 111.381 -178.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' MET . . . . . 0.455 ' HG2' ' O ' ' A' ' 33' ' ' TYR . 94.1 mmm -60.95 -46.45 90.67 Favored 'General case' 0 C--O 1.245 0.831 0 N-CA-C 112.567 0.58 . . . . 44.79 112.567 -179.638 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 75.8 p -79.5 -26.91 41.48 Favored 'General case' 0 C--O 1.256 1.44 0 N-CA-C 114.35 1.241 . . . . 29.62 114.35 -174.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.7 m -84.86 -33.66 22.79 Favored 'General case' 0 C--O 1.261 1.673 0 N-CA-C 116.023 1.861 . . . . 43.7 116.023 -178.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . 0.681 ' O ' ' CE ' ' A' ' 111' ' ' MET . 30.2 m -70.16 117.14 11.34 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 115.495 1.665 . . . . 39.22 115.495 -177.367 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 30.9 t -104.16 145.38 30.29 Favored 'General case' 0 C--O 1.25 1.121 0 C-N-CA 125.637 1.575 . . . . 55.55 108.749 175.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.696 ' C ' ' O ' ' A' ' 653' ' ' HOH . 27.9 m80 -104.45 39.04 1.74 Allowed 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 109.613 -0.514 . . . . 70.81 109.613 -178.554 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . 1.077 ' N ' ' O ' ' A' ' 653' ' ' HOH . 18.1 t -163.42 123.38 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 O-C-N 124.883 1.364 . . . . 62.3 108.518 -177.331 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . 0.34 17.8 pt-20 -68.13 140.22 56.18 Favored 'General case' 0 C--O 1.248 0.995 0 CA-C-O 123.031 1.395 . . . . 88.25 110.556 -179.989 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.16 3.35 88.96 Favored Glycine 0 C--O 1.248 0.969 0 CA-C-N 113.075 -1.875 . . . . 65.96 111.19 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.812 ' HD2' HG11 ' A' ' 43' ' ' VAL . 35.6 mttt -119.6 161.41 20.69 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 124.933 1.019 . . . . 58.51 111.078 178.872 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 69' ' ' ASP . 0.6 OUTLIER -134.56 161.99 33.53 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 124.216 0.948 . . . . 62.14 108.464 179.391 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.483 HD21 ' HE3' ' A' ' 111' ' ' MET . 97.9 m-20 -86.46 155.66 20.45 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 125.09 1.494 . . . . 36.64 108.995 176.249 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -111.51 135.83 51.53 Favored 'General case' 0 C--O 1.252 1.218 0 O-C-N 127.021 2.701 . . . . 33.82 107.569 175.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 23.2 m -114.99 133.43 61.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 114.211 -1.359 . . . . 30.84 107.635 175.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 31.2 mt -115.4 135.25 56.01 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 O-C-N 125.426 1.704 . . . . 29.29 108.989 176.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 14.5 ptp -152.95 158.72 42.51 Favored 'General case' 0 C--O 1.238 0.491 0 O-C-N 126.283 2.239 . . . . 29.05 111.315 -178.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.72 168.87 54.49 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-N 111.318 -2.674 . . . . 29.44 108.493 179.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.8 ttpt -59.85 -47.5 85.48 Favored 'General case' 0 C--O 1.261 1.7 0 O-C-N 125.558 1.387 . . . . 31.14 112.382 -178.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.57 ' NZ ' ' O ' ' A' ' 613' ' ' HOH 0.25 28.6 mtpt -62.39 -41.93 99.03 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 115.121 -0.945 . . . . 53.96 109.171 -175.627 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' THR . . . . . 0.442 ' OG1' ' H6N' ' A' ' 191' ' ' TAP . 53.6 m -61.29 -47.62 85.15 Favored 'General case' 0 C--O 1.271 2.233 0 CA-C-N 113.506 -1.679 . . . . 27.79 111.259 -179.125 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.477 ' CE2' ' HD3' ' A' ' 65' ' ' ARG . 45.0 t-105 -55.42 -47.16 76.36 Favored 'General case' 0 N--CA 1.485 1.32 0 CA-C-O 122.393 1.092 . . . . 30.32 109.988 179.034 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . 0.321 69.0 m-85 -69.13 -18.13 63.92 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-O 118.117 -0.945 . . . . 31.74 112.522 -178.19 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.4 p -76.73 -15.03 59.88 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 124.529 1.143 . . . . 34.67 110.41 -179.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 21.4 mt -83.93 130.67 54.18 Favored Pre-proline 0 N--CA 1.49 1.573 0 N-CA-C 106.722 -1.585 . . . . 35.24 106.722 -178.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -53.23 132.62 48.98 Favored 'Trans proline' 0 N--CA 1.488 1.175 0 O-C-N 127.241 3.232 . . . . 32.61 106.286 178.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -48.89 -41.8 34.69 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 125.761 1.624 . . . . 70.51 114.253 -174.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.505 ' HD3' ' N ' ' A' ' 63' ' ' LYS . 0.5 OUTLIER -69.38 -19.9 63.82 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-N 115.95 -0.568 . . . . 52.51 111.732 -179.628 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -92.54 11.54 26.09 Favored 'General case' 0 C--O 1.259 1.571 0 CA-C-O 118.562 -0.732 . . . . 50.4 111.945 179.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.477 ' HD3' ' CE2' ' A' ' 57' ' ' TRP . 48.1 mtt180 -108.7 147.7 36.3 Favored Pre-proline 0 N--CA 1.475 0.808 0 CA-C-N 119.104 0.865 . . . . 40.71 112.043 -179.221 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -77.92 170.56 70.23 Favored 'Cis proline' 0 C--O 1.254 1.317 0 N-CA-C 108.954 -1.21 . . . . 33.28 108.954 -9.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 46.5 mt -58.58 114.89 2.69 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 105.694 -1.965 . . . . 33.21 105.694 178.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.414 ' HG2' ' OD2' ' A' ' 69' ' ' ASP . 12.7 tttm -55.5 138.4 46.49 Favored 'General case' 0 C--N 1.306 -1.308 0 O-C-N 125.366 1.667 . . . . 65.59 111.854 -177.333 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.49 ' O ' ' HG2' ' A' ' 47' ' ' GLN . 65.1 m-20 73.77 12.35 4.46 Favored 'General case' 0 C--O 1.256 1.416 0 C-N-CA 125.842 1.657 . . . . 57.21 114.772 176.378 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ARG . . . . . 1.002 HH12 HE22 ' A' ' 35' ' ' GLN . 18.6 mtm180 -134.18 153.78 51.63 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 105.728 -1.953 . . . . 32.05 105.728 176.554 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.556 HD12 HG22 ' A' ' 109' ' ' VAL . 18.5 mt -84.06 114.8 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 125.961 2.038 . . . . 42.51 106.231 174.182 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.531 HD22 ' N ' ' A' ' 72' ' ' ASN . 0.7 OUTLIER -89.54 119.81 30.3 Favored 'General case' 0 C--O 1.255 1.354 0 O-C-N 124.541 1.151 . . . . 34.92 109.676 -178.43 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 61.2 mt -116.3 122.4 69.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-N 114.334 -1.303 . . . . 34.04 107.635 174.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 91.1 t -107.59 135.34 46.52 Favored 'Isoleucine or valine' 0 C--O 1.252 1.191 0 O-C-N 126.531 2.394 . . . . 32.05 109.507 177.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.423 ' HA ' ' O ' ' A' ' 90' ' ' SER . 54.2 mt -101.99 139.52 37.51 Favored 'General case' 0 C--O 1.254 1.319 0 O-C-N 125.565 1.791 . . . . 31.54 108.418 176.803 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 13.7 t -168.27 139.8 2.8 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 105.734 -1.951 . . . . 36.48 105.734 177.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . . . -89.23 -16.36 31.46 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 127.296 2.872 . . . . 58.08 107.045 176.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -94.54 -41.12 9.51 Favored 'General case' 0 C--O 1.258 1.513 0 N-CA-C 119.629 3.196 . . . . 48.88 119.629 -175.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.1 mt -71.45 149.72 45.62 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 118.554 0.615 . . . . 44.86 110.576 -176.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -94.12 -28.58 15.61 Favored 'General case' 0 C--O 1.257 1.456 0 O-C-N 127.412 2.945 . . . . 83.68 110.925 -179.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . . . -145.73 155.71 43.14 Favored 'General case' 0 C--O 1.246 0.875 0 O-C-N 121.888 -0.508 . . . . 60.28 110.775 176.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -54.25 137.14 59.21 Favored Pre-proline 0 N--CA 1.476 0.851 0 CA-C-N 114.854 -1.066 . . . . 48.83 108.967 178.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -62.28 153.33 70.85 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 N-CA-C 106.443 -2.176 . . . . 45.15 106.443 177.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . . . -54.4 113.95 1.47 Allowed 'General case' 0 C--N 1.305 -1.348 0 CA-C-N 112.92 -1.946 . . . . 63.63 108.984 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 103.74 -17.54 49.34 Favored Glycine 0 C--O 1.258 1.653 0 CA-C-N 113.133 -1.848 . . . . 41.19 114.235 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -81.0 148.92 29.52 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 104.8 -2.296 . . . . 36.1 104.8 -178.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 30.8 m80 -79.5 -39.16 32.7 Favored 'General case' 0 C--O 1.268 2.033 0 O-C-N 127.125 2.766 . . . . 40.23 114.012 178.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -150.65 156.13 40.74 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 123.547 0.529 . . . . 53.41 109.699 -179.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.8 tp -124.33 137.13 54.52 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 102.385 -3.191 . . . . 41.77 102.385 178.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . 0.423 ' O ' ' HA ' ' A' ' 75' ' ' LEU . 69.5 m -134.53 151.76 51.33 Favored 'General case' 0 C--N 1.298 -1.655 1 O-C-N 129.465 4.228 . . . . 45.29 104.422 179.598 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 279' ' ' HOH . 0.2 OUTLIER -92.16 -17.33 25.06 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 127.944 3.278 . . . . 67.24 112.108 -176.827 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 88.0 p -156.5 168.89 25.98 Favored 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 106.564 -1.643 . . . . 32.86 106.564 176.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 61.0 tp -61.38 -46.37 90.47 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 128.55 3.656 . . . . 42.33 108.68 178.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -50.12 -50.66 47.79 Favored 'General case' 0 C--O 1.246 0.912 0 CA-C-N 113.639 -1.619 . . . . 56.36 110.971 177.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -56.74 -44.62 81.87 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 125.091 1.494 . . . . 60.23 109.423 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.13 -44.18 96.3 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 114.259 -1.337 . . . . 39.57 107.57 -179.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . 0.417 49.7 mt -58.18 -50.82 72.18 Favored 'General case' 0 C--O 1.266 1.931 0 O-C-N 125.185 1.553 . . . . 44.12 110.47 -179.612 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -55.51 -47.1 76.77 Favored 'General case' 0 C--O 1.255 1.36 0 CA-C-O 122.541 1.163 . . . . 50.9 110.569 177.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 102' ' ' SER . 25.9 tp -50.03 -52.1 36.86 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 114.209 -1.359 . . . . 48.58 109.015 -178.465 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.417 HD13 ' CG2' ' A' ' 112' ' ' VAL . 20.4 mt -54.03 -45.94 71.71 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-N 113.426 -1.715 . . . . 56.23 110.695 -176.707 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.586 ' OD1' HG12 ' A' ' 1' ' ' VAL . 82.5 m-20 -66.76 -15.92 63.89 Favored 'General case' 0 C--O 1.248 0.975 0 O-C-N 126.099 2.124 . . . . 73.78 109.729 -179.309 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' SER . . . . . 0.4 ' HB3' ' O ' ' A' ' 99' ' ' LEU 0.286 0.2 OUTLIER -55.66 155.16 11.3 Favored Pre-proline 0 N--CA 1.489 1.521 0 O-C-N 124.995 1.434 . . . . 76.42 107.566 -179.678 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -57.22 -56.35 1.92 Allowed 'Trans proline' 0 C--O 1.248 0.976 0 C-N-CA 123.89 3.06 . . . . 81.5 113.262 -176.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . . . -48.15 -45.13 32.95 Favored 'General case' 0 C--O 1.248 1.008 0 CA-C-N 114.837 -1.074 . . . . 85.68 111.511 179.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.401 ' O ' ' N ' ' A' ' 108' ' ' LYS . 4.1 mt -83.02 -51.99 7.06 Favored 'General case' 0 C--O 1.24 0.6 0 O-C-N 123.857 0.723 . . . . 79.0 112.204 -177.53 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . . . -36.12 -48.06 0.59 Allowed 'General case' 0 C--O 1.25 1.108 0 O-C-N 125.11 1.506 . . . . 72.58 111.624 -176.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 19.2 p -81.81 -16.49 50.74 Favored 'General case' 0 C--O 1.263 1.768 0 O-C-N 124.776 1.298 . . . . 70.22 114.116 -177.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' A' ' 105' ' ' LEU . . . -93.15 -17.46 23.73 Favored 'General case' 0 C--O 1.254 1.298 0 N-CA-C 113.778 1.029 . . . . 56.67 113.778 -177.515 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.556 HG22 HD12 ' A' ' 71' ' ' ILE . 77.3 t -109.2 135.35 48.38 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.006 0 N-CA-C 117.185 2.291 . . . . 47.45 117.185 -173.152 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -92.44 -85.44 0.26 Allowed 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 114.752 -1.113 . . . . 42.88 108.627 176.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' MET . . . . . 0.681 ' CE ' ' O ' ' A' ' 40' ' ' THR . 7.9 mtm -107.26 146.8 31.02 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.501 0.72 . . . . 49.48 111.783 -175.59 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.417 ' CG2' HD13 ' A' ' 100' ' ' LEU . 43.1 t -103.38 126.68 57.75 Favored 'Isoleucine or valine' 0 C--O 1.242 0.663 0 C-N-CA 125.005 1.322 . . . . 31.54 108.673 176.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -120.5 133.06 55.46 Favored 'General case' 0 C--O 1.257 1.492 0 O-C-N 126.855 2.597 . . . . 30.79 108.679 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 49.0 mm -100.25 119.72 48.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 O-C-N 127.421 2.951 . . . . 30.38 104.688 178.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . 0.341 12.8 m -112.05 17.74 7.64 Favored 'Isoleucine or valine' 0 C--O 1.268 2.037 0 O-C-N 127.964 3.29 . . . . 26.76 115.031 -178.145 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 88.56 -176.03 44.42 Favored Glycine 0 C--O 1.26 1.727 0 O-C-N 124.413 1.07 . . . . 24.27 113.74 173.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -81.27 -154.06 11.04 Favored Glycine 0 N--CA 1.429 -1.797 1 C-N-CA 131.689 4.471 . . . . 25.21 114.996 3.388 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 62.9 m -39.0 -65.89 0.33 Allowed 'General case' 0 C--O 1.252 1.234 0 C-N-CA 127.481 2.312 . . . . 29.43 114.486 -174.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -57.23 -35.19 69.38 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 125.716 1.885 . . . . 29.01 111.453 -178.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 41.6 t -68.72 -45.75 80.71 Favored 'Isoleucine or valine' 0 C--O 1.253 1.251 0 CA-C-O 121.96 0.886 . . . . 27.36 112.309 -179.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -59.4 -48.0 83.29 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.961 -1.018 . . . . 28.03 108.48 179.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 44.5 tttm -56.19 -51.14 69.11 Favored 'General case' 0 C--O 1.246 0.88 0 O-C-N 125.443 1.715 . . . . 65.96 113.024 -176.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -56.68 -46.11 81.36 Favored 'General case' 0 C--O 1.246 0.889 0 CA-C-N 113.869 -1.514 . . . . 32.09 110.723 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.6 -36.59 84.18 Favored 'General case' 0 C--O 1.251 1.137 0 O-C-N 123.561 0.538 . . . . 32.14 110.418 -178.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . 0.274 68.5 mtm -67.66 -30.14 69.61 Favored 'General case' 0 C--O 1.251 1.184 0 O-C-N 125.149 1.531 . . . . 56.82 113.449 -178.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -78.43 -21.71 48.78 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 113.889 1.07 . . . . 59.86 113.889 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.61 ' HB3' HG23 ' A' ' 129' ' ' ILE . 25.9 mmtp -63.68 130.76 94.58 Favored Pre-proline 0 C--N 1.31 -1.121 0 N-CA-C 108.043 -1.095 . . . . 64.74 108.043 178.839 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' PRO . . . . . 0.436 ' O ' HG11 ' A' ' 186' ' ' VAL . 61.7 Cg_endo -78.07 67.08 8.2 Favored 'Trans proline' 0 C--O 1.245 0.83 0 O-C-N 124.988 2.046 . . . . 46.04 107.951 179.09 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.705 ' CD1' ' HA ' ' A' ' 3' ' ' SER . 0.1 OUTLIER -139.36 151.67 23.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-N 113.44 -1.709 . . . . 47.15 109.586 179.353 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.465 ' O ' HG13 ' A' ' 129' ' ' ILE . 3.3 m120 -53.98 129.87 35.67 Favored 'General case' 0 C--O 1.253 1.279 0 O-C-N 125.785 1.928 . . . . 52.48 106.019 175.874 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HIS . . . . . 0.438 ' HA ' ' O ' ' A' ' 4' ' ' LEU . 4.1 t-160 -150.9 133.59 15.72 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 112.869 -1.969 . . . . 34.44 109.304 -173.201 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 33.9 mtm-85 -114.83 129.12 56.64 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 107.09 -1.448 . . . . 69.85 107.09 175.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 29.9 tp -115.26 118.57 33.66 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 112.615 -2.084 . . . . 28.06 107.667 -177.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -103.89 113.16 26.5 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 126.4 2.313 . . . . 33.23 105.657 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 30.1 t -115.55 129.96 70.97 Favored 'Isoleucine or valine' 0 C--O 1.253 1.284 0 O-C-N 127.083 2.739 . . . . 30.35 113.456 -179.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 29.3 m -103.4 114.5 28.83 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 105.776 -1.935 . . . . 28.07 105.776 169.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.473 ' HD3' ' O ' ' A' ' 603' ' ' HOH . 6.5 mmt180 -91.99 109.64 20.99 Favored 'General case' 0 C--O 1.257 1.462 0 O-C-N 125.998 2.061 . . . . 44.47 109.224 -179.934 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 75.7 mt -90.38 114.97 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 126.687 2.492 . . . . 29.29 105.671 178.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.586 ' C ' ' CD2' ' A' ' 140' ' ' HIS . 39.8 mt -75.46 48.64 0.45 Allowed 'General case' 0 C--O 1.257 1.465 0 CA-C-N 113.249 -1.796 . . . . 31.65 115.043 -173.029 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HIS . . . . . 0.586 ' CD2' ' C ' ' A' ' 139' ' ' LEU . 36.3 m-70 -158.54 164.22 36.31 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 105.566 -2.013 . . . . 46.14 105.566 -179.785 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.48 ' HG2' HD22 ' A' ' 13' ' ' ASN . 9.9 mt-10 -111.09 142.0 43.83 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 125.694 1.871 . . . . 70.3 108.726 179.889 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -138.21 143.42 40.17 Favored 'General case' 0 C--O 1.261 1.678 0 O-C-N 126.544 2.403 . . . . 45.24 104.666 178.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.542 ' HG3' ' HD3' ' A' ' 18' ' ' LYS . 20.1 pt-20 -61.17 127.37 31.18 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 127.519 3.012 . . . . 84.47 107.935 176.998 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 4.3 m -131.58 153.08 50.26 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 113.751 -1.568 . . . . 32.27 109.082 -178.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 25.1 p30 -120.59 -3.79 9.82 Favored 'General case' 0 C--N 1.315 -0.932 0 O-C-N 125.091 1.494 . . . . 40.58 108.541 176.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 32.6 m -132.81 139.02 47.31 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 125.752 1.908 . . . . 33.27 107.639 -179.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -130.71 157.11 43.7 Favored 'General case' 0 CA--C 1.511 -0.553 0 O-C-N 126.32 2.262 . . . . 31.87 115.828 -175.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.475 ' CD1' ' HD2' ' A' ' 149' ' ' PRO . 37.4 t80 -77.44 134.7 66.0 Favored Pre-proline 0 C--O 1.253 1.261 0 CA-C-N 110.939 -2.846 . . . . 27.83 106.459 176.727 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' PRO . . . . . 0.475 ' HD2' ' CD1' ' A' ' 148' ' ' PHE . 18.5 Cg_endo -62.03 164.85 15.76 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 O-C-N 124.82 1.958 . . . . 32.41 107.935 177.074 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -74.25 134.03 42.65 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 123.578 0.751 . . . . 62.33 110.876 177.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ILE . . . . . 0.519 HG12 ' CE1' ' A' ' 153' ' ' TYR . 0.1 OUTLIER -97.9 135.57 31.98 Favored 'Isoleucine or valine' 0 C--O 1.253 1.282 0 N-CA-C 109.182 -0.673 . . . . 48.38 109.182 179.781 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -75.95 98.41 4.24 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 108.795 -0.817 . . . . 43.85 108.795 176.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' TYR . . . . . 0.519 ' CE1' HG12 ' A' ' 151' ' ' ILE 0.264 16.4 m-30 -60.67 -15.36 27.92 Favored 'General case' 0 C--O 1.258 1.546 0 O-C-N 126.031 2.082 . . . . 40.62 112.42 -179.006 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.431 ' O ' ' HE2' ' A' ' 157' ' ' LYS . 8.8 mtmm -81.39 -25.84 35.93 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 125.033 1.458 . . . . 45.59 112.179 176.374 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -93.48 -48.26 6.47 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 125.208 1.403 . . . . 52.56 111.734 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -93.02 105.64 17.71 Favored 'General case' 0 C--O 1.259 1.589 0 O-C-N 126.469 2.356 . . . . 36.86 108.34 -176.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' LYS . . . . . 0.431 ' HE2' ' O ' ' A' ' 154' ' ' LYS . 10.8 mmtt -92.02 128.03 37.71 Favored 'General case' 0 C--N 1.308 -1.217 0 O-C-N 123.704 0.627 . . . . 68.13 109.556 177.232 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 28.4 tp -68.25 126.13 28.6 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 115.823 -2.037 . . . . 42.13 106.67 178.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 52.5 mt -80.83 152.45 28.21 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 126.708 2.505 . . . . 48.43 105.712 176.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 27.4 p -95.46 -9.31 32.95 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 125.349 1.655 . . . . 59.73 109.336 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' GLU . . . . . 0.508 ' HG2' ' N ' ' A' ' 162' ' ' TYR . 10.8 tt0 -162.53 149.14 13.06 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 124.684 1.194 . . . . 80.21 110.465 178.877 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' TYR . . . . . 0.508 ' N ' ' HG2' ' A' ' 161' ' ' GLU . 35.1 t80 -153.12 133.7 7.86 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 113.217 -1.811 . . . . 49.41 108.564 176.801 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -53.31 109.13 0.32 Allowed 'Trans proline' 0 N--CA 1.448 -1.164 0 O-C-N 127.176 3.198 . . . . 54.96 114.614 178.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 91.34 10.16 62.49 Favored Glycine 0 C--O 1.262 1.852 0 CA-C-N 113.722 -1.581 . . . . 63.27 114.474 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 45.7 t -116.55 114.68 40.05 Favored Pre-proline 0 N--CA 1.477 0.895 0 N-CA-C 106.437 -1.69 . . . . 53.15 106.437 177.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.66 146.29 95.76 Favored 'Trans proline' 0 C--N 1.321 -0.918 0 O-C-N 125.668 2.404 . . . . 45.89 107.742 -177.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' ALA . . . . . . . . . . . . . . . -90.27 -40.38 12.18 Favored 'General case' 0 C--O 1.253 1.274 0 O-C-N 124.679 1.237 . . . . 56.13 113.419 -177.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -62.98 165.73 6.56 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 122.952 1.358 . . . . 75.99 111.594 -175.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' ILE . . . . . . . . . . . . . 11.0 mt -75.89 130.17 36.42 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 CA-C-N 111.196 -2.729 . . . . 46.52 105.021 171.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' GLN . . . . . . . . . . . . . 57.0 mm-40 -97.62 155.05 17.16 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 112.801 -2.0 . . . . 52.91 106.085 179.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -141.57 146.26 36.07 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 125.132 1.52 . . . . 64.09 107.503 177.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' GLU . . . . . 0.711 ' OE1' ' HB2' ' A' ' 29' ' ' ASN . 44.9 tt0 -169.23 135.06 1.61 Allowed 'General case' 0 C--N 1.302 -1.461 0 O-C-N 126.57 2.419 . . . . 56.88 105.454 -179.405 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 53.81 37.21 25.9 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 115.477 -2.201 . . . . 48.64 109.574 -177.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . 70.91 9.44 66.17 Favored Glycine 0 C--O 1.262 1.893 0 O-C-N 126.506 2.379 . . . . 29.68 113.129 177.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' ILE . . . . . . . . . . . . . 30.9 mm -111.37 140.22 31.77 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.271 0 N-CA-C 108.249 -1.019 . . . . 41.32 108.249 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -107.79 150.08 27.44 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 124.474 1.109 . . . . 31.69 109.746 176.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 44.6 p90 -155.04 166.54 33.25 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 106.674 -1.602 . . . . 41.89 106.674 175.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.649 ' NZ ' ' OE2' ' A' ' 180' ' ' GLU . 2.7 pttt -137.19 145.97 44.34 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 126.361 2.288 . . . . 73.88 110.268 175.493 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -92.89 141.42 28.44 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-N 112.173 -2.285 . . . . 35.54 106.667 175.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' GLU . . . . . 0.649 ' OE2' ' NZ ' ' A' ' 178' ' ' LYS . 75.8 mt-10 -145.4 144.24 30.54 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 104.832 -2.284 . . . . 43.2 104.832 179.719 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' VAL . . . . . . . . . . . . . 6.7 t -123.78 126.71 73.15 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.28 0 O-C-N 127.595 3.059 . . . . 29.72 106.181 177.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -114.54 146.0 41.27 Favored 'General case' 0 C--N 1.312 -1.059 0 O-C-N 126.849 2.593 . . . . 30.69 106.69 175.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -135.68 132.5 37.04 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 128.212 3.445 . . . . 56.4 112.682 -175.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 21.3 tttt -117.83 123.44 45.92 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 112.902 -1.954 . . . . 39.83 107.357 177.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 9.3 m -105.64 118.41 36.5 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 113.145 -1.843 . . . . 56.93 110.043 -179.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.625 HG21 ' C ' ' A' ' 129' ' ' ILE . 2.1 t . . . . . 0 C--O 1.268 2.033 0 CA-C-O 113.527 -3.13 . . . . 67.64 108.75 179.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' TAP . . . . . 0.674 ' H2N' ' O ' ' A' ' 16' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . 0.403 ' O ' ' HE1' ' A' ' 111' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 279' ' ' HOH . . . . . 0.403 ' O ' ' HG3' ' A' ' 91' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 295' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 367' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 383' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 392' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 393' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 603' ' ' HOH . . . . . 0.473 ' O ' ' HD3' ' A' ' 137' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 604' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 605' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 606' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 607' ' ' HOH . . . . . 0.464 ' O ' ' NZ ' ' A' ' 18' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 610' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 611' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 612' ' ' HOH . . . . . 0.511 ' O ' HG23 ' A' ' 151' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 613' ' ' HOH . . . . . 0.57 ' O ' ' NZ ' ' A' ' 55' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 615' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 622' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 625' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 630' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 637' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 644' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 647' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 648' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 652' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 653' ' ' HOH . . . . . 1.077 ' O ' ' N ' ' A' ' 43' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 655' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 677' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 731' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 732' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 734' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 736' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 737' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 743' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 746' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 749' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 750' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 758' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_