data_6ovp_residue ############################ # Computer software used # ############################ 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 6ovp _Structure_validation_residue.Date_analyzed 2020-05-15 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 ' 0' ' ' MET . . . . . 0.841 ' O ' ' NH2' ' A' ' 17' ' ' ARG . 3.2 tpt . . . . . 0 CA--C 1.507 -0.707 0 N-CA-C 110.128 -0.323 . . . . 98.21 110.128 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.84 117.01 19.54 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 107.091 -1.448 . . . . 73.14 107.091 164.48 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 53.3 mt -81.38 -19.82 41.84 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 115.949 -0.569 . . . . 61.79 112.212 -165.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.7 pttt -62.68 151.32 38.63 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.224 0.535 . . . . 78.73 109.559 177.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.7 t -130.89 140.66 48.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 N-CA-C 108.028 -1.101 . . . . 72.22 108.028 -175.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -61.11 143.32 55.67 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 120.011 -0.675 . . . . 99.95 110.077 176.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 88.46 -9.07 77.05 Favored Glycine 0 N--CA 1.443 -0.841 0 CA-C-O 119.146 -0.808 . . . . 65.71 114.199 -177.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -123.15 90.33 3.27 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 105.631 -1.988 . . . . 62.78 105.631 176.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 54.6 m -59.41 -31.04 68.9 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 113.61 -1.632 . . . . 72.01 111.708 -177.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 76.7 p -78.36 -13.69 59.74 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 113.447 0.906 . . . . 54.51 113.447 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 51.9 p -72.89 -11.86 60.75 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 119.1 -1.04 . . . . 53.08 113.051 -163.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.3 tt -55.7 -25.83 19.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-N 119.036 0.834 . . . . 55.88 111.245 173.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.8 tp -61.94 -28.19 43.83 Favored 'Isoleucine or valine' 0 C--O 1.244 0.803 0 C-N-CA 119.528 -0.869 . . . . 56.12 110.716 -177.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -67.6 -35.48 79.05 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 118.694 -1.202 . . . . 56.18 111.262 177.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -65.34 -43.52 90.63 Favored 'General case' 0 C--O 1.243 0.713 0 O-C-N 122.193 -0.317 . . . . 55.46 110.703 171.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 93.0 t -59.3 -49.8 82.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 N-CA-C 109.594 -0.521 . . . . 52.42 109.594 178.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 55.6 mt -62.3 -44.16 98.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 C-N-CA 119.956 -0.697 . . . . 58.18 111.219 -176.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ARG . . . . . 0.841 ' NH2' ' O ' ' A' ' 0' ' ' MET . 52.8 ttp180 -57.85 -50.64 72.61 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 119.857 -0.737 . . . . 53.87 110.87 179.953 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -60.44 -46.16 91.04 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.991 -0.284 . . . . 61.26 111.656 179.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.71 -36.42 87.47 Favored Glycine 0 C--N 1.335 0.472 0 C-N-CA 119.282 -1.437 . . . . 54.57 111.532 -177.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.6 tp -71.28 -40.86 70.65 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 122.255 -0.556 . . . . 67.95 111.737 177.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -86.75 -5.49 59.1 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 113.335 0.865 . . . . 58.55 113.335 -173.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -56.34 117.8 18.42 Favored Pre-proline 0 C--O 1.245 0.825 0 CA-C-N 118.203 0.456 . . . . 63.02 110.009 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -58.28 -30.38 90.76 Favored 'Trans proline' 0 CA--C 1.513 -0.562 0 C-N-CA 120.503 0.802 . . . . 60.73 113.534 -178.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.0 m -74.98 0.48 15.72 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 119.087 -1.045 . . . . 68.96 112.72 176.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -116.92 31.66 6.62 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 118.882 0.764 . . . . 73.41 112.279 176.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.08 -30.13 34.4 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 112.054 0.39 . . . . 70.45 112.054 -177.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.5 mtmt -86.57 -37.11 18.46 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 118.712 -1.195 . . . . 86.52 112.438 -177.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -55.11 -48.9 72.98 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 121.227 -0.92 . . . . 82.68 110.692 169.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -53.33 -49.44 67.05 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.152 0.501 . . . . 88.73 111.401 175.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.87 -30.03 71.01 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 112.217 0.451 . . . . 89.12 112.217 -171.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -82.08 -35.04 29.08 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 119.806 -0.758 . . . . 102.1 112.225 179.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.6 m -69.37 -27.17 65.08 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 118.122 -1.431 . . . . 93.45 110.822 178.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 33.8 mt -74.16 -32.79 33.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 120.015 -0.674 . . . . 93.92 110.512 172.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -79.3 -38.41 35.38 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.175 -0.61 . . . . 107.11 112.044 -172.997 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.62 -48.79 7.61 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 112.918 0.71 . . . . 104.95 112.918 178.575 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.1 -47.35 85.03 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 120.073 -0.651 . . . . 100.08 110.434 -174.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 47.7 t30 50.66 50.86 18.09 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.529 0.68 . . . . 90.93 112.715 167.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -162.11 152.28 16.82 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.026 -0.534 . . . . 91.38 110.107 178.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.6 mp -90.73 126.91 43.47 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 108.078 -1.082 . . . . 85.55 108.078 161.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 25.0 mt -115.6 129.51 71.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 N-CA-C 109.034 -0.728 . . . . 76.39 109.034 179.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -105.27 137.0 36.82 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 C-N-CA 123.233 0.613 . . . . 71.81 109.468 173.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -108.77 119.54 39.85 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.699 -0.852 . . . . 68.85 108.699 174.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -101.85 103.7 14.41 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 106.964 -1.495 . . . . 82.58 106.964 172.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 25.4 mt -95.47 143.18 27.02 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.063 -0.347 . . . . 58.68 110.063 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.8 mmtt -126.94 131.88 50.98 Favored 'General case' 0 CA--C 1.518 -0.261 0 C-N-CA 124.051 0.94 . . . . 67.83 108.612 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 47.9 p30 -108.39 172.51 6.79 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 119.302 -0.959 . . . . 66.4 110.028 -179.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.0 mtpt -76.23 0.15 20.19 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.856 -1.066 . . . . 93.36 112.675 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -91.93 1.93 56.86 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 118.854 0.752 . . . . 76.52 112.286 169.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 88.84 1.95 79.22 Favored Glycine 0 N--CA 1.441 -1.0 0 CA-C-O 118.73 -1.039 . . . . 75.66 115.654 177.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.0 mmmt -94.04 158.34 15.67 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 119.366 1.583 . . . . 85.53 112.028 -176.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 93.6 m -118.8 129.8 55.43 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.734 1.614 . . . . 69.86 108.783 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . 0.405 ' OE1' ' NZ ' ' A' ' 66' ' ' LYS . 77.8 mm-40 -130.0 144.91 51.59 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.24 -1.022 . . . . 73.84 108.24 168.398 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.0 m -126.2 152.75 45.61 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 121.532 0.682 . . . . 72.02 111.594 -178.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 20.9 m-90 -138.92 154.63 48.37 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 106.6 -1.629 . . . . 64.21 106.6 176.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 48.1 p90 -119.56 146.92 45.06 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.518 0.675 . . . . 80.52 109.505 176.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.5 tp -127.75 94.12 3.87 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 105.16 -2.163 . . . . 72.08 105.16 178.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 59.1 t0 -78.01 102.96 7.66 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.028 -1.101 . . . . 83.2 108.028 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 52.4 mt -120.92 38.91 3.93 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 113.932 1.086 . . . . 83.58 113.932 177.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LYS . . . . . 1.068 ' NZ ' ' NZ ' ' A' ' 113' ' ' LYS . 15.3 pttt -134.79 -20.2 1.77 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.771 0.286 . . . . 99.2 111.771 177.472 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -96.42 -105.36 0.16 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.508 0.723 . . . . 95.83 109.079 171.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -109.63 -5.88 15.53 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 114.17 1.174 . . . . 107.25 114.17 -177.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.74 55.18 0.95 Allowed Glycine 0 CA--C 1.518 0.226 0 N-CA-C 118.439 2.136 . . . . 85.14 118.439 165.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -109.61 150.75 27.76 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 121.247 -1.149 . . . . 86.16 109.545 -173.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.4 t -117.59 134.91 59.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 107.954 -1.128 . . . . 63.75 107.954 176.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -160.89 -179.71 35.81 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 118.272 -1.918 . . . . 68.39 113.52 177.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LYS . . . . . 0.405 ' NZ ' ' OE1' ' A' ' 52' ' ' GLU . 23.7 tptp -84.9 143.04 29.27 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.588 -1.306 . . . . 73.56 110.767 -176.848 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 108.92 168.31 20.73 Favored Glycine 0 N--CA 1.435 -1.387 0 CA-C-O 121.487 0.493 . . . . 72.7 111.889 176.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -97.66 13.56 29.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.949 -0.626 . . . . 83.15 112.513 -177.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.9 124.81 21.26 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 109.667 -0.494 . . . . 95.95 109.667 177.328 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.7 t -69.15 136.1 89.24 Favored Pre-proline 0 C--N 1.343 0.307 0 C-N-CA 127.614 2.366 . . . . 98.38 110.832 167.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -71.28 -27.8 19.21 Favored 'Trans proline' 0 CA--C 1.533 0.464 0 N-CA-C 116.203 1.578 . . . . 105.26 116.203 176.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -104.48 104.92 14.86 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 121.441 1.928 . . . . 106.82 108.102 178.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 66.36 170.94 3.93 Favored Glycine 0 CA--C 1.519 0.301 0 N-CA-C 106.431 -2.667 . . . . 110.01 106.431 -169.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -129.24 -178.56 4.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 119.623 1.711 . . . . 110.87 111.028 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -54.86 139.48 39.94 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 114.401 -1.272 . . . . 91.5 112.401 -158.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASP . . . . . 0.662 ' OD2' ' NZ ' ' A' ' 113' ' ' LYS . 1.6 m-20 -99.27 -41.27 7.54 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.991 -1.004 . . . . 91.18 113.457 175.617 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 7.7 pt -139.57 144.24 29.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 108.303 -0.999 . . . . 85.65 108.303 179.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -125.22 129.74 50.68 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 123.098 0.559 . . . . 87.31 110.859 -178.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.2 mt -114.74 126.15 54.53 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 123.67 0.788 . . . . 66.7 109.602 179.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 32.0 m -118.47 125.04 49.05 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.548 -0.908 . . . . 59.4 108.548 179.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -160.12 169.53 23.14 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.847 -1.168 . . . . 53.55 107.847 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.9 p -77.38 161.64 27.86 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 122.243 1.02 . . . . 53.9 110.733 -179.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -64.24 -39.22 93.51 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 114.758 -1.11 . . . . 58.16 111.411 177.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASP . . . . . 0.733 ' OD1' ' O ' ' A' ' 201' ' ' HOH . 3.8 m-20 -68.22 -40.67 82.03 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.268 -0.573 . . . . 79.05 111.5 -179.973 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 8.1 m-70 -73.54 -35.68 65.55 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 119.609 -0.836 . . . . 62.75 111.212 -177.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -64.52 -41.94 96.08 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 119.716 -0.793 . . . . 55.23 110.199 175.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -63.41 -39.06 93.49 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 118.873 -1.131 . . . . 78.57 110.908 176.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -61.56 -43.83 98.14 Favored 'General case' 0 CA--C 1.511 -0.552 0 C-N-CA 118.559 -1.256 . . . . 73.21 110.71 174.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 50.1 tp -61.35 -44.08 97.78 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-O 120.952 0.406 . . . . 66.75 111.283 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.7 t -68.34 -41.48 83.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 O-C-N 121.744 -0.597 . . . . 64.94 111.052 -176.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -74.95 -4.49 38.46 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 114.088 1.144 . . . . 82.29 114.088 -179.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.3 12.01 68.32 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-O 118.941 -0.921 . . . . 75.76 115.384 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 55.2 mttt -103.43 15.24 29.56 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 118.596 1.198 . . . . 83.32 113.14 -178.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -156.48 150.45 25.06 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.084 -0.709 . . . . 69.43 109.084 176.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -105.15 134.34 48.42 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.044 0.538 . . . . 79.57 109.943 -176.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.51 -45.73 86.0 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 112.769 0.655 . . . . 67.1 112.769 -172.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -73.63 -28.07 61.6 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 117.057 -1.857 . . . . 83.05 110.596 -176.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . 0.325 5.1 tpt180 -73.99 -34.7 64.31 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 114.796 -2.761 . . . . 92.16 114.589 169.32 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 14.4 mt -54.53 -36.46 64.3 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 117.767 -1.573 . . . . 64.09 110.398 167.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -67.51 -51.47 50.59 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 112.392 0.516 . . . . 63.12 112.392 179.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 73.9 mtm -70.16 -15.08 62.9 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.336 -0.853 . . . . 72.88 112.228 -173.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 71.7 p -97.23 8.92 43.57 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 112.921 0.711 . . . . 64.35 112.921 -179.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 76.38 6.19 83.37 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 119.668 -1.254 . . . . 51.36 114.818 177.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -81.48 -25.48 36.0 Favored 'General case' 0 C--O 1.239 0.553 0 CA-C-N 118.682 1.241 . . . . 63.95 111.452 -179.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.4 tp -123.49 125.92 45.78 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 107.854 -1.165 . . . . 56.14 107.854 179.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -108.5 145.08 35.26 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.221 0.534 . . . . 74.79 111.176 177.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 97.6 t -125.06 115.26 43.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 N-CA-C 107.377 -1.342 . . . . 74.73 107.377 -173.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 17.1 ttmt -116.0 150.2 37.59 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.999 0.919 . . . . 86.22 109.664 173.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 104.56 -145.75 16.05 Favored Glycine 0 CA--C 1.519 0.325 0 N-CA-C 115.993 1.157 . . . . 91.22 115.993 -179.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -94.8 119.73 33.87 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.047 0.939 . . . . 95.84 110.346 -164.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 2.4 m -67.59 -18.39 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 CA-C-O 122.412 1.101 . . . . 91.36 108.984 178.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . 0.262 11.8 mmm -74.86 -36.46 62.31 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 126.466 1.907 . . . . 118.68 110.484 -167.163 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LYS . . . . . 1.068 ' NZ ' ' NZ ' ' A' ' 59' ' ' LYS . 15.0 mttt -92.03 -31.83 15.43 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 127.049 2.14 . . . . 100.46 112.046 169.948 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.64 -40.63 97.61 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 115.738 -0.665 . . . . 106.89 111.952 -175.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -53.32 -44.33 68.31 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.926 -0.31 . . . . 106.03 111.83 -176.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -95.01 130.22 41.76 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.647 -0.658 . . . . 103.71 109.871 172.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 1.6 pp . . . . . 0 C--N 1.329 -0.318 0 C-N-CA 118.276 -1.37 . . . . 106.11 113.662 -175.2 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 0' ' ' MET . . . . . 0.797 ' O ' ' NH2' ' B' ' 17' ' ' ARG . 34.9 mmm . . . . . 0 CA--C 1.502 -0.903 0 N-CA-C 108.177 -1.046 . . . . 95.1 108.177 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 34.5 t -78.36 119.24 21.41 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 103.028 -2.953 . . . . 69.14 103.028 151.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 70.3 mt -83.09 -16.19 47.87 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 113.883 1.068 . . . . 62.35 113.883 -162.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 17.7 tttm -61.52 141.78 57.5 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.332 0.587 . . . . 76.64 111.048 177.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 74.3 t -133.7 139.91 47.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 108.126 -1.064 . . . . 66.05 108.126 -177.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -62.85 141.56 58.6 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.575 0.547 . . . . 87.23 110.523 176.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 87.57 -8.96 75.5 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 115.08 0.792 . . . . 67.15 115.08 -179.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -124.16 92.99 3.79 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 107.325 -1.361 . . . . 68.05 107.325 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 30.7 m -57.58 -34.78 69.58 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.107 -0.951 . . . . 71.68 111.901 -175.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.6 p -77.54 -8.82 58.4 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 119.031 -1.068 . . . . 62.56 112.816 -175.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 84.3 p -73.19 -17.17 61.39 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 119.229 -0.989 . . . . 61.45 113.46 -164.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 13.3 tt -58.69 -24.21 25.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 CA-C-N 118.805 0.73 . . . . 69.13 111.357 172.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ILE . . . . . . . . . . . . . 19.7 mt -60.47 -32.53 51.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 C-N-CA 123.145 0.578 . . . . 70.2 111.604 179.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -68.34 -34.94 77.0 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 118.775 -1.17 . . . . 56.76 111.701 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -60.85 -44.07 97.5 Favored 'General case' 0 C--O 1.238 0.448 0 O-C-N 121.844 -0.535 . . . . 68.04 110.876 175.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 58.0 t -64.49 -44.99 96.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 CA-C-O 120.837 0.351 . . . . 51.98 110.703 178.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ILE . . . . . . . . . . . . . 73.3 mt -62.98 -43.83 99.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 O-C-N 121.754 -0.591 . . . . 58.17 110.895 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ARG . . . . . 0.797 ' NH2' ' O ' ' B' ' 0' ' ' MET . 50.1 ttp180 -57.67 -49.0 77.94 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 119.207 -0.997 . . . . 52.37 111.119 178.143 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -57.9 -46.02 85.56 Favored 'General case' 0 C--O 1.24 0.566 0 C-N-CA 120.816 -0.354 . . . . 70.78 111.308 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.05 -36.53 81.07 Favored Glycine 0 C--N 1.333 0.366 0 C-N-CA 119.465 -1.35 . . . . 55.01 113.064 -178.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 15.8 tp -68.43 -40.66 81.1 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 121.915 -0.756 . . . . 68.33 111.796 177.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -86.22 -8.84 57.49 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 124.107 0.963 . . . . 55.82 113.35 -172.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -51.1 118.68 10.87 Favored Pre-proline 0 N--CA 1.443 -0.798 0 N-CA-C 108.492 -0.929 . . . . 70.46 108.492 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -56.86 -30.58 85.97 Favored 'Trans proline' 0 C--O 1.238 0.504 0 CA-C-N 118.753 0.59 . . . . 57.24 113.18 -177.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' SER . . . . . . . . . . . . . 3.0 m -75.69 1.58 14.25 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.053 1.131 . . . . 67.0 114.053 177.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -115.59 27.63 9.2 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 119.726 1.148 . . . . 86.03 111.568 176.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.77 -30.12 31.11 Favored 'General case' 0 C--O 1.246 0.876 0 O-C-N 123.461 0.476 . . . . 68.24 111.391 -178.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -75.61 -45.16 39.04 Favored 'General case' 0 CA--C 1.508 -0.648 0 C-N-CA 119.561 -0.856 . . . . 88.94 111.678 -175.661 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' GLN . . . . . 0.431 ' O ' ' N ' ' B' ' 32' ' ' SER . 1.9 tp60 -75.31 -35.57 61.23 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 116.191 -2.204 . . . . 100.23 109.159 -175.004 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -50.23 -50.82 48.56 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 119.564 -0.854 . . . . 67.08 109.456 172.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -66.11 -29.67 70.03 Favored 'General case' 0 C--O 1.239 0.517 0 C-N-CA 120.14 -0.624 . . . . 71.63 110.698 -178.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -75.54 -38.33 59.4 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.258 -0.577 . . . . 92.29 111.052 177.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' SER . . . . . 0.431 ' N ' ' O ' ' B' ' 28' ' ' GLN . 5.2 m -71.03 -28.68 64.56 Favored 'General case' 0 CA--C 1.516 -0.346 0 C-N-CA 118.05 -1.46 . . . . 74.38 111.338 177.643 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 5.2 mt -71.3 -35.09 56.33 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 C-N-CA 119.052 -1.059 . . . . 77.41 111.008 177.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -78.4 -30.35 47.7 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.043 -0.663 . . . . 96.62 110.863 -177.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -78.04 -54.48 6.23 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 118.116 0.417 . . . . 86.96 111.359 176.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.26 -48.49 67.59 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 121.779 -0.576 . . . . 78.66 112.21 -176.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 52.2 t-20 48.87 49.7 18.75 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.976 0.893 . . . . 82.22 110.368 175.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -161.32 148.97 15.14 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.749 -0.66 . . . . 74.77 110.206 -177.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ILE . . . . . . . . . . . . . 29.3 mt -89.87 124.65 42.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 106.155 -1.794 . . . . 69.26 106.155 162.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 20.7 mt -114.31 125.3 71.58 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 N-CA-C 106.713 -1.588 . . . . 62.31 106.713 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 53.3 t -105.98 135.82 42.73 Favored 'Isoleucine or valine' 0 C--O 1.244 0.798 0 CA-C-O 121.892 0.853 . . . . 57.13 109.936 173.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -107.35 118.64 37.26 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 107.139 -1.43 . . . . 56.17 107.139 173.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -104.19 103.39 13.16 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 106.979 -1.489 . . . . 53.52 106.979 171.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 14.1 mt -93.84 144.51 25.37 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.248 0.547 . . . . 55.18 109.914 -179.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 47.0 mmtt -123.64 131.14 53.54 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 108.136 -1.061 . . . . 56.83 108.136 -178.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 52.6 p30 -107.84 170.69 7.83 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 117.127 -1.829 . . . . 62.81 110.761 -176.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 20.4 mtmt -75.88 11.56 1.37 Allowed 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 113.994 -1.457 . . . . 90.09 111.133 176.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -99.16 0.21 42.93 Favored 'General case' 0 C--N 1.348 0.532 0 CA-C-N 120.54 1.518 . . . . 81.27 112.105 162.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 89.5 5.11 72.53 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 119.795 -1.193 . . . . 68.91 115.743 -177.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 10.2 mttt -95.33 160.88 14.32 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 119.206 1.503 . . . . 88.57 112.3 -175.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' THR . . . . . . . . . . . . . 35.7 m -120.88 126.82 51.02 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 114.621 -1.172 . . . . 60.11 109.251 174.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -127.8 144.14 51.1 Favored 'General case' 0 C--O 1.247 0.972 0 N-CA-C 108.127 -1.064 . . . . 65.98 108.127 169.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' SER . . . . . . . . . . . . . 4.6 m -125.72 153.72 43.51 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.389 0.614 . . . . 60.77 111.524 -178.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' TRP . . . . . . . . . . . . . 27.9 m-90 -139.44 152.68 47.24 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 113.584 -1.644 . . . . 56.0 107.13 177.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -123.67 147.79 47.09 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.936 0.874 . . . . 68.59 111.254 177.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 21.3 tp -128.8 95.95 4.24 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 103.994 -2.595 . . . . 60.19 103.994 -179.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -80.44 102.12 9.46 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 107.697 -1.223 . . . . 71.31 107.697 -179.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 54.2 mt -117.2 35.32 4.7 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 122.549 0.34 . . . . 64.08 111.02 174.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -124.6 -31.29 3.24 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 113.537 0.94 . . . . 81.52 113.537 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -99.94 -102.28 0.23 Allowed 'General case' 0 C--O 1.237 0.41 0 CA-C-N 118.38 0.536 . . . . 78.73 111.418 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -109.02 -6.45 15.65 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 114.599 1.333 . . . . 85.87 114.599 -174.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.85 81.74 1.61 Allowed Glycine 0 C--O 1.244 0.768 0 C-N-CA 118.232 -1.937 . . . . 74.86 110.512 170.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -135.57 147.12 48.62 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.694 -0.854 . . . . 68.51 108.694 -175.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 45.5 t -122.52 135.46 62.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 105.931 -1.877 . . . . 57.48 105.931 168.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . -161.27 -177.54 34.45 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 117.873 -2.108 . . . . 56.46 112.678 178.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 25.0 tptp -84.77 143.96 28.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.101 -1.05 . . . . 65.14 110.222 -177.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 112.29 169.17 17.97 Favored Glycine 0 CA--C 1.518 0.281 0 CA-C-O 122.941 1.301 . . . . 61.92 112.868 173.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -97.61 9.35 42.73 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 114.042 -1.079 . . . . 79.08 112.664 -177.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . . 2.2 pttp -141.55 130.46 23.09 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.402 -0.962 . . . . 88.43 108.402 174.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' SER . . . . . . . . . . . . . 1.6 t -66.71 142.91 97.82 Favored Pre-proline 0 C--N 1.322 -0.618 0 C-N-CA 119.928 -0.709 . . . . 79.61 109.089 166.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -66.81 -18.0 52.49 Favored 'Trans proline' 0 CA--C 1.517 -0.34 0 C-N-CA 118.453 -0.565 . . . . 83.4 112.726 174.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -100.88 27.08 6.25 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 113.464 0.912 . . . . 81.96 113.464 -177.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' GLY . . . . . . . . . . . . . . . 148.96 178.3 23.88 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 119.608 -1.282 . . . . 85.62 111.846 -174.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -110.64 163.24 13.94 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 114.535 -0.833 . . . . 93.62 108.9 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.17 139.2 57.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.439 -1.255 . . . . 77.17 110.103 -168.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -91.02 -30.61 16.7 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.875 -0.602 . . . . 82.38 110.325 170.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 7.3 mt -138.85 143.01 32.91 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 108.827 -0.805 . . . . 69.59 108.827 178.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -124.84 128.55 48.87 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 106.643 -1.614 . . . . 81.83 106.643 173.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 36.0 mt -117.16 123.3 46.36 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 106.47 -1.678 . . . . 59.44 106.47 177.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' THR . . . . . . . . . . . . . 29.9 m -117.43 122.84 44.87 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.669 -0.863 . . . . 47.18 108.669 -179.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -162.6 168.88 21.09 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 107.742 -1.207 . . . . 50.29 107.742 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 29.2 p -73.7 160.21 31.88 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 122.303 1.049 . . . . 55.49 110.466 -179.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -61.87 -38.1 87.02 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 114.558 -1.201 . . . . 71.32 110.633 177.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -68.29 -40.02 81.9 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.043 -0.663 . . . . 77.91 111.288 178.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -72.38 -34.89 68.27 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 118.447 -1.301 . . . . 58.85 111.455 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -62.18 -42.78 99.6 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.401 -0.919 . . . . 59.46 110.687 176.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -65.5 -37.48 86.93 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.034 -0.666 . . . . 91.8 111.592 178.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -61.16 -43.43 98.9 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.557 -0.857 . . . . 75.17 110.899 173.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.2 tp -61.93 -41.91 98.49 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 121.021 -0.272 . . . . 58.97 111.609 -179.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 15.6 m -70.41 -37.67 71.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 C-N-CA 119.45 -0.9 . . . . 72.79 110.445 179.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 73.4 mt-10 -70.99 -11.93 61.25 Favored 'General case' 0 C--N 1.345 0.374 0 C-N-CA 118.904 -1.119 . . . . 94.06 112.386 177.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.4 9.67 75.44 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-O 119.117 -0.824 . . . . 78.41 114.74 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -97.54 13.13 31.07 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 118.348 1.074 . . . . 87.95 111.436 -179.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -150.39 145.67 26.22 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 106.688 -1.597 . . . . 69.15 106.688 172.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -108.28 132.39 53.74 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.553 -1.277 . . . . 61.1 107.553 -175.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.43 -37.45 83.56 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 119.806 -0.758 . . . . 56.61 110.735 -174.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -71.97 -34.09 68.68 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 118.989 -1.085 . . . . 64.95 111.079 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ARG . . . . . . . . . . . . . 31.8 tpt180 -72.13 -39.46 68.79 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.436 -0.506 . . . . 69.67 111.24 174.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 30.7 mt -58.22 -39.2 78.43 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.189 -0.604 . . . . 53.06 111.391 174.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -66.43 -45.8 78.63 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.817 0.341 . . . . 51.0 110.966 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 39.3 mmm -68.44 -29.65 68.35 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.12 -0.632 . . . . 54.77 112.203 -174.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' THR . . . . . . . . . . . . . 82.7 p -91.05 10.13 28.0 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.619 0.97 . . . . 52.58 113.619 177.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' GLY . . . . . . . . . . . . . . . 78.95 6.98 88.66 Favored Glycine 0 C--N 1.333 0.361 0 N-CA-C 116.065 1.186 . . . . 48.42 116.065 178.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -82.85 -24.15 33.4 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 118.826 1.313 . . . . 51.31 113.18 -178.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 10.0 tp -123.16 125.22 44.72 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.014 -0.735 . . . . 51.1 109.014 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -103.61 142.95 33.42 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.331 -0.618 . . . . 80.08 109.331 173.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' VAL . . . . . . . . . . . . . 73.0 t -125.76 125.95 69.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 C-N-CA 123.905 0.882 . . . . 59.36 109.471 -172.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 3.1 mtpp -111.55 139.54 46.9 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 109.137 -0.69 . . . . 83.31 109.137 164.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . 101.56 -147.59 17.62 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 110.194 -1.162 . . . . 67.97 110.194 -176.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' ASN . . . . . . . . . . . . . 24.5 t30 -88.14 115.51 25.67 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 106.663 -1.606 . . . . 77.51 106.663 -167.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 2.0 p -69.25 -21.19 24.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 C-N-CA 119.216 -0.994 . . . . 61.08 111.276 -172.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 43.8 mtm -75.71 -22.47 56.57 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 118.409 -1.316 . . . . 122.56 111.64 -177.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 56.2 mttm -83.11 -29.94 28.32 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 118.331 -1.348 . . . . 76.04 111.653 170.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.36 -42.93 99.79 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 119.434 -0.906 . . . . 66.8 110.831 170.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' ALA . . . . . . . . . . . . . . . -54.82 -34.23 62.55 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-O 121.208 0.528 . . . . 66.34 111.607 177.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -87.53 15.02 7.15 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 113.585 0.957 . . . . 66.05 113.585 179.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' ILE . . . . . . . . . . . . . 4.2 tp -64.89 -42.59 95.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 C-N-CA 119.914 -0.714 . . . . 66.61 111.465 -170.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -74.95 -21.81 58.95 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 114.359 -2.937 . . . . 86.83 112.102 -176.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' GLY . . . . . . . . . . . . . . . -68.4 -45.66 67.66 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 119.541 -1.314 . . . . 72.79 111.687 166.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' ILE . . . . . . . . . . . . . 92.3 mt -55.64 -38.35 49.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 CA-C-O 121.098 0.475 . . . . 70.64 110.716 174.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 78.6 mt -74.56 -28.64 61.03 Favored 'General case' 0 C--O 1.232 0.149 0 O-C-N 121.894 -0.504 . . . . 82.75 112.061 -173.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -70.31 -64.95 0.79 Allowed 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.244 0.545 . . . . 92.12 110.778 176.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' ASN . . . . . 0.431 ' O ' ' NE2' ' B' ' 28' ' ' GLN . 62.9 m-20 -60.79 -17.43 49.28 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 113.755 1.021 . . . . 102.51 113.755 -177.158 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' ALA . . . . . . . . . . . . . . . -55.3 -70.1 0.12 Allowed 'General case' 0 C--O 1.242 0.667 0 CA-C-N 118.228 0.467 . . . . 89.09 111.129 175.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 1.8 pp0? -104.02 10.09 36.24 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.487 0.921 . . . . 90.72 113.487 -170.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -66.22 97.5 0.4 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 118.692 0.678 . . . . 94.27 109.924 -173.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 . . . . . 0 C--O 1.235 0.33 0 CA-C-O 121.024 0.44 . . . . 93.09 110.716 174.233 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . 0.733 ' O ' ' OD1' ' A' ' 84' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 0' ' ' MET . . . . . 0.841 ' O ' ' NH2' ' A' ' 17' ' ' ARG . 3.2 tpt . . . . . 0 CA--C 1.507 -0.707 0 N-CA-C 110.128 -0.323 . . . . 98.209999999999994 110.128 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.84 117.01 19.54 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 107.091 -1.448 . . . . 73.140000000000001 107.091 164.48 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 53.3 mt -81.38 -19.82 41.84 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 115.949 -0.569 . . . . 61.789999999999999 112.212 -165.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.7 pttt -62.68 151.32 38.63 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.224 0.535 . . . . 78.730000000000004 109.559 177.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.7 t -130.89 140.66 48.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 N-CA-C 108.028 -1.101 . . . . 72.219999999999999 108.028 -175.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -61.11 143.32 55.67 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 120.011 -0.675 . . . . 99.950000000000003 110.077 176.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 88.46 -9.07 77.05 Favored Glycine 0 N--CA 1.443 -0.841 0 CA-C-O 119.146 -0.808 . . . . 65.709999999999994 114.199 -177.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -123.15 90.33 3.27 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 105.631 -1.988 . . . . 62.780000000000001 105.631 176.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 54.6 m -59.41 -31.04 68.9 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 113.61 -1.632 . . . . 72.010000000000005 111.708 -177.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 76.7 p -78.36 -13.69 59.74 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 113.447 0.906 . . . . 54.509999999999998 113.447 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 51.9 p -72.89 -11.86 60.75 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 119.1 -1.04 . . . . 53.079999999999998 113.051 -163.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.3 tt -55.7 -25.83 19.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-N 119.036 0.834 . . . . 55.880000000000003 111.245 173.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.8 tp -61.94 -28.19 43.83 Favored 'Isoleucine or valine' 0 C--O 1.244 0.803 0 C-N-CA 119.528 -0.869 . . . . 56.119999999999997 110.716 -177.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -67.6 -35.48 79.05 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 118.694 -1.202 . . . . 56.18 111.262 177.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -65.34 -43.52 90.63 Favored 'General case' 0 C--O 1.243 0.713 0 O-C-N 122.193 -0.317 . . . . 55.460000000000001 110.703 171.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 93.0 t -59.3 -49.8 82.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 N-CA-C 109.594 -0.521 . . . . 52.420000000000002 109.594 178.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ILE . . . . . 0.429 HG22 HG21 ' A' ' 64' ' ' VAL . 55.6 mt -62.3 -44.16 98.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 C-N-CA 119.956 -0.697 . . . . 58.18 111.219 -176.831 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ARG . . . . . 0.841 ' NH2' ' O ' ' A' ' 0' ' ' MET . 52.8 ttp180 -57.85 -50.64 72.61 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 119.857 -0.737 . . . . 53.869999999999997 110.87 179.953 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -60.44 -46.16 91.04 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.991 -0.284 . . . . 61.259999999999998 111.656 179.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.71 -36.42 87.47 Favored Glycine 0 C--N 1.335 0.472 0 C-N-CA 119.282 -1.437 . . . . 54.57 111.532 -177.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.6 tp -71.28 -40.86 70.65 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 122.255 -0.556 . . . . 67.950000000000003 111.737 177.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -86.75 -5.49 59.1 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 113.335 0.865 . . . . 58.549999999999997 113.335 -173.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ASP . . . . . 0.62 ' HB3' ' HG3' ' A' ' 25' ' ' GLN . 39.4 t0 -56.34 117.8 18.42 Favored Pre-proline 0 C--O 1.245 0.825 0 CA-C-N 118.203 0.456 . . . . 63.020000000000003 110.009 -179.217 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -58.28 -30.38 90.76 Favored 'Trans proline' 0 CA--C 1.513 -0.562 0 C-N-CA 120.503 0.802 . . . . 60.729999999999997 113.534 -178.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.0 m -74.98 0.48 15.72 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 119.087 -1.045 . . . . 68.959999999999994 112.72 176.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLN . . . . . 0.62 ' HG3' ' HB3' ' A' ' 22' ' ' ASP . 2.9 mt-30 -116.92 31.66 6.62 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 118.882 0.764 . . . . 73.409999999999997 112.279 176.268 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.08 -30.13 34.4 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 112.054 0.39 . . . . 70.450000000000003 112.054 -177.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.5 mtmt -86.57 -37.11 18.46 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 118.712 -1.195 . . . . 86.519999999999996 112.438 -177.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -55.11 -48.9 72.98 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 121.227 -0.92 . . . . 82.680000000000007 110.692 169.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LYS . . . . . 0.405 ' O ' HG13 ' A' ' 33' ' ' ILE . 21.1 tttt -53.33 -49.44 67.05 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.152 0.501 . . . . 88.730000000000004 111.401 175.005 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.87 -30.03 71.01 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 112.217 0.451 . . . . 89.120000000000005 112.217 -171.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -82.08 -35.04 29.08 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 119.806 -0.758 . . . . 102.09999999999999 112.225 179.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.6 m -69.37 -27.17 65.08 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 118.122 -1.431 . . . . 93.450000000000003 110.822 178.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 29' ' ' LYS . 33.8 mt -74.16 -32.79 33.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 120.015 -0.674 . . . . 93.920000000000002 110.512 172.22 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -79.3 -38.41 35.38 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.175 -0.61 . . . . 107.11 112.044 -172.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.62 -48.79 7.61 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 112.918 0.71 . . . . 104.95 112.918 178.575 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.1 -47.35 85.03 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 120.073 -0.651 . . . . 100.08 110.434 -174.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 47.7 t30 50.66 50.86 18.09 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.529 0.68 . . . . 90.930000000000007 112.715 167.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ALA . . . . . 0.635 ' N ' ' HB3' ' A' ' 59' ' ' LYS . . . -162.11 152.28 16.82 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.026 -0.534 . . . . 91.379999999999995 110.107 178.95 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ILE . . . . . 0.529 HD12 ' HG2' ' A' ' 59' ' ' LYS . 3.6 mp -90.73 126.91 43.47 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 108.078 -1.082 . . . . 85.549999999999997 108.078 161.534 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 25.0 mt -115.6 129.51 71.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 N-CA-C 109.034 -0.728 . . . . 76.390000000000001 109.034 179.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -105.27 137.0 36.82 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 C-N-CA 123.233 0.613 . . . . 71.810000000000002 109.468 173.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PHE . . . . . 0.434 ' O ' ' HA ' ' A' ' 53' ' ' SER . 93.9 m-85 -108.77 119.54 39.85 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.699 -0.852 . . . . 68.849999999999994 108.699 174.21 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -101.85 103.7 14.41 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 106.964 -1.495 . . . . 82.579999999999998 106.964 172.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 25.4 mt -95.47 143.18 27.02 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.063 -0.347 . . . . 58.68 110.063 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.8 mmtt -126.94 131.88 50.98 Favored 'General case' 0 CA--C 1.518 -0.261 0 C-N-CA 124.051 0.94 . . . . 67.829999999999998 108.612 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 47.9 p30 -108.39 172.51 6.79 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 119.302 -0.959 . . . . 66.400000000000006 110.028 -179.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.0 mtpt -76.23 0.15 20.19 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.856 -1.066 . . . . 93.359999999999999 112.675 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -91.93 1.93 56.86 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 118.854 0.752 . . . . 76.519999999999996 112.286 169.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 88.84 1.95 79.22 Favored Glycine 0 N--CA 1.441 -1.0 0 CA-C-O 118.73 -1.039 . . . . 75.659999999999997 115.654 177.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.0 mmmt -94.04 158.34 15.67 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 119.366 1.583 . . . . 85.530000000000001 112.028 -176.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 93.6 m -118.8 129.8 55.43 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.734 1.614 . . . . 69.859999999999999 108.783 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -130.0 144.91 51.59 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.24 -1.022 . . . . 73.840000000000003 108.24 168.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' SER . . . . . 0.434 ' HA ' ' O ' ' A' ' 42' ' ' PHE . 6.0 m -126.2 152.75 45.61 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 121.532 0.682 . . . . 72.019999999999996 111.594 -178.336 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 20.9 m-90 -138.92 154.63 48.37 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 106.6 -1.629 . . . . 64.209999999999994 106.6 176.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 48.1 p90 -119.56 146.92 45.06 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.518 0.675 . . . . 80.519999999999996 109.505 176.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.5 tp -127.75 94.12 3.87 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 105.16 -2.163 . . . . 72.079999999999998 105.16 178.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASP . . . . . 0.501 ' O ' ' HA2' ' A' ' 62' ' ' GLY . 59.1 t0 -78.01 102.96 7.66 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.028 -1.101 . . . . 83.200000000000003 108.028 179.873 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 52.4 mt -120.92 38.91 3.93 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 113.932 1.086 . . . . 83.579999999999998 113.932 177.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LYS . . . . . 1.206 ' NZ ' ' HZ1' ' A' ' 113' ' ' LYS . 15.3 pttt -134.79 -20.2 1.77 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.771 0.286 . . . . 99.200000000000003 111.771 177.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -96.42 -105.36 0.16 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.508 0.723 . . . . 95.829999999999998 109.079 171.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASP . . . . . 0.536 ' H ' ' HZ3' ' A' ' 72' ' ' LYS . 12.0 m-20 -109.63 -5.88 15.53 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 114.17 1.174 . . . . 107.25 114.17 -177.767 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLY . . . . . 0.501 ' HA2' ' O ' ' A' ' 57' ' ' ASP . . . 100.74 55.18 0.95 Allowed Glycine 0 CA--C 1.518 0.226 0 N-CA-C 118.439 2.136 . . . . 85.140000000000001 118.439 165.078 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -109.61 150.75 27.76 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 121.247 -1.149 . . . . 86.159999999999997 109.545 -173.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' VAL . . . . . 0.429 HG21 HG22 ' A' ' 16' ' ' ILE . 59.4 t -117.59 134.91 59.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 107.954 -1.128 . . . . 63.75 107.954 176.646 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -160.89 -179.71 35.81 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 118.272 -1.918 . . . . 68.390000000000001 113.52 177.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 23.7 tptp -84.9 143.04 29.27 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.588 -1.306 . . . . 73.560000000000002 110.767 -176.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 108.92 168.31 20.73 Favored Glycine 0 N--CA 1.435 -1.387 0 CA-C-O 121.487 0.493 . . . . 72.700000000000003 111.889 176.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -97.66 13.56 29.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.949 -0.626 . . . . 83.150000000000006 112.513 -177.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.9 124.81 21.26 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 109.667 -0.494 . . . . 95.950000000000003 109.667 177.328 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.7 t -69.15 136.1 89.24 Favored Pre-proline 0 C--N 1.343 0.307 0 C-N-CA 127.614 2.366 . . . . 98.379999999999995 110.832 167.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -71.28 -27.8 19.21 Favored 'Trans proline' 0 CA--C 1.533 0.464 0 N-CA-C 116.203 1.578 . . . . 105.26000000000001 116.203 176.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LYS . . . . . 0.536 ' HZ3' ' H ' ' A' ' 61' ' ' ASP . 4.5 mttt -104.48 104.92 14.86 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 121.441 1.928 . . . . 106.81999999999999 108.102 178.277 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 66.36 170.94 3.93 Favored Glycine 0 CA--C 1.519 0.301 0 N-CA-C 106.431 -2.667 . . . . 110.01000000000001 106.431 -169.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -129.24 -178.56 4.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 119.623 1.711 . . . . 110.87 111.028 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -54.86 139.48 39.94 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 114.401 -1.272 . . . . 91.5 112.401 -158.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASP . . . . . 0.715 ' HB3' ' HD2' ' A' ' 113' ' ' LYS . 1.6 m-20 -99.27 -41.27 7.54 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.991 -1.004 . . . . 91.180000000000007 113.457 175.617 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 7.7 pt -139.57 144.24 29.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 108.303 -0.999 . . . . 85.650000000000006 108.303 179.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -125.22 129.74 50.68 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 123.098 0.559 . . . . 87.310000000000002 110.859 -178.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.2 mt -114.74 126.15 54.53 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 123.67 0.788 . . . . 66.700000000000003 109.602 179.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 32.0 m -118.47 125.04 49.05 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.548 -0.908 . . . . 59.399999999999999 108.548 179.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -160.12 169.53 23.14 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.847 -1.168 . . . . 53.549999999999997 107.847 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.9 p -77.38 161.64 27.86 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 122.243 1.02 . . . . 53.899999999999999 110.733 -179.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -64.24 -39.22 93.51 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 114.758 -1.11 . . . . 58.159999999999997 111.411 177.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASP . . . . . 0.733 ' OD1' ' O ' ' A' ' 201' ' ' HOH . 3.8 m-20 -68.22 -40.67 82.03 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.268 -0.573 . . . . 79.049999999999997 111.5 -179.973 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' HIS . . . . . 0.509 ' HD2' ' O ' ' A' ' 203' ' ' HOH . 8.1 m-70 -73.54 -35.68 65.55 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 119.609 -0.836 . . . . 62.75 111.212 -177.92 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -64.52 -41.94 96.08 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 119.716 -0.793 . . . . 55.229999999999997 110.199 175.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -63.41 -39.06 93.49 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 118.873 -1.131 . . . . 78.569999999999993 110.908 176.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -61.56 -43.83 98.14 Favored 'General case' 0 CA--C 1.511 -0.552 0 C-N-CA 118.559 -1.256 . . . . 73.209999999999994 110.71 174.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 50.1 tp -61.35 -44.08 97.78 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-O 120.952 0.406 . . . . 66.75 111.283 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.7 t -68.34 -41.48 83.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 O-C-N 121.744 -0.597 . . . . 64.939999999999998 111.052 -176.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -74.95 -4.49 38.46 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 114.088 1.144 . . . . 82.290000000000006 114.088 -179.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.3 12.01 68.32 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-O 118.941 -0.921 . . . . 75.760000000000005 115.384 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 55.2 mttt -103.43 15.24 29.56 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 118.596 1.198 . . . . 83.319999999999993 113.14 -178.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -156.48 150.45 25.06 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.084 -0.709 . . . . 69.430000000000007 109.084 176.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -105.15 134.34 48.42 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.044 0.538 . . . . 79.569999999999993 109.943 -176.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.51 -45.73 86.0 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 112.769 0.655 . . . . 67.099999999999994 112.769 -172.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -73.63 -28.07 61.6 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 117.057 -1.857 . . . . 83.049999999999997 110.596 -176.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ARG . . . . . 0.704 ' O ' ' HG3' ' A' ' 98' ' ' ARG 0.325 5.1 tpt180 -73.99 -34.7 64.31 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 114.796 -2.761 . . . . 92.159999999999997 114.589 169.32 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 14.4 mt -54.53 -36.46 64.3 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 117.767 -1.573 . . . . 64.090000000000003 110.398 167.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -67.51 -51.47 50.59 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 112.392 0.516 . . . . 63.119999999999997 112.392 179.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 73.9 mtm -70.16 -15.08 62.9 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.336 -0.853 . . . . 72.879999999999995 112.228 -173.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 71.7 p -97.23 8.92 43.57 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 112.921 0.711 . . . . 64.349999999999994 112.921 -179.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 76.38 6.19 83.37 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 119.668 -1.254 . . . . 51.359999999999999 114.818 177.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -81.48 -25.48 36.0 Favored 'General case' 0 C--O 1.239 0.553 0 CA-C-N 118.682 1.241 . . . . 63.950000000000003 111.452 -179.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.4 tp -123.49 125.92 45.78 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 107.854 -1.165 . . . . 56.140000000000001 107.854 179.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -108.5 145.08 35.26 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.221 0.534 . . . . 74.790000000000006 111.176 177.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 97.6 t -125.06 115.26 43.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 N-CA-C 107.377 -1.342 . . . . 74.730000000000004 107.377 -173.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 17.1 ttmt -116.0 150.2 37.59 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.999 0.919 . . . . 86.219999999999999 109.664 173.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 104.56 -145.75 16.05 Favored Glycine 0 CA--C 1.519 0.325 0 N-CA-C 115.993 1.157 . . . . 91.219999999999999 115.993 -179.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ASN . . . . . 0.448 ' CG ' ' HB2' ' A' ' 112' ' ' MET . 24.5 t-20 -94.8 119.73 33.87 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.047 0.939 . . . . 95.840000000000003 110.346 -164.649 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 2.4 m -67.59 -18.39 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 CA-C-O 122.412 1.101 . . . . 91.359999999999999 108.984 178.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' MET . . . . . 0.448 ' HB2' ' CG ' ' A' ' 110' ' ' ASN 0.262 11.8 mmm -74.86 -36.46 62.31 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 126.466 1.907 . . . . 118.68000000000001 110.484 -167.163 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LYS . . . . . 1.206 ' HZ1' ' NZ ' ' A' ' 59' ' ' LYS . 15.0 mttt -92.03 -31.83 15.43 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 127.049 2.14 . . . . 100.45999999999999 112.046 169.948 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ALA . . . . . 0.471 ' O ' HG23 ' A' ' 117' ' ' ILE . . . -62.64 -40.63 97.61 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 115.738 -0.665 . . . . 106.89 111.952 -175.373 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -53.32 -44.33 68.31 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.926 -0.31 . . . . 106.03 111.83 -176.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -95.01 130.22 41.76 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.647 -0.658 . . . . 103.70999999999999 109.871 172.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ILE . . . . . 0.618 ' O ' HD12 ' A' ' 117' ' ' ILE . 1.6 pp . . . . . 0 C--N 1.329 -0.318 0 C-N-CA 118.276 -1.37 . . . . 106.11 113.662 -175.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 0' ' ' MET . . . . . 0.794 ' O ' ' NH2' ' B' ' 17' ' ' ARG . 34.9 mmm . . . . . 0 CA--C 1.502 -0.903 0 N-CA-C 108.177 -1.046 . . . . 95.099999999999994 108.177 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 34.5 t -78.36 119.24 21.41 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 103.028 -2.953 . . . . 69.140000000000001 103.028 151.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 70.3 mt -83.09 -16.19 47.87 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 113.883 1.068 . . . . 62.350000000000001 113.883 -162.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 17.7 tttm -61.52 141.78 57.5 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.332 0.587 . . . . 76.640000000000001 111.048 177.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 74.3 t -133.7 139.91 47.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 108.126 -1.064 . . . . 66.049999999999997 108.126 -177.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -62.85 141.56 58.6 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.575 0.547 . . . . 87.230000000000004 110.523 176.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 87.57 -8.96 75.5 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 115.08 0.792 . . . . 67.150000000000006 115.08 -179.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -124.16 92.99 3.79 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 107.325 -1.361 . . . . 68.049999999999997 107.325 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 30.7 m -57.58 -34.78 69.58 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.107 -0.951 . . . . 71.680000000000007 111.901 -175.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' SER . . . . . 0.449 ' O ' HD12 ' B' ' 12' ' ' ILE . 31.6 p -77.54 -8.82 58.4 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 119.031 -1.068 . . . . 62.560000000000002 112.816 -175.668 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 84.3 p -73.19 -17.17 61.39 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 119.229 -0.989 . . . . 61.450000000000003 113.46 -164.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 13.3 tt -58.69 -24.21 25.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 CA-C-N 118.805 0.73 . . . . 69.129999999999995 111.357 172.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ILE . . . . . 0.537 HD13 HG21 ' B' ' 90' ' ' VAL . 19.7 mt -60.47 -32.53 51.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 C-N-CA 123.145 0.578 . . . . 70.200000000000003 111.604 179.026 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 13' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -68.34 -34.94 77.0 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 118.775 -1.17 . . . . 56.759999999999998 111.701 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -60.85 -44.07 97.5 Favored 'General case' 0 C--O 1.238 0.448 0 O-C-N 121.844 -0.535 . . . . 68.040000000000006 110.876 175.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 58.0 t -64.49 -44.99 96.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 CA-C-O 120.837 0.351 . . . . 51.979999999999997 110.703 178.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ILE . . . . . . . . . . . . . 73.3 mt -62.98 -43.83 99.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 O-C-N 121.754 -0.591 . . . . 58.170000000000002 110.895 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ARG . . . . . 0.794 ' NH2' ' O ' ' B' ' 0' ' ' MET . 50.1 ttp180 -57.67 -49.0 77.94 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 119.207 -0.997 . . . . 52.369999999999997 111.119 178.143 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -57.9 -46.02 85.56 Favored 'General case' 0 C--O 1.24 0.566 0 C-N-CA 120.816 -0.354 . . . . 70.780000000000001 111.308 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' GLY . . . . . 0.408 ' HA2' HD21 ' B' ' 127' ' ' ASN . . . -69.05 -36.53 81.07 Favored Glycine 0 C--N 1.333 0.366 0 C-N-CA 119.465 -1.35 . . . . 55.009999999999998 113.064 -178.459 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 15.8 tp -68.43 -40.66 81.1 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 121.915 -0.756 . . . . 68.329999999999998 111.796 177.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -86.22 -8.84 57.49 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 124.107 0.963 . . . . 55.82 113.35 -172.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -51.1 118.68 10.87 Favored Pre-proline 0 N--CA 1.443 -0.798 0 N-CA-C 108.492 -0.929 . . . . 70.459999999999994 108.492 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -56.86 -30.58 85.97 Favored 'Trans proline' 0 C--O 1.238 0.504 0 CA-C-N 118.753 0.59 . . . . 57.240000000000002 113.18 -177.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' SER . . . . . . . . . . . . . 3.0 m -75.69 1.58 14.25 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.053 1.131 . . . . 67.0 114.053 177.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLN . . . . . 0.534 ' HG3' ' OD1' ' B' ' 127' ' ' ASN . 90.3 mm-40 -115.59 27.63 9.2 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 119.726 1.148 . . . . 86.030000000000001 111.568 176.93 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.77 -30.12 31.11 Favored 'General case' 0 C--O 1.246 0.876 0 O-C-N 123.461 0.476 . . . . 68.239999999999995 111.391 -178.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -75.61 -45.16 39.04 Favored 'General case' 0 CA--C 1.508 -0.648 0 C-N-CA 119.561 -0.856 . . . . 88.939999999999998 111.678 -175.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' GLN . . . . . 0.72 ' NE2' ' HB3' ' B' ' 123' ' ' ASN . 1.9 tp60 -75.31 -35.57 61.23 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 116.191 -2.204 . . . . 100.23 109.159 -175.004 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LYS . . . . . 0.472 ' O ' HG13 ' B' ' 33' ' ' ILE . 35.5 ttpt -50.23 -50.82 48.56 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 119.564 -0.854 . . . . 67.079999999999998 109.456 172.25 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -66.11 -29.67 70.03 Favored 'General case' 0 C--O 1.239 0.517 0 C-N-CA 120.14 -0.624 . . . . 71.629999999999995 110.698 -178.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -75.54 -38.33 59.4 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.258 -0.577 . . . . 92.290000000000006 111.052 177.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 5.2 m -71.03 -28.68 64.56 Favored 'General case' 0 CA--C 1.516 -0.346 0 C-N-CA 118.05 -1.46 . . . . 74.379999999999995 111.338 177.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ILE . . . . . 0.472 HG13 ' O ' ' B' ' 29' ' ' LYS . 5.2 mt -71.3 -35.09 56.33 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 C-N-CA 119.052 -1.059 . . . . 77.409999999999997 111.008 177.823 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -78.4 -30.35 47.7 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.043 -0.663 . . . . 96.620000000000005 110.863 -177.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -78.04 -54.48 6.23 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 118.116 0.417 . . . . 86.959999999999994 111.359 176.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.26 -48.49 67.59 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 121.779 -0.576 . . . . 78.659999999999997 112.21 -176.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 52.2 t-20 48.87 49.7 18.75 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.976 0.893 . . . . 82.219999999999999 110.368 175.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -161.32 148.97 15.14 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.749 -0.66 . . . . 74.769999999999996 110.206 -177.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ILE . . . . . 0.479 HD13 ' HB3' ' B' ' 70' ' ' SER . 29.3 mt -89.87 124.65 42.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 106.155 -1.794 . . . . 69.260000000000005 106.155 162.183 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 20.7 mt -114.31 125.3 71.58 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 N-CA-C 106.713 -1.588 . . . . 62.310000000000002 106.713 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 53.3 t -105.98 135.82 42.73 Favored 'Isoleucine or valine' 0 C--O 1.244 0.798 0 CA-C-O 121.892 0.853 . . . . 57.130000000000003 109.936 173.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -107.35 118.64 37.26 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 107.139 -1.43 . . . . 56.170000000000002 107.139 173.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -104.19 103.39 13.16 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 106.979 -1.489 . . . . 53.520000000000003 106.979 171.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 14.1 mt -93.84 144.51 25.37 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.248 0.547 . . . . 55.18 109.914 -179.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 47.0 mmtt -123.64 131.14 53.54 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 108.136 -1.061 . . . . 56.829999999999998 108.136 -178.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 52.6 p30 -107.84 170.69 7.83 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 117.127 -1.829 . . . . 62.810000000000002 110.761 -176.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 20.4 mtmt -75.88 11.56 1.37 Allowed 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 113.994 -1.457 . . . . 90.090000000000003 111.133 176.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -99.16 0.21 42.93 Favored 'General case' 0 C--N 1.348 0.532 0 CA-C-N 120.54 1.518 . . . . 81.269999999999996 112.105 162.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 89.5 5.11 72.53 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 119.795 -1.193 . . . . 68.909999999999997 115.743 -177.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 10.2 mttt -95.33 160.88 14.32 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 119.206 1.503 . . . . 88.569999999999993 112.3 -175.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' THR . . . . . . . . . . . . . 35.7 m -120.88 126.82 51.02 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 114.621 -1.172 . . . . 60.109999999999999 109.251 174.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -127.8 144.14 51.1 Favored 'General case' 0 C--O 1.247 0.972 0 N-CA-C 108.127 -1.064 . . . . 65.980000000000004 108.127 169.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' SER . . . . . . . . . . . . . 4.6 m -125.72 153.72 43.51 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.389 0.614 . . . . 60.770000000000003 111.524 -178.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' TRP . . . . . . . . . . . . . 27.9 m-90 -139.44 152.68 47.24 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 113.584 -1.644 . . . . 56.0 107.13 177.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -123.67 147.79 47.09 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.936 0.874 . . . . 68.590000000000003 111.254 177.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 21.3 tp -128.8 95.95 4.24 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 103.994 -2.595 . . . . 60.189999999999998 103.994 -179.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -80.44 102.12 9.46 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 107.697 -1.223 . . . . 71.310000000000002 107.697 -179.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 54.2 mt -117.2 35.32 4.7 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 122.549 0.34 . . . . 64.079999999999998 111.02 174.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -124.6 -31.29 3.24 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 113.537 0.94 . . . . 81.519999999999996 113.537 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -99.94 -102.28 0.23 Allowed 'General case' 0 C--O 1.237 0.41 0 CA-C-N 118.38 0.536 . . . . 78.730000000000004 111.418 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -109.02 -6.45 15.65 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 114.599 1.333 . . . . 85.870000000000005 114.599 -174.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.85 81.74 1.61 Allowed Glycine 0 C--O 1.244 0.768 0 C-N-CA 118.232 -1.937 . . . . 74.859999999999999 110.512 170.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -135.57 147.12 48.62 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.694 -0.854 . . . . 68.510000000000005 108.694 -175.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 45.5 t -122.52 135.46 62.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 105.931 -1.877 . . . . 57.479999999999997 105.931 168.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . -161.27 -177.54 34.45 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 117.873 -2.108 . . . . 56.460000000000001 112.678 178.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 25.0 tptp -84.77 143.96 28.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.101 -1.05 . . . . 65.140000000000001 110.222 -177.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 112.29 169.17 17.97 Favored Glycine 0 CA--C 1.518 0.281 0 CA-C-O 122.941 1.301 . . . . 61.920000000000002 112.868 173.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -97.61 9.35 42.73 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 114.042 -1.079 . . . . 79.079999999999998 112.664 -177.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . . 2.2 pttp -141.55 130.46 23.09 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.402 -0.962 . . . . 88.430000000000007 108.402 174.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' SER . . . . . 0.479 ' HB3' HD13 ' B' ' 39' ' ' ILE . 1.6 t -66.71 142.91 97.82 Favored Pre-proline 0 C--N 1.322 -0.618 0 C-N-CA 119.928 -0.709 . . . . 79.609999999999999 109.089 166.039 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 71' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -66.81 -18.0 52.49 Favored 'Trans proline' 0 CA--C 1.517 -0.34 0 C-N-CA 118.453 -0.565 . . . . 83.400000000000006 112.726 174.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -100.88 27.08 6.25 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 113.464 0.912 . . . . 81.959999999999994 113.464 -177.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' GLY . . . . . . . . . . . . . . . 148.96 178.3 23.88 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 119.608 -1.282 . . . . 85.620000000000005 111.846 -174.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -110.64 163.24 13.94 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 114.535 -0.833 . . . . 93.620000000000005 108.9 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.17 139.2 57.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.439 -1.255 . . . . 77.170000000000002 110.103 -168.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -91.02 -30.61 16.7 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.875 -0.602 . . . . 82.379999999999995 110.325 170.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' ILE . . . . . 0.487 HD11 ' HB2' ' B' ' 113' ' ' LYS . 7.3 mt -138.85 143.01 32.91 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 108.827 -0.805 . . . . 69.590000000000003 108.827 178.704 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 78' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -124.84 128.55 48.87 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 106.643 -1.614 . . . . 81.829999999999998 106.643 173.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 36.0 mt -117.16 123.3 46.36 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 106.47 -1.678 . . . . 59.439999999999998 106.47 177.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' THR . . . . . . . . . . . . . 29.9 m -117.43 122.84 44.87 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.669 -0.863 . . . . 47.18 108.669 -179.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -162.6 168.88 21.09 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 107.742 -1.207 . . . . 50.289999999999999 107.742 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 29.2 p -73.7 160.21 31.88 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 122.303 1.049 . . . . 55.490000000000002 110.466 -179.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -61.87 -38.1 87.02 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 114.558 -1.201 . . . . 71.319999999999993 110.633 177.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -68.29 -40.02 81.9 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.043 -0.663 . . . . 77.909999999999997 111.288 178.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -72.38 -34.89 68.27 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 118.447 -1.301 . . . . 58.850000000000001 111.455 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -62.18 -42.78 99.6 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.401 -0.919 . . . . 59.460000000000001 110.687 176.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -65.5 -37.48 86.93 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.034 -0.666 . . . . 91.799999999999997 111.592 178.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -61.16 -43.43 98.9 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.557 -0.857 . . . . 75.170000000000002 110.899 173.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.2 tp -61.93 -41.91 98.49 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 121.021 -0.272 . . . . 58.969999999999999 111.609 -179.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' VAL . . . . . 0.537 HG21 HD13 ' B' ' 12' ' ' ILE . 15.6 m -70.41 -37.67 71.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 C-N-CA 119.45 -0.9 . . . . 72.790000000000006 110.445 179.437 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 73.4 mt-10 -70.99 -11.93 61.25 Favored 'General case' 0 C--N 1.345 0.374 0 C-N-CA 118.904 -1.119 . . . . 94.060000000000002 112.386 177.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.4 9.67 75.44 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-O 119.117 -0.824 . . . . 78.409999999999997 114.74 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -97.54 13.13 31.07 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 118.348 1.074 . . . . 87.950000000000003 111.436 -179.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -150.39 145.67 26.22 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 106.688 -1.597 . . . . 69.150000000000006 106.688 172.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -108.28 132.39 53.74 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.553 -1.277 . . . . 61.100000000000001 107.553 -175.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.43 -37.45 83.56 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 119.806 -0.758 . . . . 56.609999999999999 110.735 -174.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -71.97 -34.09 68.68 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 118.989 -1.085 . . . . 64.950000000000003 111.079 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ARG . . . . . . . . . . . . . 31.8 tpt180 -72.13 -39.46 68.79 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.436 -0.506 . . . . 69.670000000000002 111.24 174.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 30.7 mt -58.22 -39.2 78.43 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.189 -0.604 . . . . 53.060000000000002 111.391 174.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -66.43 -45.8 78.63 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.817 0.341 . . . . 51.0 110.966 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 39.3 mmm -68.44 -29.65 68.35 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.12 -0.632 . . . . 54.770000000000003 112.203 -174.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' THR . . . . . . . . . . . . . 82.7 p -91.05 10.13 28.0 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.619 0.97 . . . . 52.579999999999998 113.619 177.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' GLY . . . . . . . . . . . . . . . 78.95 6.98 88.66 Favored Glycine 0 C--N 1.333 0.361 0 N-CA-C 116.065 1.186 . . . . 48.420000000000002 116.065 178.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -82.85 -24.15 33.4 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 118.826 1.313 . . . . 51.310000000000002 113.18 -178.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 10.0 tp -123.16 125.22 44.72 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.014 -0.735 . . . . 51.100000000000001 109.014 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -103.61 142.95 33.42 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.331 -0.618 . . . . 80.079999999999998 109.331 173.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' VAL . . . . . . . . . . . . . 73.0 t -125.76 125.95 69.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 C-N-CA 123.905 0.882 . . . . 59.359999999999999 109.471 -172.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 3.1 mtpp -111.55 139.54 46.9 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 109.137 -0.69 . . . . 83.310000000000002 109.137 164.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . 101.56 -147.59 17.62 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 110.194 -1.162 . . . . 67.969999999999999 110.194 -176.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' ASN . . . . . . . . . . . . . 24.5 t30 -88.14 115.51 25.67 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 106.663 -1.606 . . . . 77.510000000000005 106.663 -167.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 2.0 p -69.25 -21.19 24.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 C-N-CA 119.216 -0.994 . . . . 61.079999999999998 111.276 -172.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 43.8 mtm -75.71 -22.47 56.57 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 118.409 -1.316 . . . . 122.56 111.64 -177.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' LYS . . . . . 0.487 ' HB2' HD11 ' B' ' 77' ' ' ILE . 56.2 mttm -83.11 -29.94 28.32 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 118.331 -1.348 . . . . 76.040000000000006 111.653 170.975 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.36 -42.93 99.79 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 119.434 -0.906 . . . . 66.799999999999997 110.831 170.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' ALA . . . . . . . . . . . . . . . -54.82 -34.23 62.55 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-O 121.208 0.528 . . . . 66.340000000000003 111.607 177.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -87.53 15.02 7.15 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 113.585 0.957 . . . . 66.049999999999997 113.585 179.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' ILE . . . . . . . . . . . . . 4.2 tp -64.89 -42.59 95.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 C-N-CA 119.914 -0.714 . . . . 66.609999999999999 111.465 -170.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -74.95 -21.81 58.95 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 114.359 -2.937 . . . . 86.829999999999998 112.102 -176.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' GLY . . . . . . . . . . . . . . . -68.4 -45.66 67.66 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 119.541 -1.314 . . . . 72.790000000000006 111.687 166.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' ILE . . . . . . . . . . . . . 92.3 mt -55.64 -38.35 49.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 CA-C-O 121.098 0.475 . . . . 70.640000000000001 110.716 174.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 78.6 mt -74.56 -28.64 61.03 Favored 'General case' 0 C--O 1.232 0.149 0 O-C-N 121.894 -0.504 . . . . 82.75 112.061 -173.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -70.31 -64.95 0.79 Allowed 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.244 0.545 . . . . 92.120000000000005 110.778 176.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' ASN . . . . . 0.72 ' HB3' ' NE2' ' B' ' 28' ' ' GLN . 62.9 m-20 -60.79 -17.43 49.28 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 113.755 1.021 . . . . 102.51000000000001 113.755 -177.158 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 124' ' ' ALA . . . . . . . . . . . . . . . -55.3 -70.1 0.12 Allowed 'General case' 0 C--O 1.242 0.667 0 CA-C-N 118.228 0.467 . . . . 89.090000000000003 111.129 175.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 1.8 pp0? -104.02 10.09 36.24 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.487 0.921 . . . . 90.719999999999999 113.487 -170.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -66.22 97.5 0.4 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 118.692 0.678 . . . . 94.269999999999996 109.924 -173.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' ASN . . . . . 0.534 ' OD1' ' HG3' ' B' ' 25' ' ' GLN . 87.3 m-20 . . . . . 0 C--O 1.235 0.33 0 CA-C-O 121.024 0.44 . . . . 93.090000000000003 110.716 174.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 201' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . 0.733 ' O ' ' OD1' ' A' ' 84' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . 0.509 ' O ' ' HD2' ' A' ' 85' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' MET . . . . . 0.841 ' O ' ' NH2' ' A' ' 17' ' ' ARG . 3.2 tpt . . . . . 0 CA--C 1.507 -0.707 0 N-CA-C 110.128 -0.323 . . . . 98.21 110.128 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.84 117.01 19.54 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 107.091 -1.448 . . . . 73.14 107.091 164.48 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 53.3 mt -81.38 -19.82 41.84 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 115.949 -0.569 . . . . 61.79 112.212 -165.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.7 pttt -62.68 151.32 38.63 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.224 0.535 . . . . 78.73 109.559 177.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.7 t -130.89 140.66 48.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 N-CA-C 108.028 -1.101 . . . . 72.22 108.028 -175.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -61.11 143.32 55.67 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 120.011 -0.675 . . . . 99.95 110.077 176.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 88.46 -9.07 77.05 Favored Glycine 0 N--CA 1.443 -0.841 0 CA-C-O 119.146 -0.808 . . . . 65.71 114.199 -177.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -123.15 90.33 3.27 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 105.631 -1.988 . . . . 62.78 105.631 176.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 54.6 m -59.41 -31.04 68.9 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 113.61 -1.632 . . . . 72.01 111.708 -177.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 76.7 p -78.36 -13.69 59.74 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 113.447 0.906 . . . . 54.51 113.447 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 51.9 p -72.89 -11.86 60.75 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 119.1 -1.04 . . . . 53.08 113.051 -163.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.3 tt -55.7 -25.83 19.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-N 119.036 0.834 . . . . 55.88 111.245 173.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.8 tp -61.94 -28.19 43.83 Favored 'Isoleucine or valine' 0 C--O 1.244 0.803 0 C-N-CA 119.528 -0.869 . . . . 56.12 110.716 -177.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -67.6 -35.48 79.05 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 118.694 -1.202 . . . . 56.18 111.262 177.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -65.34 -43.52 90.63 Favored 'General case' 0 C--O 1.243 0.713 0 O-C-N 122.193 -0.317 . . . . 55.46 110.703 171.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 93.0 t -59.3 -49.8 82.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 N-CA-C 109.594 -0.521 . . . . 52.42 109.594 178.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.429 HG22 HG21 ' A' ' 64' ' ' VAL . 55.6 mt -62.3 -44.16 98.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 C-N-CA 119.956 -0.697 . . . . 58.18 111.219 -176.831 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.841 ' NH2' ' O ' ' A' ' 0' ' ' MET . 52.8 ttp180 -57.85 -50.64 72.61 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 119.857 -0.737 . . . . 53.87 110.87 179.953 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -60.44 -46.16 91.04 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.991 -0.284 . . . . 61.26 111.656 179.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.71 -36.42 87.47 Favored Glycine 0 C--N 1.335 0.472 0 C-N-CA 119.282 -1.437 . . . . 54.57 111.532 -177.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.6 tp -71.28 -40.86 70.65 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 122.255 -0.556 . . . . 67.95 111.737 177.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -86.75 -5.49 59.1 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 113.335 0.865 . . . . 58.55 113.335 -173.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.62 ' HB3' ' HG3' ' A' ' 25' ' ' GLN . 39.4 t0 -56.34 117.8 18.42 Favored Pre-proline 0 C--O 1.245 0.825 0 CA-C-N 118.203 0.456 . . . . 63.02 110.009 -179.217 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -58.28 -30.38 90.76 Favored 'Trans proline' 0 CA--C 1.513 -0.562 0 C-N-CA 120.503 0.802 . . . . 60.73 113.534 -178.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.0 m -74.98 0.48 15.72 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 119.087 -1.045 . . . . 68.96 112.72 176.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.62 ' HG3' ' HB3' ' A' ' 22' ' ' ASP . 2.9 mt-30 -116.92 31.66 6.62 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 118.882 0.764 . . . . 73.41 112.279 176.268 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.08 -30.13 34.4 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 112.054 0.39 . . . . 70.45 112.054 -177.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.5 mtmt -86.57 -37.11 18.46 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 118.712 -1.195 . . . . 86.52 112.438 -177.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -55.11 -48.9 72.98 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 121.227 -0.92 . . . . 82.68 110.692 169.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.405 ' O ' HG13 ' A' ' 33' ' ' ILE . 21.1 tttt -53.33 -49.44 67.05 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.152 0.501 . . . . 88.73 111.401 175.005 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.87 -30.03 71.01 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 112.217 0.451 . . . . 89.12 112.217 -171.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -82.08 -35.04 29.08 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 119.806 -0.758 . . . . 102.1 112.225 179.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.6 m -69.37 -27.17 65.08 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 118.122 -1.431 . . . . 93.45 110.822 178.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 29' ' ' LYS . 33.8 mt -74.16 -32.79 33.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 120.015 -0.674 . . . . 93.92 110.512 172.22 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -79.3 -38.41 35.38 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.175 -0.61 . . . . 107.11 112.044 -172.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.62 -48.79 7.61 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 112.918 0.71 . . . . 104.95 112.918 178.575 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.1 -47.35 85.03 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 120.073 -0.651 . . . . 100.08 110.434 -174.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 47.7 t30 50.66 50.86 18.09 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.529 0.68 . . . . 90.93 112.715 167.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.635 ' N ' ' HB3' ' A' ' 59' ' ' LYS . . . -162.11 152.28 16.82 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.026 -0.534 . . . . 91.38 110.107 178.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.529 HD12 ' HG2' ' A' ' 59' ' ' LYS . 3.6 mp -90.73 126.91 43.47 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 108.078 -1.082 . . . . 85.55 108.078 161.534 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 25.0 mt -115.6 129.51 71.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 N-CA-C 109.034 -0.728 . . . . 76.39 109.034 179.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -105.27 137.0 36.82 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 C-N-CA 123.233 0.613 . . . . 71.81 109.468 173.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.434 ' O ' ' HA ' ' A' ' 53' ' ' SER . 93.9 m-85 -108.77 119.54 39.85 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.699 -0.852 . . . . 68.85 108.699 174.21 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -101.85 103.7 14.41 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 106.964 -1.495 . . . . 82.58 106.964 172.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 25.4 mt -95.47 143.18 27.02 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.063 -0.347 . . . . 58.68 110.063 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.8 mmtt -126.94 131.88 50.98 Favored 'General case' 0 CA--C 1.518 -0.261 0 C-N-CA 124.051 0.94 . . . . 67.83 108.612 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 47.9 p30 -108.39 172.51 6.79 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 119.302 -0.959 . . . . 66.4 110.028 -179.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.0 mtpt -76.23 0.15 20.19 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.856 -1.066 . . . . 93.36 112.675 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -91.93 1.93 56.86 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 118.854 0.752 . . . . 76.52 112.286 169.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 88.84 1.95 79.22 Favored Glycine 0 N--CA 1.441 -1.0 0 CA-C-O 118.73 -1.039 . . . . 75.66 115.654 177.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.0 mmmt -94.04 158.34 15.67 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 119.366 1.583 . . . . 85.53 112.028 -176.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 93.6 m -118.8 129.8 55.43 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.734 1.614 . . . . 69.86 108.783 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -130.0 144.91 51.59 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.24 -1.022 . . . . 73.84 108.24 168.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' SER . . . . . 0.434 ' HA ' ' O ' ' A' ' 42' ' ' PHE . 6.0 m -126.2 152.75 45.61 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 121.532 0.682 . . . . 72.02 111.594 -178.336 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 20.9 m-90 -138.92 154.63 48.37 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 106.6 -1.629 . . . . 64.21 106.6 176.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 48.1 p90 -119.56 146.92 45.06 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.518 0.675 . . . . 80.52 109.505 176.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.5 tp -127.75 94.12 3.87 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 105.16 -2.163 . . . . 72.08 105.16 178.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.501 ' O ' ' HA2' ' A' ' 62' ' ' GLY . 59.1 t0 -78.01 102.96 7.66 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.028 -1.101 . . . . 83.2 108.028 179.873 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 52.4 mt -120.92 38.91 3.93 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 113.932 1.086 . . . . 83.58 113.932 177.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LYS . . . . . 1.206 ' NZ ' ' HZ1' ' A' ' 113' ' ' LYS . 15.3 pttt -134.79 -20.2 1.77 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.771 0.286 . . . . 99.2 111.771 177.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.411 ' ND2' ' HB2' ' A' ' 72' ' ' LYS . 64.4 m-20 -96.42 -105.36 0.16 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.508 0.723 . . . . 95.83 109.079 171.794 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.536 ' H ' ' HZ3' ' A' ' 72' ' ' LYS . 12.0 m-20 -109.63 -5.88 15.53 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 114.17 1.174 . . . . 107.25 114.17 -177.767 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.501 ' HA2' ' O ' ' A' ' 57' ' ' ASP . . . 100.74 55.18 0.95 Allowed Glycine 0 CA--C 1.518 0.226 0 N-CA-C 118.439 2.136 . . . . 85.14 118.439 165.078 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -109.61 150.75 27.76 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 121.247 -1.149 . . . . 86.16 109.545 -173.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.429 HG21 HG22 ' A' ' 16' ' ' ILE . 59.4 t -117.59 134.91 59.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 107.954 -1.128 . . . . 63.75 107.954 176.646 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -160.89 -179.71 35.81 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 118.272 -1.918 . . . . 68.39 113.52 177.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 23.7 tptp -84.9 143.04 29.27 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.588 -1.306 . . . . 73.56 110.767 -176.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 108.92 168.31 20.73 Favored Glycine 0 N--CA 1.435 -1.387 0 CA-C-O 121.487 0.493 . . . . 72.7 111.889 176.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -97.66 13.56 29.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.949 -0.626 . . . . 83.15 112.513 -177.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.9 124.81 21.26 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 109.667 -0.494 . . . . 95.95 109.667 177.328 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.7 t -69.15 136.1 89.24 Favored Pre-proline 0 C--N 1.343 0.307 0 C-N-CA 127.614 2.366 . . . . 98.38 110.832 167.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -71.28 -27.8 19.21 Favored 'Trans proline' 0 CA--C 1.533 0.464 0 N-CA-C 116.203 1.578 . . . . 105.26 116.203 176.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.536 ' HZ3' ' H ' ' A' ' 61' ' ' ASP . 4.5 mttt -104.48 104.92 14.86 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 121.441 1.928 . . . . 106.82 108.102 178.277 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 66.36 170.94 3.93 Favored Glycine 0 CA--C 1.519 0.301 0 N-CA-C 106.431 -2.667 . . . . 110.01 106.431 -169.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -129.24 -178.56 4.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 119.623 1.711 . . . . 110.87 111.028 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -54.86 139.48 39.94 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 114.401 -1.272 . . . . 91.5 112.401 -158.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.715 ' HB3' ' HD2' ' A' ' 113' ' ' LYS . 1.6 m-20 -99.27 -41.27 7.54 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.991 -1.004 . . . . 91.18 113.457 175.617 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 7.7 pt -139.57 144.24 29.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 108.303 -0.999 . . . . 85.65 108.303 179.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -125.22 129.74 50.68 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 123.098 0.559 . . . . 87.31 110.859 -178.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.2 mt -114.74 126.15 54.53 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 123.67 0.788 . . . . 66.7 109.602 179.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 32.0 m -118.47 125.04 49.05 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.548 -0.908 . . . . 59.4 108.548 179.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -160.12 169.53 23.14 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.847 -1.168 . . . . 53.55 107.847 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.9 p -77.38 161.64 27.86 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 122.243 1.02 . . . . 53.9 110.733 -179.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -64.24 -39.22 93.51 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 114.758 -1.11 . . . . 58.16 111.411 177.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.733 ' OD1' ' O ' ' A' ' 201' ' ' HOH . 3.8 m-20 -68.22 -40.67 82.03 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.268 -0.573 . . . . 79.05 111.5 -179.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.509 ' HD2' ' O ' ' A' ' 203' ' ' HOH . 8.1 m-70 -73.54 -35.68 65.55 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 119.609 -0.836 . . . . 62.75 111.212 -177.92 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -64.52 -41.94 96.08 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 119.716 -0.793 . . . . 55.23 110.199 175.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -63.41 -39.06 93.49 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 118.873 -1.131 . . . . 78.57 110.908 176.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -61.56 -43.83 98.14 Favored 'General case' 0 CA--C 1.511 -0.552 0 C-N-CA 118.559 -1.256 . . . . 73.21 110.71 174.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 50.1 tp -61.35 -44.08 97.78 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-O 120.952 0.406 . . . . 66.75 111.283 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.7 t -68.34 -41.48 83.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 O-C-N 121.744 -0.597 . . . . 64.94 111.052 -176.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -74.95 -4.49 38.46 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 114.088 1.144 . . . . 82.29 114.088 -179.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.3 12.01 68.32 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-O 118.941 -0.921 . . . . 75.76 115.384 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 55.2 mttt -103.43 15.24 29.56 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 118.596 1.198 . . . . 83.32 113.14 -178.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -156.48 150.45 25.06 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.084 -0.709 . . . . 69.43 109.084 176.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -105.15 134.34 48.42 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.044 0.538 . . . . 79.57 109.943 -176.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.51 -45.73 86.0 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 112.769 0.655 . . . . 67.1 112.769 -172.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -73.63 -28.07 61.6 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 117.057 -1.857 . . . . 83.05 110.596 -176.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.704 ' HG3' ' O ' ' A' ' 98' ' ' ARG 0.325 5.1 tpt180 -73.99 -34.7 64.31 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 114.796 -2.761 . . . . 92.16 114.589 169.32 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 14.4 mt -54.53 -36.46 64.3 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 117.767 -1.573 . . . . 64.09 110.398 167.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -67.51 -51.47 50.59 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 112.392 0.516 . . . . 63.12 112.392 179.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 73.9 mtm -70.16 -15.08 62.9 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.336 -0.853 . . . . 72.88 112.228 -173.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 71.7 p -97.23 8.92 43.57 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 112.921 0.711 . . . . 64.35 112.921 -179.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 76.38 6.19 83.37 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 119.668 -1.254 . . . . 51.36 114.818 177.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -81.48 -25.48 36.0 Favored 'General case' 0 C--O 1.239 0.553 0 CA-C-N 118.682 1.241 . . . . 63.95 111.452 -179.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.4 tp -123.49 125.92 45.78 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 107.854 -1.165 . . . . 56.14 107.854 179.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -108.5 145.08 35.26 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.221 0.534 . . . . 74.79 111.176 177.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 97.6 t -125.06 115.26 43.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 N-CA-C 107.377 -1.342 . . . . 74.73 107.377 -173.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 17.1 ttmt -116.0 150.2 37.59 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.999 0.919 . . . . 86.22 109.664 173.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 104.56 -145.75 16.05 Favored Glycine 0 CA--C 1.519 0.325 0 N-CA-C 115.993 1.157 . . . . 91.22 115.993 -179.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.448 ' CG ' ' HB2' ' A' ' 112' ' ' MET . 24.5 t-20 -94.8 119.73 33.87 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.047 0.939 . . . . 95.84 110.346 -164.649 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 2.4 m -67.59 -18.39 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 CA-C-O 122.412 1.101 . . . . 91.36 108.984 178.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' MET . . . . . 0.448 ' HB2' ' CG ' ' A' ' 110' ' ' ASN 0.262 11.8 mmm -74.86 -36.46 62.31 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 126.466 1.907 . . . . 118.68 110.484 -167.163 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LYS . . . . . 1.206 ' HZ1' ' NZ ' ' A' ' 59' ' ' LYS . 15.0 mttt -92.03 -31.83 15.43 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 127.049 2.14 . . . . 100.46 112.046 169.948 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.471 ' O ' HG23 ' A' ' 117' ' ' ILE . . . -62.64 -40.63 97.61 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 115.738 -0.665 . . . . 106.89 111.952 -175.373 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -53.32 -44.33 68.31 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.926 -0.31 . . . . 106.03 111.83 -176.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -95.01 130.22 41.76 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.647 -0.658 . . . . 103.71 109.871 172.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.618 HD12 ' O ' ' A' ' 117' ' ' ILE . 1.6 pp . . . . . 0 C--N 1.329 -0.318 0 C-N-CA 118.276 -1.37 . . . . 106.11 113.662 -175.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 0' ' ' MET . . . . . 0.794 ' O ' ' NH2' ' B' ' 17' ' ' ARG . 34.9 mmm . . . . . 0 CA--C 1.502 -0.903 0 N-CA-C 108.177 -1.046 . . . . 95.1 108.177 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 34.5 t -78.36 119.24 21.41 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 103.028 -2.953 . . . . 69.14 103.028 151.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 70.3 mt -83.09 -16.19 47.87 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 113.883 1.068 . . . . 62.35 113.883 -162.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 17.7 tttm -61.52 141.78 57.5 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.332 0.587 . . . . 76.64 111.048 177.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 74.3 t -133.7 139.91 47.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 108.126 -1.064 . . . . 66.05 108.126 -177.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -62.85 141.56 58.6 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.575 0.547 . . . . 87.23 110.523 176.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 87.57 -8.96 75.5 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 115.08 0.792 . . . . 67.15 115.08 -179.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -124.16 92.99 3.79 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 107.325 -1.361 . . . . 68.05 107.325 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 30.7 m -57.58 -34.78 69.58 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.107 -0.951 . . . . 71.68 111.901 -175.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' SER . . . . . 0.449 ' O ' HD12 ' B' ' 12' ' ' ILE . 31.6 p -77.54 -8.82 58.4 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 119.031 -1.068 . . . . 62.56 112.816 -175.668 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 84.3 p -73.19 -17.17 61.39 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 119.229 -0.989 . . . . 61.45 113.46 -164.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 13.3 tt -58.69 -24.21 25.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 CA-C-N 118.805 0.73 . . . . 69.13 111.357 172.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ILE . . . . . 0.537 HD13 HG21 ' B' ' 90' ' ' VAL . 19.7 mt -60.47 -32.53 51.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 C-N-CA 123.145 0.578 . . . . 70.2 111.604 179.026 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -68.34 -34.94 77.0 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 118.775 -1.17 . . . . 56.76 111.701 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -60.85 -44.07 97.5 Favored 'General case' 0 C--O 1.238 0.448 0 O-C-N 121.844 -0.535 . . . . 68.04 110.876 175.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 58.0 t -64.49 -44.99 96.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 CA-C-O 120.837 0.351 . . . . 51.98 110.703 178.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ILE . . . . . . . . . . . . . 73.3 mt -62.98 -43.83 99.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 O-C-N 121.754 -0.591 . . . . 58.17 110.895 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ARG . . . . . 0.794 ' NH2' ' O ' ' B' ' 0' ' ' MET . 50.1 ttp180 -57.67 -49.0 77.94 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 119.207 -0.997 . . . . 52.37 111.119 178.143 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -57.9 -46.02 85.56 Favored 'General case' 0 C--O 1.24 0.566 0 C-N-CA 120.816 -0.354 . . . . 70.78 111.308 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' GLY . . . . . 0.408 ' HA2' HD21 ' B' ' 127' ' ' ASN . . . -69.05 -36.53 81.07 Favored Glycine 0 C--N 1.333 0.366 0 C-N-CA 119.465 -1.35 . . . . 55.01 113.064 -178.459 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 15.8 tp -68.43 -40.66 81.1 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 121.915 -0.756 . . . . 68.33 111.796 177.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -86.22 -8.84 57.49 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 124.107 0.963 . . . . 55.82 113.35 -172.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -51.1 118.68 10.87 Favored Pre-proline 0 N--CA 1.443 -0.798 0 N-CA-C 108.492 -0.929 . . . . 70.46 108.492 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -56.86 -30.58 85.97 Favored 'Trans proline' 0 C--O 1.238 0.504 0 CA-C-N 118.753 0.59 . . . . 57.24 113.18 -177.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' SER . . . . . . . . . . . . . 3.0 m -75.69 1.58 14.25 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.053 1.131 . . . . 67.0 114.053 177.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.534 ' HG3' ' OD1' ' B' ' 127' ' ' ASN . 90.3 mm-40 -115.59 27.63 9.2 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 119.726 1.148 . . . . 86.03 111.568 176.93 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.77 -30.12 31.11 Favored 'General case' 0 C--O 1.246 0.876 0 O-C-N 123.461 0.476 . . . . 68.24 111.391 -178.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -75.61 -45.16 39.04 Favored 'General case' 0 CA--C 1.508 -0.648 0 C-N-CA 119.561 -0.856 . . . . 88.94 111.678 -175.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' GLN . . . . . 0.72 ' NE2' ' HB3' ' B' ' 123' ' ' ASN . 1.9 tp60 -75.31 -35.57 61.23 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 116.191 -2.204 . . . . 100.23 109.159 -175.004 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.472 ' O ' HG13 ' B' ' 33' ' ' ILE . 35.5 ttpt -50.23 -50.82 48.56 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 119.564 -0.854 . . . . 67.08 109.456 172.25 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -66.11 -29.67 70.03 Favored 'General case' 0 C--O 1.239 0.517 0 C-N-CA 120.14 -0.624 . . . . 71.63 110.698 -178.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -75.54 -38.33 59.4 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.258 -0.577 . . . . 92.29 111.052 177.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 5.2 m -71.03 -28.68 64.56 Favored 'General case' 0 CA--C 1.516 -0.346 0 C-N-CA 118.05 -1.46 . . . . 74.38 111.338 177.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ILE . . . . . 0.472 HG13 ' O ' ' B' ' 29' ' ' LYS . 5.2 mt -71.3 -35.09 56.33 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 C-N-CA 119.052 -1.059 . . . . 77.41 111.008 177.823 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -78.4 -30.35 47.7 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.043 -0.663 . . . . 96.62 110.863 -177.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -78.04 -54.48 6.23 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 118.116 0.417 . . . . 86.96 111.359 176.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.26 -48.49 67.59 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 121.779 -0.576 . . . . 78.66 112.21 -176.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 52.2 t-20 48.87 49.7 18.75 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.976 0.893 . . . . 82.22 110.368 175.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -161.32 148.97 15.14 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.749 -0.66 . . . . 74.77 110.206 -177.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ILE . . . . . 0.479 HD13 ' HB3' ' B' ' 70' ' ' SER . 29.3 mt -89.87 124.65 42.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 106.155 -1.794 . . . . 69.26 106.155 162.183 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 20.7 mt -114.31 125.3 71.58 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 N-CA-C 106.713 -1.588 . . . . 62.31 106.713 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 53.3 t -105.98 135.82 42.73 Favored 'Isoleucine or valine' 0 C--O 1.244 0.798 0 CA-C-O 121.892 0.853 . . . . 57.13 109.936 173.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -107.35 118.64 37.26 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 107.139 -1.43 . . . . 56.17 107.139 173.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -104.19 103.39 13.16 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 106.979 -1.489 . . . . 53.52 106.979 171.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 14.1 mt -93.84 144.51 25.37 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.248 0.547 . . . . 55.18 109.914 -179.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 47.0 mmtt -123.64 131.14 53.54 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 108.136 -1.061 . . . . 56.83 108.136 -178.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 52.6 p30 -107.84 170.69 7.83 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 117.127 -1.829 . . . . 62.81 110.761 -176.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 20.4 mtmt -75.88 11.56 1.37 Allowed 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 113.994 -1.457 . . . . 90.09 111.133 176.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -99.16 0.21 42.93 Favored 'General case' 0 C--N 1.348 0.532 0 CA-C-N 120.54 1.518 . . . . 81.27 112.105 162.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 89.5 5.11 72.53 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 119.795 -1.193 . . . . 68.91 115.743 -177.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 10.2 mttt -95.33 160.88 14.32 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 119.206 1.503 . . . . 88.57 112.3 -175.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' THR . . . . . . . . . . . . . 35.7 m -120.88 126.82 51.02 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 114.621 -1.172 . . . . 60.11 109.251 174.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -127.8 144.14 51.1 Favored 'General case' 0 C--O 1.247 0.972 0 N-CA-C 108.127 -1.064 . . . . 65.98 108.127 169.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' SER . . . . . . . . . . . . . 4.6 m -125.72 153.72 43.51 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.389 0.614 . . . . 60.77 111.524 -178.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' TRP . . . . . . . . . . . . . 27.9 m-90 -139.44 152.68 47.24 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 113.584 -1.644 . . . . 56.0 107.13 177.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -123.67 147.79 47.09 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.936 0.874 . . . . 68.59 111.254 177.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 21.3 tp -128.8 95.95 4.24 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 103.994 -2.595 . . . . 60.19 103.994 -179.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -80.44 102.12 9.46 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 107.697 -1.223 . . . . 71.31 107.697 -179.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 54.2 mt -117.2 35.32 4.7 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 122.549 0.34 . . . . 64.08 111.02 174.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -124.6 -31.29 3.24 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 113.537 0.94 . . . . 81.52 113.537 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -99.94 -102.28 0.23 Allowed 'General case' 0 C--O 1.237 0.41 0 CA-C-N 118.38 0.536 . . . . 78.73 111.418 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -109.02 -6.45 15.65 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 114.599 1.333 . . . . 85.87 114.599 -174.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.85 81.74 1.61 Allowed Glycine 0 C--O 1.244 0.768 0 C-N-CA 118.232 -1.937 . . . . 74.86 110.512 170.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -135.57 147.12 48.62 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.694 -0.854 . . . . 68.51 108.694 -175.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 45.5 t -122.52 135.46 62.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 105.931 -1.877 . . . . 57.48 105.931 168.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . -161.27 -177.54 34.45 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 117.873 -2.108 . . . . 56.46 112.678 178.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 25.0 tptp -84.77 143.96 28.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.101 -1.05 . . . . 65.14 110.222 -177.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 112.29 169.17 17.97 Favored Glycine 0 CA--C 1.518 0.281 0 CA-C-O 122.941 1.301 . . . . 61.92 112.868 173.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -97.61 9.35 42.73 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 114.042 -1.079 . . . . 79.08 112.664 -177.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . . 2.2 pttp -141.55 130.46 23.09 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.402 -0.962 . . . . 88.43 108.402 174.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' SER . . . . . 0.479 ' HB3' HD13 ' B' ' 39' ' ' ILE . 1.6 t -66.71 142.91 97.82 Favored Pre-proline 0 C--N 1.322 -0.618 0 C-N-CA 119.928 -0.709 . . . . 79.61 109.089 166.039 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -66.81 -18.0 52.49 Favored 'Trans proline' 0 CA--C 1.517 -0.34 0 C-N-CA 118.453 -0.565 . . . . 83.4 112.726 174.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -100.88 27.08 6.25 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 113.464 0.912 . . . . 81.96 113.464 -177.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' GLY . . . . . . . . . . . . . . . 148.96 178.3 23.88 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 119.608 -1.282 . . . . 85.62 111.846 -174.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -110.64 163.24 13.94 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 114.535 -0.833 . . . . 93.62 108.9 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.17 139.2 57.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.439 -1.255 . . . . 77.17 110.103 -168.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -91.02 -30.61 16.7 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.875 -0.602 . . . . 82.38 110.325 170.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' ILE . . . . . 0.487 HD11 ' HB2' ' B' ' 113' ' ' LYS . 7.3 mt -138.85 143.01 32.91 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 108.827 -0.805 . . . . 69.59 108.827 178.704 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -124.84 128.55 48.87 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 106.643 -1.614 . . . . 81.83 106.643 173.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 36.0 mt -117.16 123.3 46.36 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 106.47 -1.678 . . . . 59.44 106.47 177.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' THR . . . . . . . . . . . . . 29.9 m -117.43 122.84 44.87 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.669 -0.863 . . . . 47.18 108.669 -179.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -162.6 168.88 21.09 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 107.742 -1.207 . . . . 50.29 107.742 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 29.2 p -73.7 160.21 31.88 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 122.303 1.049 . . . . 55.49 110.466 -179.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -61.87 -38.1 87.02 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 114.558 -1.201 . . . . 71.32 110.633 177.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -68.29 -40.02 81.9 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.043 -0.663 . . . . 77.91 111.288 178.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -72.38 -34.89 68.27 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 118.447 -1.301 . . . . 58.85 111.455 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -62.18 -42.78 99.6 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.401 -0.919 . . . . 59.46 110.687 176.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -65.5 -37.48 86.93 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.034 -0.666 . . . . 91.8 111.592 178.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -61.16 -43.43 98.9 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.557 -0.857 . . . . 75.17 110.899 173.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.2 tp -61.93 -41.91 98.49 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 121.021 -0.272 . . . . 58.97 111.609 -179.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' VAL . . . . . 0.537 HG21 HD13 ' B' ' 12' ' ' ILE . 15.6 m -70.41 -37.67 71.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 C-N-CA 119.45 -0.9 . . . . 72.79 110.445 179.437 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 73.4 mt-10 -70.99 -11.93 61.25 Favored 'General case' 0 C--N 1.345 0.374 0 C-N-CA 118.904 -1.119 . . . . 94.06 112.386 177.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.4 9.67 75.44 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-O 119.117 -0.824 . . . . 78.41 114.74 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -97.54 13.13 31.07 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 118.348 1.074 . . . . 87.95 111.436 -179.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -150.39 145.67 26.22 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 106.688 -1.597 . . . . 69.15 106.688 172.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -108.28 132.39 53.74 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.553 -1.277 . . . . 61.1 107.553 -175.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.43 -37.45 83.56 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 119.806 -0.758 . . . . 56.61 110.735 -174.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -71.97 -34.09 68.68 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 118.989 -1.085 . . . . 64.95 111.079 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ARG . . . . . . . . . . . . . 31.8 tpt180 -72.13 -39.46 68.79 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.436 -0.506 . . . . 69.67 111.24 174.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 30.7 mt -58.22 -39.2 78.43 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.189 -0.604 . . . . 53.06 111.391 174.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -66.43 -45.8 78.63 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.817 0.341 . . . . 51.0 110.966 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 39.3 mmm -68.44 -29.65 68.35 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.12 -0.632 . . . . 54.77 112.203 -174.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' THR . . . . . . . . . . . . . 82.7 p -91.05 10.13 28.0 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.619 0.97 . . . . 52.58 113.619 177.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' GLY . . . . . . . . . . . . . . . 78.95 6.98 88.66 Favored Glycine 0 C--N 1.333 0.361 0 N-CA-C 116.065 1.186 . . . . 48.42 116.065 178.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -82.85 -24.15 33.4 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 118.826 1.313 . . . . 51.31 113.18 -178.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 10.0 tp -123.16 125.22 44.72 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.014 -0.735 . . . . 51.1 109.014 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -103.61 142.95 33.42 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.331 -0.618 . . . . 80.08 109.331 173.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' VAL . . . . . . . . . . . . . 73.0 t -125.76 125.95 69.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 C-N-CA 123.905 0.882 . . . . 59.36 109.471 -172.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 3.1 mtpp -111.55 139.54 46.9 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 109.137 -0.69 . . . . 83.31 109.137 164.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . 101.56 -147.59 17.62 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 110.194 -1.162 . . . . 67.97 110.194 -176.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' ASN . . . . . . . . . . . . . 24.5 t30 -88.14 115.51 25.67 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 106.663 -1.606 . . . . 77.51 106.663 -167.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 2.0 p -69.25 -21.19 24.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 C-N-CA 119.216 -0.994 . . . . 61.08 111.276 -172.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 43.8 mtm -75.71 -22.47 56.57 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 118.409 -1.316 . . . . 122.56 111.64 -177.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' LYS . . . . . 0.487 ' HB2' HD11 ' B' ' 77' ' ' ILE . 56.2 mttm -83.11 -29.94 28.32 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 118.331 -1.348 . . . . 76.04 111.653 170.975 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.36 -42.93 99.79 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 119.434 -0.906 . . . . 66.8 110.831 170.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' ALA . . . . . . . . . . . . . . . -54.82 -34.23 62.55 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-O 121.208 0.528 . . . . 66.34 111.607 177.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -87.53 15.02 7.15 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 113.585 0.957 . . . . 66.05 113.585 179.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' ILE . . . . . . . . . . . . . 4.2 tp -64.89 -42.59 95.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 C-N-CA 119.914 -0.714 . . . . 66.61 111.465 -170.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -74.95 -21.81 58.95 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 114.359 -2.937 . . . . 86.83 112.102 -176.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' GLY . . . . . . . . . . . . . . . -68.4 -45.66 67.66 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 119.541 -1.314 . . . . 72.79 111.687 166.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' ILE . . . . . . . . . . . . . 92.3 mt -55.64 -38.35 49.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 CA-C-O 121.098 0.475 . . . . 70.64 110.716 174.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 78.6 mt -74.56 -28.64 61.03 Favored 'General case' 0 C--O 1.232 0.149 0 O-C-N 121.894 -0.504 . . . . 82.75 112.061 -173.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -70.31 -64.95 0.79 Allowed 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.244 0.545 . . . . 92.12 110.778 176.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.72 ' HB3' ' NE2' ' B' ' 28' ' ' GLN . 62.9 m-20 -60.79 -17.43 49.28 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 113.755 1.021 . . . . 102.51 113.755 -177.158 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' ALA . . . . . . . . . . . . . . . -55.3 -70.1 0.12 Allowed 'General case' 0 C--O 1.242 0.667 0 CA-C-N 118.228 0.467 . . . . 89.09 111.129 175.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 1.8 pp0? -104.02 10.09 36.24 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.487 0.921 . . . . 90.72 113.487 -170.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -66.22 97.5 0.4 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 118.692 0.678 . . . . 94.27 109.924 -173.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' ASN . . . . . 0.534 ' OD1' ' HG3' ' B' ' 25' ' ' GLN . 87.3 m-20 . . . . . 0 C--O 1.235 0.33 0 CA-C-O 121.024 0.44 . . . . 93.09 110.716 174.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . 0.733 ' O ' ' OD1' ' A' ' 84' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . 0.509 ' O ' ' HD2' ' A' ' 85' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_