data_5kgw_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 5kgw _Structure_validation_residue.Date_analyzed 2016-10-20 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 ' 56' ' ' CYS . . . . . . . . . . . . . 27.2 p . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.649 0.261 . . . . 92.060000000000002 111.049 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 43.5 t -56.07 135.72 74.16 Favored Pre-proline 0 C--O 1.238 0.452 0 C-N-CA 120.546 -0.462 . . . . 74.700000000000003 109.98 179.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -73.51 -11.19 24.33 Favored 'Trans proline' 0 C--O 1.238 0.495 0 N-CA-C 114.213 0.813 . . . . 74.230000000000004 114.213 -177.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -103.08 19.95 44.7 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 119.04 0.836 . . . . 52.579999999999998 114.681 -178.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 79.3 mt -98.3 126.77 51.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 109.095 -0.706 . . . . 66.260000000000005 109.095 -179.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 64.6 m95 -123.03 160.63 25.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.278 0.561 . . . . 44.240000000000002 110.083 176.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -124.65 134.38 52.91 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.325 -0.991 . . . . 55.090000000000003 108.325 177.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.2 tp -131.47 125.13 31.71 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.48 -0.563 . . . . 54.719999999999999 109.48 -172.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -148.67 165.66 30.69 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 120.998 -0.281 . . . . 48.509999999999998 111.581 176.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' CAF . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 29.6 p -118.2 172.08 7.68 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.753 -0.832 . . . . 75.620000000000005 108.753 170.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 69.6 m80 -127.64 142.3 51.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.052 0.453 . . . . 75.950000000000003 110.724 -174.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 40.6 mt -156.87 138.29 13.9 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 107.625 -1.25 . . . . 64.840000000000003 107.625 173.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 53.81 35.35 21.3 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.589 0.709 . . . . 60.469999999999999 111.228 176.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 63.19 25.03 67.83 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.32 -0.943 . . . . 60.759999999999998 114.312 -177.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -123.36 161.58 24.43 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 117.908 0.854 . . . . 69.299999999999997 109.902 177.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 73.6 t -106.22 129.87 58.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 CA-C-N 115.271 -0.877 . . . . 56.0 108.716 -174.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 64.8 mt -116.95 117.18 54.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 107.742 -1.207 . . . . 53.409999999999997 107.742 176.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.1 tt -89.42 126.39 35.54 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 108.337 -0.986 . . . . 54.439999999999998 108.337 174.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 57.3 t -125.49 127.13 71.51 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 N-CA-C 108.947 -0.76 . . . . 47.539999999999999 108.947 -174.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -116.11 135.93 53.48 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 124.315 1.046 . . . . 43.32 109.076 173.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 42.0 t -125.01 125.23 69.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 108.09 -1.078 . . . . 44.119999999999997 108.09 -177.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' HIS . . . . . 0.591 ' ND1' ' OG ' ' A' ' 81' ' ' SER . 33.0 t-80 -76.62 99.75 5.12 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 106.7 -1.592 . . . . 50.609999999999999 106.7 168.972 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 99.3 t -54.12 -44.11 62.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-N 116.234 -0.439 . . . . 58.729999999999997 111.18 -167.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.64 -25.91 66.66 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.126 -0.629 . . . . 61.439999999999998 112.222 -175.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . 0.591 ' OG ' ' ND1' ' A' ' 78' ' ' HIS . 78.7 p -119.51 -23.27 6.67 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 114.803 1.408 . . . . 52.259999999999998 114.803 -171.012 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.96 -3.71 84.91 Favored Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 119.128 0.877 . . . . 47.770000000000003 114.832 -171.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -60.3 140.86 56.86 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.368 1.084 . . . . 48.009999999999998 110.205 175.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.2 mt -123.78 139.54 49.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 N-CA-C 109.715 -0.476 . . . . 51.119999999999997 109.715 -174.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . 0.4 ' OE2' ' NE1' ' A' ' 108' ' ' TRP . 73.4 mt-10 -121.21 146.66 46.56 Favored 'General case' 0 CA--C 1.521 -0.14 0 N-CA-C 108.463 -0.94 . . . . 53.259999999999998 108.463 161.387 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -150.69 151.95 33.21 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 119.46 -0.896 . . . . 46.340000000000003 110.024 -176.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -145.51 147.89 32.64 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 107.7 -1.222 . . . . 57.399999999999999 107.7 178.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 40.6 t -96.99 120.09 45.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 107.587 -1.264 . . . . 51.109999999999999 107.587 175.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 38.8 pt -112.51 150.68 43.02 Favored Pre-proline 0 C--O 1.24 0.602 0 N-CA-C 109.555 -0.535 . . . . 57.590000000000003 109.555 -175.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -68.2 -49.94 0.86 Allowed 'Trans proline' 0 C--O 1.236 0.423 0 C-N-CA 120.091 0.528 . . . . 70.519999999999996 112.02 -179.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -123.1 143.5 49.94 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 122.553 0.341 . . . . 67.549999999999997 110.162 -177.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -81.24 62.81 5.32 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 122.454 1.121 . . . . 64.819999999999993 110.357 177.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 9.0 t -108.64 158.3 17.73 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.031 -0.986 . . . . 77.900000000000006 111.134 -173.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.66 -26.97 69.09 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 115.009 -0.996 . . . . 55.670000000000002 114.205 176.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -65.56 -46.04 81.0 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 117.915 0.858 . . . . 92.620000000000005 110.731 177.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -60.0 -46.72 88.56 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.702 -0.399 . . . . 61.600000000000001 111.047 174.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 41.8 m -58.95 -42.83 90.76 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.002 -0.679 . . . . 40.659999999999997 110.941 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.9 -47.15 81.72 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 120.96 0.409 . . . . 44.109999999999999 110.99 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -59.76 -45.11 93.25 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 120.212 -0.595 . . . . 39.740000000000002 110.952 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -57.76 -44.53 86.22 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.698 -0.401 . . . . 44.369999999999997 110.942 177.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 28.5 mt -60.59 -43.32 97.53 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.433 -0.507 . . . . 43.509999999999998 111.206 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 86.9 mt -58.13 -45.39 87.4 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 119.719 -0.793 . . . . 37.210000000000001 110.849 176.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -59.37 -43.39 92.88 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 119.238 -0.985 . . . . 49.890000000000001 111.169 177.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 12.8 tp -66.7 -45.05 80.0 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 122.278 -0.264 . . . . 41.93 111.504 -174.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.33 -33.01 74.76 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.057 0.391 . . . . 42.979999999999997 112.057 -176.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -69.31 -12.0 65.37 Favored Glycine 0 CA--C 1.508 -0.403 0 C-N-CA 119.884 -1.15 . . . . 42.090000000000003 113.993 177.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 15.2 ttp-105 -108.15 -34.87 6.73 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.234 0.827 . . . . 57.5 113.234 -176.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' TRP . . . . . 0.4 ' NE1' ' OE2' ' A' ' 85' ' ' GLU . 76.1 m95 -124.73 160.58 53.08 Favored Pre-proline 0 C--N 1.325 -0.483 0 C-N-CA 123.026 0.531 . . . . 49.950000000000003 110.059 -179.379 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' PRO . . . . . 0.681 ' O ' ' O ' ' A' ' 401' ' ' HOH . 76.7 Cg_endo -78.45 94.87 1.06 Allowed 'Trans proline' 0 C--O 1.234 0.323 0 N-CA-C 110.688 -0.543 . . . . 54.670000000000002 110.688 171.234 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.0 t -97.26 111.52 27.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 N-CA-C 108.036 -1.098 . . . . 51.670000000000002 108.036 -174.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -92.99 -57.07 2.76 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.491 -0.322 . . . . 97.480000000000004 111.213 177.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 69.2 p -133.57 146.99 51.5 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.489 0.661 . . . . 50.57 110.272 -176.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 75.0 t -123.37 131.66 72.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 108.43 -0.952 . . . . 51.850000000000001 108.43 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -111.93 160.09 17.76 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.508 1.123 . . . . 62.079999999999998 108.841 174.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.1 t -153.67 159.56 42.09 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.4 -0.963 . . . . 50.68 108.4 178.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -93.3 -1.8 55.64 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.592 -0.731 . . . . 57.240000000000002 112.701 174.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -130.96 86.81 2.41 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 106.933 -1.506 . . . . 47.850000000000001 106.933 175.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -50.74 -36.95 33.58 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 120.438 -0.887 . . . . 45.850000000000001 113.227 -175.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 54.6 p -61.44 -11.78 11.92 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 122.096 -0.649 . . . . 42.659999999999997 112.592 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -59.29 -27.57 65.98 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 118.459 0.572 . . . . 55.439999999999998 111.821 172.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 22.3 m-30 -109.62 20.43 18.14 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 113.019 0.748 . . . . 56.380000000000003 113.019 -167.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 81.7 p -94.94 -16.75 22.57 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 113.725 1.009 . . . . 64.439999999999998 113.725 -178.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 54.3 p -67.66 152.43 45.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.834 0.826 . . . . 62.259999999999998 110.635 -175.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.2 t -60.86 -40.0 91.27 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.202 -0.908 . . . . 55.659999999999997 111.022 177.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 39.2 p -60.55 -42.4 96.46 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.885 -0.726 . . . . 57.200000000000003 111.134 -179.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 70.8 t -63.49 -51.02 75.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 120.121 -0.632 . . . . 47.340000000000003 110.395 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -58.56 -36.44 73.92 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 119.9 -0.72 . . . . 75.150000000000006 111.139 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.85 -45.1 95.26 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.158 -0.617 . . . . 45.380000000000003 111.03 177.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -62.28 -41.54 98.57 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.012 0.375 . . . . 42.740000000000002 112.012 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' CAF . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 31.3 t90 -60.56 -53.0 62.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 49.159999999999997 110.736 176.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' TRP . . . . . . . . . . . . . 79.0 t90 -64.21 -39.92 94.99 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.22 -0.592 . . . . 45.619999999999997 111.521 -175.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -85.63 -2.11 57.84 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.998 0.74 . . . . 42.719999999999999 112.998 -178.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 69.01 45.92 61.03 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 118.294 0.497 . . . . 45.259999999999998 112.577 179.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 43.3 mt -107.75 136.02 44.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 108.944 -0.762 . . . . 52.549999999999997 108.944 -177.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -109.29 151.0 27.15 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.628 -0.508 . . . . 67.109999999999999 109.628 175.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -84.26 161.51 20.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.677 0.751 . . . . 70.530000000000001 110.087 175.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 115.565 -0.743 . . . . 86.439999999999998 111.273 -179.814 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 . . . . . 0 C--O 1.233 0.209 0 CA-C-O 120.839 0.352 . . . . 96.989999999999995 111.75 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 46.9 t 72.12 2.12 4.19 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.745 1.218 . . . . 111.55 111.85 -172.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' MET . . . . . . . . . . . . . 23.8 mmt -60.56 -39.62 88.63 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 118.597 0.635 . . . . 103.22 111.106 178.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 51.0 m-20 -60.39 -32.84 71.69 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 119.786 -0.766 . . . . 89.200000000000003 111.407 175.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -76.74 -43.41 37.37 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 120.829 -0.348 . . . . 113.83 111.601 -179.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -61.13 -50.55 72.74 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 120.324 -0.551 . . . . 97.739999999999995 110.87 174.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 39.9 tp -56.63 -43.91 80.72 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 122.209 -0.307 . . . . 72.200000000000003 111.092 178.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 39.6 mttp -61.14 -32.05 71.76 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 119.45 -0.9 . . . . 86.310000000000002 111.375 174.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -62.6 -57.66 10.31 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.054 0.454 . . . . 87.810000000000002 110.596 176.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 57.7 mt -58.83 -40.84 81.05 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 C-N-CA 120.438 -0.505 . . . . 62.0 110.643 -179.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 53.2 mt -56.29 -49.51 76.2 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 O-C-N 121.77 -0.581 . . . . 59.350000000000001 110.194 177.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -55.91 -39.71 79.17 Favored Glycine 0 C--N 1.336 0.566 0 C-N-CA 119.718 -1.229 . . . . 58.5 112.419 175.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -63.68 -39.46 94.37 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 122.23 -0.571 . . . . 72.620000000000005 112.033 -179.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 7.5 m -101.23 2.47 10.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 N-CA-C 113.076 0.769 . . . . 61.859999999999999 113.076 -171.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 43.3 tpt85 -61.83 -29.73 70.36 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 118.706 0.685 . . . . 61.899999999999999 112.637 -167.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -80.54 -17.38 51.69 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 113.082 0.771 . . . . 91.099999999999994 113.082 -173.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -74.09 -11.89 60.45 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 113.364 0.875 . . . . 77.950000000000003 113.364 178.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -133.71 141.57 47.6 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 118.73 0.695 . . . . 59.57 110.165 -172.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -66.57 -57.98 6.14 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.693 -0.685 . . . . 72.609999999999999 111.069 177.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -87.21 150.33 23.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.558 0.694 . . . . 62.359999999999999 111.269 -173.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 32.4 tp -63.91 -37.44 87.42 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.42 -0.809 . . . . 51.539999999999999 111.564 178.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' LYS . . . . . 0.592 ' NZ ' ' O ' ' A' ' 402' ' ' HOH . 59.9 pttt -63.49 -35.84 81.79 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 120.03 -0.668 . . . . 51.689999999999998 111.259 -174.915 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 26.5 m -61.77 -44.55 96.67 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 120.896 -0.321 . . . . 42.729999999999997 111.409 176.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.92 -36.72 84.15 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.912 -0.315 . . . . 43.780000000000001 111.338 177.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 55.7 t -59.25 -50.05 81.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-O 121.167 0.508 . . . . 45.270000000000003 110.209 175.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 58.5 mm-40 -65.69 -36.4 83.52 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 119.166 -1.014 . . . . 43.340000000000003 111.166 -179.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' MET . . . . . . . . . . . . . 90.1 mtp -57.49 -47.01 83.05 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.216 -0.594 . . . . 50.640000000000001 110.727 173.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' ALA . . . . . . . . . . . . . . . -63.07 -42.17 99.61 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.647 -0.251 . . . . 44.659999999999997 111.419 -179.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 71.7 t -57.39 -47.5 84.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-O 121.22 0.533 . . . . 41.539999999999999 110.089 175.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' PHE . . . . . . . . . . . . . 38.1 t80 -53.49 -54.58 35.02 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.041 0.448 . . . . 45.460000000000001 111.159 177.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 49.1 mt -57.57 -49.69 79.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 C-N-CA 120.574 -0.45 . . . . 49.43 110.556 -177.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 61.8 t60 -60.07 -45.16 93.79 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 121.791 -0.568 . . . . 52.450000000000003 111.567 -177.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -69.59 -29.86 67.49 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 119.837 -0.745 . . . . 49.460000000000001 111.765 -176.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -87.62 -22.8 24.53 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 113.103 0.779 . . . . 69.930000000000007 113.103 -178.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 4.8 tppp? -51.79 135.86 28.79 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.324 0.583 . . . . 93.819999999999993 111.148 -178.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 31.5 mmt180 -88.6 138.58 31.29 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.725 -0.671 . . . . 98.230000000000004 109.937 177.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 91.8 mttt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 115.975 -0.557 . . . . 100.76000000000001 111.265 -178.557 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.312 0 N-CA-C 113.623 0.209 . . . . 98.719999999999999 113.623 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -62.67 166.09 5.77 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 122.066 0.936 . . . . 114.09 110.631 179.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 83.5 p -94.98 173.37 7.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.335 -0.848 . . . . 77.430000000000007 110.311 177.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' ALA . . . . . 0.539 ' N ' ' O ' ' A' ' 403' ' ' HOH . . . -60.34 -46.31 90.36 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.261 -0.881 . . . . 56.219999999999999 111.391 179.078 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -62.73 -46.83 92.85 Favored Glycine 0 C--O 1.24 0.506 0 C-N-CA 119.652 -1.261 . . . . 60.82 112.286 -179.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -57.19 -41.32 79.14 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.35 -0.54 . . . . 82.790000000000006 110.964 174.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' ARG . . . . . . . . . . . . . 73.6 mtm-85 -64.86 -47.59 77.35 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 120.192 -0.603 . . . . 75.890000000000001 111.494 -177.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' ILE . . . . . . . . . . . . . 9.7 tt -60.53 -45.71 96.65 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 C-N-CA 119.252 -0.979 . . . . 56.649999999999999 110.135 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 42.3 t -61.09 -40.76 86.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.474 0 C-N-CA 119.521 -0.872 . . . . 65.439999999999998 110.737 -178.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -72.72 -38.99 67.29 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.806 -0.559 . . . . 78.900000000000006 111.606 -176.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' ILE . . . . . . . . . . . . . 86.1 mt -62.14 -50.72 78.87 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 CA-C-O 121.215 0.531 . . . . 68.890000000000001 110.267 176.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' ILE . . . . . . . . . . . . . 50.3 mt -66.45 -34.49 70.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 C-N-CA 119.372 -0.931 . . . . 71.540000000000006 110.917 -176.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' ALA . . . . . . . . . . . . . . . -68.15 -50.11 56.69 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.146 -0.622 . . . . 73.010000000000005 110.883 177.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' THR . . . . . . . . . . . . . 75.6 m -52.65 -46.08 66.99 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.936 0.398 . . . . 77.909999999999997 111.011 176.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -59.04 -15.13 11.96 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.688 -0.405 . . . . 80.420000000000002 112.024 178.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' ILE . . . . . . . . . . . . . 23.2 mm . . . . . 0 C--N 1.33 -0.261 0 CA-C-O 120.945 0.402 . . . . 87.900000000000006 110.129 177.44 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' 6SK . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' HOH . . . . . 0.681 ' O ' ' O ' ' A' ' 109' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' HOH . . . . . 0.592 ' O ' ' NZ ' ' A' ' 173' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 403' ' ' HOH . . . . . 0.539 ' O ' ' N ' ' A' ' 196' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 27.2 p . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.649 0.261 . . . . 92.060000000000002 111.049 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . 0.504 ' HB3' ' CD1' ' A' ' 60' ' ' ILE . 43.5 t -56.07 135.72 74.16 Favored Pre-proline 0 C--O 1.238 0.452 0 C-N-CA 120.546 -0.462 . . . . 74.700000000000003 109.98 179.901 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -73.51 -11.19 24.33 Favored 'Trans proline' 0 C--O 1.238 0.495 0 N-CA-C 114.213 0.813 . . . . 74.230000000000004 114.213 -177.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -103.08 19.95 44.7 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 119.04 0.836 . . . . 52.579999999999998 114.681 -178.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ILE . . . . . 0.504 ' CD1' ' HB3' ' A' ' 57' ' ' SER . 79.3 mt -98.3 126.77 51.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 109.095 -0.706 . . . . 66.260000000000005 109.095 -179.017 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 64.6 m95 -123.03 160.63 25.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.278 0.561 . . . . 44.240000000000002 110.083 176.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -124.65 134.38 52.91 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.325 -0.991 . . . . 55.090000000000003 108.325 177.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LEU . . . . . 0.64 HD11 HD21 ' A' ' 74' ' ' LEU . 11.2 tp -131.47 125.13 31.71 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.48 -0.563 . . . . 54.719999999999999 109.48 -172.924 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -148.67 165.66 30.69 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 120.998 -0.281 . . . . 48.509999999999998 111.581 176.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' CAF . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 29.6 p -118.2 172.08 7.68 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.753 -0.832 . . . . 75.620000000000005 108.753 170.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 69.6 m80 -127.64 142.3 51.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.052 0.453 . . . . 75.950000000000003 110.724 -174.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 40.6 mt -156.87 138.29 13.9 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 107.625 -1.25 . . . . 64.840000000000003 107.625 173.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 53.81 35.35 21.3 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.589 0.709 . . . . 60.469999999999999 111.228 176.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 63.19 25.03 67.83 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.32 -0.943 . . . . 60.759999999999998 114.312 -177.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -123.36 161.58 24.43 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 117.908 0.854 . . . . 69.299999999999997 109.902 177.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 73.6 t -106.22 129.87 58.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 CA-C-N 115.271 -0.877 . . . . 56.0 108.716 -174.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 64.8 mt -116.95 117.18 54.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 107.742 -1.207 . . . . 53.409999999999997 107.742 176.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . 0.64 HD21 HD11 ' A' ' 63' ' ' LEU . 4.1 tt -89.42 126.39 35.54 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 108.337 -0.986 . . . . 54.439999999999998 108.337 174.548 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 57.3 t -125.49 127.13 71.51 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 N-CA-C 108.947 -0.76 . . . . 47.539999999999999 108.947 -174.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -116.11 135.93 53.48 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 124.315 1.046 . . . . 43.32 109.076 173.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 42.0 t -125.01 125.23 69.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 108.09 -1.078 . . . . 44.119999999999997 108.09 -177.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 -76.62 99.75 5.12 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 106.7 -1.592 . . . . 50.609999999999999 106.7 168.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 99.3 t -54.12 -44.11 62.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-N 116.234 -0.439 . . . . 58.729999999999997 111.18 -167.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.64 -25.91 66.66 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.126 -0.629 . . . . 61.439999999999998 112.222 -175.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 78.7 p -119.51 -23.27 6.67 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 114.803 1.408 . . . . 52.259999999999998 114.803 -171.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.96 -3.71 84.91 Favored Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 119.128 0.877 . . . . 47.770000000000003 114.832 -171.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' TYR . . . . . 0.441 ' CE1' ' HG3' ' A' ' 85' ' ' GLU . 13.5 t80 -60.3 140.86 56.86 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.368 1.084 . . . . 48.009999999999998 110.205 175.95 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.2 mt -123.78 139.54 49.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 N-CA-C 109.715 -0.476 . . . . 51.119999999999997 109.715 -174.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . 0.441 ' HG3' ' CE1' ' A' ' 83' ' ' TYR . 73.4 mt-10 -121.21 146.66 46.56 Favored 'General case' 0 CA--C 1.521 -0.14 0 N-CA-C 108.463 -0.94 . . . . 53.259999999999998 108.463 161.387 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -150.69 151.95 33.21 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 119.46 -0.896 . . . . 46.340000000000003 110.024 -176.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -145.51 147.89 32.64 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 107.7 -1.222 . . . . 57.399999999999999 107.7 178.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 40.6 t -96.99 120.09 45.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 107.587 -1.264 . . . . 51.109999999999999 107.587 175.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 38.8 pt -112.51 150.68 43.02 Favored Pre-proline 0 C--O 1.24 0.602 0 N-CA-C 109.555 -0.535 . . . . 57.590000000000003 109.555 -175.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -68.2 -49.94 0.86 Allowed 'Trans proline' 0 C--O 1.236 0.423 0 C-N-CA 120.091 0.528 . . . . 70.519999999999996 112.02 -179.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -123.1 143.5 49.94 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 122.553 0.341 . . . . 67.549999999999997 110.162 -177.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -81.24 62.81 5.32 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 122.454 1.121 . . . . 64.819999999999993 110.357 177.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' THR . . . . . 0.547 HG23 ' H ' ' A' ' 96' ' ' GLU . 9.0 t -108.64 158.3 17.73 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.031 -0.986 . . . . 77.900000000000006 111.134 -173.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.66 -26.97 69.09 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 115.009 -0.996 . . . . 55.670000000000002 114.205 176.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -65.56 -46.04 81.0 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 117.915 0.858 . . . . 92.620000000000005 110.731 177.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLU . . . . . 0.547 ' H ' HG23 ' A' ' 93' ' ' THR . 77.7 mm-40 -60.0 -46.72 88.56 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.702 -0.399 . . . . 61.600000000000001 111.047 174.742 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 41.8 m -58.95 -42.83 90.76 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.002 -0.679 . . . . 40.659999999999997 110.941 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.9 -47.15 81.72 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 120.96 0.409 . . . . 44.109999999999999 110.99 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -59.76 -45.11 93.25 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 120.212 -0.595 . . . . 39.740000000000002 110.952 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -57.76 -44.53 86.22 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.698 -0.401 . . . . 44.369999999999997 110.942 177.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 28.5 mt -60.59 -43.32 97.53 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.433 -0.507 . . . . 43.509999999999998 111.206 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 86.9 mt -58.13 -45.39 87.4 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 119.719 -0.793 . . . . 37.210000000000001 110.849 176.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -59.37 -43.39 92.88 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 119.238 -0.985 . . . . 49.890000000000001 111.169 177.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 12.8 tp -66.7 -45.05 80.0 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 122.278 -0.264 . . . . 41.93 111.504 -174.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.33 -33.01 74.76 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.057 0.391 . . . . 42.979999999999997 112.057 -176.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -69.31 -12.0 65.37 Favored Glycine 0 CA--C 1.508 -0.403 0 C-N-CA 119.884 -1.15 . . . . 42.090000000000003 113.993 177.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ARG . . . . . 0.493 ' HG2' ' CD1' ' A' ' 108' ' ' TRP . 15.2 ttp-105 -108.15 -34.87 6.73 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.234 0.827 . . . . 57.5 113.234 -176.244 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' TRP . . . . . 0.493 ' CD1' ' HG2' ' A' ' 107' ' ' ARG . 76.1 m95 -124.73 160.58 53.08 Favored Pre-proline 0 C--N 1.325 -0.483 0 C-N-CA 123.026 0.531 . . . . 49.950000000000003 110.059 -179.379 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' PRO . . . . . 0.681 ' O ' ' O ' ' A' ' 401' ' ' HOH . 76.7 Cg_endo -78.45 94.87 1.06 Allowed 'Trans proline' 0 C--O 1.234 0.323 0 N-CA-C 110.688 -0.543 . . . . 54.670000000000002 110.688 171.234 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.0 t -97.26 111.52 27.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 N-CA-C 108.036 -1.098 . . . . 51.670000000000002 108.036 -174.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -92.99 -57.07 2.76 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.491 -0.322 . . . . 97.480000000000004 111.213 177.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' THR . . . . . 0.483 ' HA ' ' O ' ' A' ' 136' ' ' LYS . 69.2 p -133.57 146.99 51.5 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.489 0.661 . . . . 50.57 110.272 -176.233 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' VAL . . . . . 0.471 ' HB ' ' CE2' ' A' ' 130' ' ' CAF . 75.0 t -123.37 131.66 72.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 108.43 -0.952 . . . . 51.850000000000001 108.43 -179.972 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -111.93 160.09 17.76 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.508 1.123 . . . . 62.079999999999998 108.841 174.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.1 t -153.67 159.56 42.09 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.4 -0.963 . . . . 50.68 108.4 178.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -93.3 -1.8 55.64 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.592 -0.731 . . . . 57.240000000000002 112.701 174.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ASN . . . . . 0.525 ' HB3' ' ND2' ' A' ' 120' ' ' ASN . 61.3 t-20 -130.96 86.81 2.41 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 106.933 -1.506 . . . . 47.850000000000001 106.933 175.27 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -50.74 -36.95 33.58 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 120.438 -0.887 . . . . 45.850000000000001 113.227 -175.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 54.6 p -61.44 -11.78 11.92 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 122.096 -0.649 . . . . 42.659999999999997 112.592 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ASN . . . . . 0.525 ' ND2' ' HB3' ' A' ' 117' ' ' ASN . 92.2 m-20 -59.29 -27.57 65.98 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 118.459 0.572 . . . . 55.439999999999998 111.821 172.81 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 22.3 m-30 -109.62 20.43 18.14 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 113.019 0.748 . . . . 56.380000000000003 113.019 -167.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 81.7 p -94.94 -16.75 22.57 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 113.725 1.009 . . . . 64.439999999999998 113.725 -178.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 54.3 p -67.66 152.43 45.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.834 0.826 . . . . 62.259999999999998 110.635 -175.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' THR . . . . . 0.684 HG22 ' O ' ' A' ' 422' ' ' HOH . 5.2 t -60.86 -40.0 91.27 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.202 -0.908 . . . . 55.659999999999997 111.022 177.651 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 39.2 p -60.55 -42.4 96.46 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.885 -0.726 . . . . 57.200000000000003 111.134 -179.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 70.8 t -63.49 -51.02 75.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 120.121 -0.632 . . . . 47.340000000000003 110.395 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -58.56 -36.44 73.92 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 119.9 -0.72 . . . . 75.150000000000006 111.139 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.85 -45.1 95.26 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.158 -0.617 . . . . 45.380000000000003 111.03 177.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -62.28 -41.54 98.57 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.012 0.375 . . . . 42.740000000000002 112.012 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' CAF . . . . . 0.471 ' CE2' ' HB ' ' A' ' 113' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 31.3 t90 -60.56 -53.0 62.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 49.159999999999997 110.736 176.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' TRP . . . . . . . . . . . . . 79.0 t90 -64.21 -39.92 94.99 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.22 -0.592 . . . . 45.619999999999997 111.521 -175.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -85.63 -2.11 57.84 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.998 0.74 . . . . 42.719999999999999 112.998 -178.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 69.01 45.92 61.03 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 118.294 0.497 . . . . 45.259999999999998 112.577 179.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 43.3 mt -107.75 136.02 44.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 108.944 -0.762 . . . . 52.549999999999997 108.944 -177.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LYS . . . . . 0.483 ' O ' ' HA ' ' A' ' 112' ' ' THR . 7.8 mmpt? -109.29 151.0 27.15 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.628 -0.508 . . . . 67.109999999999999 109.628 175.601 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -84.26 161.51 20.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.677 0.751 . . . . 70.530000000000001 110.087 175.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 115.565 -0.743 . . . . 86.439999999999998 111.273 -179.814 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 . . . . . 0 C--O 1.233 0.209 0 CA-C-O 120.839 0.352 . . . . 96.989999999999995 111.75 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 46.9 t 72.12 2.12 4.19 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.745 1.218 . . . . 111.55 111.85 -172.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' MET . . . . . . . . . . . . . 23.8 mmt -60.56 -39.62 88.63 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 118.597 0.635 . . . . 103.22 111.106 178.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' ASN . . . . . 0.406 ' O ' ' HG3' ' A' ' 159' ' ' LYS . 51.0 m-20 -60.39 -32.84 71.69 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 119.786 -0.766 . . . . 89.200000000000003 111.407 175.119 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -76.74 -43.41 37.37 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 120.829 -0.348 . . . . 113.83 111.601 -179.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' GLU . . . . . 0.434 ' O ' ' HB3' ' A' ' 160' ' ' LYS . 16.2 tp10 -61.13 -50.55 72.74 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 120.324 -0.551 . . . . 97.739999999999995 110.87 174.764 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 158' ' ' LEU . . . . . 0.575 ' O ' HG13 ' A' ' 162' ' ' ILE . 39.9 tp -56.63 -43.91 80.72 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 122.209 -0.307 . . . . 72.200000000000003 111.092 178.069 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 159' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 155' ' ' ASN . 39.6 mttp -61.14 -32.05 71.76 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 119.45 -0.9 . . . . 86.310000000000002 111.375 174.864 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 160' ' ' LYS . . . . . 0.434 ' HB3' ' O ' ' A' ' 157' ' ' GLU . 40.9 ttmt -62.6 -57.66 10.31 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.054 0.454 . . . . 87.810000000000002 110.596 176.903 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 57.7 mt -58.83 -40.84 81.05 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 C-N-CA 120.438 -0.505 . . . . 62.0 110.643 -179.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' ILE . . . . . 0.575 HG13 ' O ' ' A' ' 158' ' ' LEU . 53.2 mt -56.29 -49.51 76.2 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 O-C-N 121.77 -0.581 . . . . 59.350000000000001 110.194 177.432 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -55.91 -39.71 79.17 Favored Glycine 0 C--N 1.336 0.566 0 C-N-CA 119.718 -1.229 . . . . 58.5 112.419 175.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -63.68 -39.46 94.37 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 122.23 -0.571 . . . . 72.620000000000005 112.033 -179.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 7.5 m -101.23 2.47 10.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 N-CA-C 113.076 0.769 . . . . 61.859999999999999 113.076 -171.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 43.3 tpt85 -61.83 -29.73 70.36 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 118.706 0.685 . . . . 61.899999999999999 112.637 -167.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -80.54 -17.38 51.69 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 113.082 0.771 . . . . 91.099999999999994 113.082 -173.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -74.09 -11.89 60.45 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 113.364 0.875 . . . . 77.950000000000003 113.364 178.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -133.71 141.57 47.6 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 118.73 0.695 . . . . 59.57 110.165 -172.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -66.57 -57.98 6.14 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.693 -0.685 . . . . 72.609999999999999 111.069 177.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -87.21 150.33 23.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.558 0.694 . . . . 62.359999999999999 111.269 -173.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 32.4 tp -63.91 -37.44 87.42 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.42 -0.809 . . . . 51.539999999999999 111.564 178.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' LYS . . . . . 0.531 ' NZ ' ' O ' ' A' ' 402' ' ' HOH . 59.9 pttt -63.49 -35.84 81.79 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 120.03 -0.668 . . . . 51.689999999999998 111.259 -174.915 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 26.5 m -61.77 -44.55 96.67 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 120.896 -0.321 . . . . 42.729999999999997 111.409 176.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.92 -36.72 84.15 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.912 -0.315 . . . . 43.780000000000001 111.338 177.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 55.7 t -59.25 -50.05 81.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-O 121.167 0.508 . . . . 45.270000000000003 110.209 175.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 58.5 mm-40 -65.69 -36.4 83.52 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 119.166 -1.014 . . . . 43.340000000000003 111.166 -179.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' MET . . . . . . . . . . . . . 90.1 mtp -57.49 -47.01 83.05 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.216 -0.594 . . . . 50.640000000000001 110.727 173.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' ALA . . . . . . . . . . . . . . . -63.07 -42.17 99.61 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.647 -0.251 . . . . 44.659999999999997 111.419 -179.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 71.7 t -57.39 -47.5 84.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-O 121.22 0.533 . . . . 41.539999999999999 110.089 175.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 181' ' ' PHE . . . . . 0.489 ' O ' ' HG2' ' A' ' 185' ' ' LYS . 38.1 t80 -53.49 -54.58 35.02 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.041 0.448 . . . . 45.460000000000001 111.159 177.296 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 49.1 mt -57.57 -49.69 79.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 C-N-CA 120.574 -0.45 . . . . 49.43 110.556 -177.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 61.8 t60 -60.07 -45.16 93.79 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 121.791 -0.568 . . . . 52.450000000000003 111.567 -177.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -69.59 -29.86 67.49 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 119.837 -0.745 . . . . 49.460000000000001 111.765 -176.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 181' ' ' PHE . 74.0 mmtt -87.62 -22.8 24.53 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 113.103 0.779 . . . . 69.930000000000007 113.103 -178.925 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 4.8 tppp? -51.79 135.86 28.79 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.324 0.583 . . . . 93.819999999999993 111.148 -178.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 31.5 mmt180 -88.6 138.58 31.29 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.725 -0.671 . . . . 98.230000000000004 109.937 177.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 91.8 mttt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 115.975 -0.557 . . . . 100.76000000000001 111.265 -178.557 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.312 0 N-CA-C 113.623 0.209 . . . . 98.719999999999999 113.623 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 194' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -62.67 166.09 5.77 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 122.066 0.936 . . . . 114.09 110.631 179.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 83.5 p -94.98 173.37 7.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.335 -0.848 . . . . 77.430000000000007 110.311 177.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.34 -46.31 90.36 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.261 -0.881 . . . . 56.219999999999999 111.391 179.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -62.73 -46.83 92.85 Favored Glycine 0 C--O 1.24 0.506 0 C-N-CA 119.652 -1.261 . . . . 60.82 112.286 -179.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -57.19 -41.32 79.14 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.35 -0.54 . . . . 82.790000000000006 110.964 174.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 199' ' ' ARG . . . . . . . . . . . . . 73.6 mtm-85 -64.86 -47.59 77.35 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 120.192 -0.603 . . . . 75.890000000000001 111.494 -177.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 200' ' ' ILE . . . . . . . . . . . . . 9.7 tt -60.53 -45.71 96.65 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 C-N-CA 119.252 -0.979 . . . . 56.649999999999999 110.135 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 42.3 t -61.09 -40.76 86.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.474 0 C-N-CA 119.521 -0.872 . . . . 65.439999999999998 110.737 -178.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -72.72 -38.99 67.29 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.806 -0.559 . . . . 78.900000000000006 111.606 -176.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 203' ' ' ILE . . . . . . . . . . . . . 86.1 mt -62.14 -50.72 78.87 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 CA-C-O 121.215 0.531 . . . . 68.890000000000001 110.267 176.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' ILE . . . . . . . . . . . . . 50.3 mt -66.45 -34.49 70.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 C-N-CA 119.372 -0.931 . . . . 71.540000000000006 110.917 -176.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 205' ' ' ALA . . . . . . . . . . . . . . . -68.15 -50.11 56.69 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.146 -0.622 . . . . 73.010000000000005 110.883 177.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 206' ' ' THR . . . . . . . . . . . . . 75.6 m -52.65 -46.08 66.99 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.936 0.398 . . . . 77.909999999999997 111.011 176.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -59.04 -15.13 11.96 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.688 -0.405 . . . . 80.420000000000002 112.024 178.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 208' ' ' ILE . . . . . . . . . . . . . 23.2 mm . . . . . 0 C--N 1.33 -0.261 0 CA-C-O 120.945 0.402 . . . . 87.900000000000006 110.129 177.44 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' 6SK . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 401' ' ' HOH . . . . . 0.681 ' O ' ' O ' ' A' ' 109' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 402' ' ' HOH . . . . . 0.531 ' O ' ' NZ ' ' A' ' 173' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 422' ' ' HOH . . . . . 0.684 ' O ' HG22 ' A' ' 124' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 27.2 p . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.649 0.261 . . . . 92.060000000000002 111.049 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . 0.504 ' HB3' ' CD1' ' A' ' 60' ' ' ILE . 43.5 t -56.07 135.72 74.16 Favored Pre-proline 0 C--O 1.238 0.452 0 C-N-CA 120.546 -0.462 . . . . 74.700000000000003 109.98 179.901 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -73.51 -11.19 24.33 Favored 'Trans proline' 0 C--O 1.238 0.495 0 N-CA-C 114.213 0.813 . . . . 74.230000000000004 114.213 -177.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -103.08 19.95 44.7 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 119.04 0.836 . . . . 52.579999999999998 114.681 -178.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.504 ' CD1' ' HB3' ' A' ' 57' ' ' SER . 79.3 mt -98.3 126.77 51.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 109.095 -0.706 . . . . 66.260000000000005 109.095 -179.017 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 64.6 m95 -123.03 160.63 25.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.278 0.561 . . . . 44.240000000000002 110.083 176.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -124.65 134.38 52.91 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.325 -0.991 . . . . 55.090000000000003 108.325 177.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.64 HD11 HD21 ' A' ' 74' ' ' LEU . 11.2 tp -131.47 125.13 31.71 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.48 -0.563 . . . . 54.719999999999999 109.48 -172.924 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -148.67 165.66 30.69 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 120.998 -0.281 . . . . 48.509999999999998 111.581 176.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' CAF . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 29.6 p -118.2 172.08 7.68 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.753 -0.832 . . . . 75.620000000000005 108.753 170.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 69.6 m80 -127.64 142.3 51.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.052 0.453 . . . . 75.950000000000003 110.724 -174.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 40.6 mt -156.87 138.29 13.9 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 107.625 -1.25 . . . . 64.840000000000003 107.625 173.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 53.81 35.35 21.3 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.589 0.709 . . . . 60.469999999999999 111.228 176.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 63.19 25.03 67.83 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.32 -0.943 . . . . 60.759999999999998 114.312 -177.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -123.36 161.58 24.43 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 117.908 0.854 . . . . 69.299999999999997 109.902 177.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 73.6 t -106.22 129.87 58.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 CA-C-N 115.271 -0.877 . . . . 56.0 108.716 -174.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 64.8 mt -116.95 117.18 54.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 107.742 -1.207 . . . . 53.409999999999997 107.742 176.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.64 HD21 HD11 ' A' ' 63' ' ' LEU . 4.1 tt -89.42 126.39 35.54 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 108.337 -0.986 . . . . 54.439999999999998 108.337 174.548 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 57.3 t -125.49 127.13 71.51 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 N-CA-C 108.947 -0.76 . . . . 47.539999999999999 108.947 -174.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -116.11 135.93 53.48 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 124.315 1.046 . . . . 43.32 109.076 173.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 42.0 t -125.01 125.23 69.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 108.09 -1.078 . . . . 44.119999999999997 108.09 -177.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 -76.62 99.75 5.12 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 106.7 -1.592 . . . . 50.609999999999999 106.7 168.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 99.3 t -54.12 -44.11 62.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-N 116.234 -0.439 . . . . 58.729999999999997 111.18 -167.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.64 -25.91 66.66 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.126 -0.629 . . . . 61.439999999999998 112.222 -175.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 78.7 p -119.51 -23.27 6.67 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 114.803 1.408 . . . . 52.259999999999998 114.803 -171.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.96 -3.71 84.91 Favored Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 119.128 0.877 . . . . 47.770000000000003 114.832 -171.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.441 ' CE1' ' HG3' ' A' ' 85' ' ' GLU . 13.5 t80 -60.3 140.86 56.86 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.368 1.084 . . . . 48.009999999999998 110.205 175.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.2 mt -123.78 139.54 49.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 N-CA-C 109.715 -0.476 . . . . 51.119999999999997 109.715 -174.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.441 ' HG3' ' CE1' ' A' ' 83' ' ' TYR . 73.4 mt-10 -121.21 146.66 46.56 Favored 'General case' 0 CA--C 1.521 -0.14 0 N-CA-C 108.463 -0.94 . . . . 53.259999999999998 108.463 161.387 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -150.69 151.95 33.21 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 119.46 -0.896 . . . . 46.340000000000003 110.024 -176.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -145.51 147.89 32.64 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 107.7 -1.222 . . . . 57.399999999999999 107.7 178.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 40.6 t -96.99 120.09 45.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 107.587 -1.264 . . . . 51.109999999999999 107.587 175.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 38.8 pt -112.51 150.68 43.02 Favored Pre-proline 0 C--O 1.24 0.602 0 N-CA-C 109.555 -0.535 . . . . 57.590000000000003 109.555 -175.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -68.2 -49.94 0.86 Allowed 'Trans proline' 0 C--O 1.236 0.423 0 C-N-CA 120.091 0.528 . . . . 70.519999999999996 112.02 -179.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -123.1 143.5 49.94 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 122.553 0.341 . . . . 67.549999999999997 110.162 -177.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -81.24 62.81 5.32 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 122.454 1.121 . . . . 64.819999999999993 110.357 177.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' THR . . . . . 0.547 HG23 ' H ' ' A' ' 96' ' ' GLU . 9.0 t -108.64 158.3 17.73 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.031 -0.986 . . . . 77.900000000000006 111.134 -173.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.66 -26.97 69.09 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 115.009 -0.996 . . . . 55.670000000000002 114.205 176.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -65.56 -46.04 81.0 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 117.915 0.858 . . . . 92.620000000000005 110.731 177.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.547 ' H ' HG23 ' A' ' 93' ' ' THR . 77.7 mm-40 -60.0 -46.72 88.56 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.702 -0.399 . . . . 61.600000000000001 111.047 174.742 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 41.8 m -58.95 -42.83 90.76 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.002 -0.679 . . . . 40.659999999999997 110.941 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.9 -47.15 81.72 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 120.96 0.409 . . . . 44.109999999999999 110.99 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -59.76 -45.11 93.25 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 120.212 -0.595 . . . . 39.740000000000002 110.952 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -57.76 -44.53 86.22 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.698 -0.401 . . . . 44.369999999999997 110.942 177.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 28.5 mt -60.59 -43.32 97.53 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.433 -0.507 . . . . 43.509999999999998 111.206 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 86.9 mt -58.13 -45.39 87.4 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 119.719 -0.793 . . . . 37.210000000000001 110.849 176.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -59.37 -43.39 92.88 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 119.238 -0.985 . . . . 49.890000000000001 111.169 177.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 12.8 tp -66.7 -45.05 80.0 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 122.278 -0.264 . . . . 41.93 111.504 -174.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.33 -33.01 74.76 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.057 0.391 . . . . 42.979999999999997 112.057 -176.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -69.31 -12.0 65.37 Favored Glycine 0 CA--C 1.508 -0.403 0 C-N-CA 119.884 -1.15 . . . . 42.090000000000003 113.993 177.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.493 ' HG2' ' CD1' ' A' ' 108' ' ' TRP . 15.2 ttp-105 -108.15 -34.87 6.73 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.234 0.827 . . . . 57.5 113.234 -176.244 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' TRP . . . . . 0.493 ' CD1' ' HG2' ' A' ' 107' ' ' ARG . 76.1 m95 -124.73 160.58 53.08 Favored Pre-proline 0 C--N 1.325 -0.483 0 C-N-CA 123.026 0.531 . . . . 49.950000000000003 110.059 -179.379 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.681 ' O ' ' O ' ' A' ' 401' ' ' HOH . 76.7 Cg_endo -78.45 94.87 1.06 Allowed 'Trans proline' 0 C--O 1.234 0.323 0 N-CA-C 110.688 -0.543 . . . . 54.670000000000002 110.688 171.234 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.0 t -97.26 111.52 27.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 N-CA-C 108.036 -1.098 . . . . 51.670000000000002 108.036 -174.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -92.99 -57.07 2.76 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.491 -0.322 . . . . 97.480000000000004 111.213 177.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' THR . . . . . 0.483 ' HA ' ' O ' ' A' ' 136' ' ' LYS . 69.2 p -133.57 146.99 51.5 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.489 0.661 . . . . 50.57 110.272 -176.233 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.471 ' HB ' ' CE2' ' A' ' 130' ' ' CAF . 75.0 t -123.37 131.66 72.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 108.43 -0.952 . . . . 51.850000000000001 108.43 -179.972 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -111.93 160.09 17.76 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.508 1.123 . . . . 62.079999999999998 108.841 174.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.1 t -153.67 159.56 42.09 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.4 -0.963 . . . . 50.68 108.4 178.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -93.3 -1.8 55.64 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.592 -0.731 . . . . 57.240000000000002 112.701 174.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.525 ' HB3' ' ND2' ' A' ' 120' ' ' ASN . 61.3 t-20 -130.96 86.81 2.41 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 106.933 -1.506 . . . . 47.850000000000001 106.933 175.27 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -50.74 -36.95 33.58 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 120.438 -0.887 . . . . 45.850000000000001 113.227 -175.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 54.6 p -61.44 -11.78 11.92 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 122.096 -0.649 . . . . 42.659999999999997 112.592 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ASN . . . . . 0.525 ' ND2' ' HB3' ' A' ' 117' ' ' ASN . 92.2 m-20 -59.29 -27.57 65.98 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 118.459 0.572 . . . . 55.439999999999998 111.821 172.81 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 22.3 m-30 -109.62 20.43 18.14 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 113.019 0.748 . . . . 56.380000000000003 113.019 -167.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 81.7 p -94.94 -16.75 22.57 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 113.725 1.009 . . . . 64.439999999999998 113.725 -178.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 54.3 p -67.66 152.43 45.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.834 0.826 . . . . 62.259999999999998 110.635 -175.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' THR . . . . . 0.684 HG22 ' O ' ' A' ' 422' ' ' HOH . 5.2 t -60.86 -40.0 91.27 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.202 -0.908 . . . . 55.659999999999997 111.022 177.651 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 39.2 p -60.55 -42.4 96.46 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.885 -0.726 . . . . 57.200000000000003 111.134 -179.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 70.8 t -63.49 -51.02 75.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 120.121 -0.632 . . . . 47.340000000000003 110.395 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -58.56 -36.44 73.92 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 119.9 -0.72 . . . . 75.150000000000006 111.139 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.85 -45.1 95.26 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.158 -0.617 . . . . 45.380000000000003 111.03 177.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -62.28 -41.54 98.57 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.012 0.375 . . . . 42.740000000000002 112.012 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' CAF . . . . . 0.471 ' CE2' ' HB ' ' A' ' 113' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 31.3 t90 -60.56 -53.0 62.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 49.159999999999997 110.736 176.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' TRP . . . . . . . . . . . . . 79.0 t90 -64.21 -39.92 94.99 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.22 -0.592 . . . . 45.619999999999997 111.521 -175.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -85.63 -2.11 57.84 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.998 0.74 . . . . 42.719999999999999 112.998 -178.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 69.01 45.92 61.03 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 118.294 0.497 . . . . 45.259999999999998 112.577 179.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 43.3 mt -107.75 136.02 44.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 108.944 -0.762 . . . . 52.549999999999997 108.944 -177.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.483 ' O ' ' HA ' ' A' ' 112' ' ' THR . 7.8 mmpt? -109.29 151.0 27.15 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.628 -0.508 . . . . 67.109999999999999 109.628 175.601 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -84.26 161.51 20.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.677 0.751 . . . . 70.530000000000001 110.087 175.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 115.565 -0.743 . . . . 86.439999999999998 111.273 -179.814 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 . . . . . 0 C--O 1.233 0.209 0 CA-C-O 120.839 0.352 . . . . 96.989999999999995 111.75 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 46.9 t 72.12 2.12 4.19 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.745 1.218 . . . . 111.55 111.85 -172.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' MET . . . . . . . . . . . . . 23.8 mmt -60.56 -39.62 88.63 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 118.597 0.635 . . . . 103.22 111.106 178.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.406 ' O ' ' HG3' ' A' ' 159' ' ' LYS . 51.0 m-20 -60.39 -32.84 71.69 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 119.786 -0.766 . . . . 89.200000000000003 111.407 175.119 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -76.74 -43.41 37.37 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 120.829 -0.348 . . . . 113.83 111.601 -179.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' GLU . . . . . 0.434 ' O ' ' HB3' ' A' ' 160' ' ' LYS . 16.2 tp10 -61.13 -50.55 72.74 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 120.324 -0.551 . . . . 97.739999999999995 110.87 174.764 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.575 ' O ' HG13 ' A' ' 162' ' ' ILE . 39.9 tp -56.63 -43.91 80.72 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 122.209 -0.307 . . . . 72.200000000000003 111.092 178.069 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 155' ' ' ASN . 39.6 mttp -61.14 -32.05 71.76 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 119.45 -0.9 . . . . 86.310000000000002 111.375 174.864 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' LYS . . . . . 0.434 ' HB3' ' O ' ' A' ' 157' ' ' GLU . 40.9 ttmt -62.6 -57.66 10.31 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.054 0.454 . . . . 87.810000000000002 110.596 176.903 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 57.7 mt -58.83 -40.84 81.05 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 C-N-CA 120.438 -0.505 . . . . 62.0 110.643 -179.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.575 HG13 ' O ' ' A' ' 158' ' ' LEU . 53.2 mt -56.29 -49.51 76.2 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 O-C-N 121.77 -0.581 . . . . 59.350000000000001 110.194 177.432 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -55.91 -39.71 79.17 Favored Glycine 0 C--N 1.336 0.566 0 C-N-CA 119.718 -1.229 . . . . 58.5 112.419 175.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -63.68 -39.46 94.37 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 122.23 -0.571 . . . . 72.620000000000005 112.033 -179.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 7.5 m -101.23 2.47 10.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 N-CA-C 113.076 0.769 . . . . 61.859999999999999 113.076 -171.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 43.3 tpt85 -61.83 -29.73 70.36 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 118.706 0.685 . . . . 61.899999999999999 112.637 -167.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -80.54 -17.38 51.69 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 113.082 0.771 . . . . 91.099999999999994 113.082 -173.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -74.09 -11.89 60.45 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 113.364 0.875 . . . . 77.950000000000003 113.364 178.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -133.71 141.57 47.6 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 118.73 0.695 . . . . 59.57 110.165 -172.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -66.57 -57.98 6.14 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.693 -0.685 . . . . 72.609999999999999 111.069 177.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -87.21 150.33 23.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.558 0.694 . . . . 62.359999999999999 111.269 -173.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 32.4 tp -63.91 -37.44 87.42 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.42 -0.809 . . . . 51.539999999999999 111.564 178.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' LYS . . . . . 0.531 ' NZ ' ' O ' ' A' ' 402' ' ' HOH . 59.9 pttt -63.49 -35.84 81.79 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 120.03 -0.668 . . . . 51.689999999999998 111.259 -174.915 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 26.5 m -61.77 -44.55 96.67 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 120.896 -0.321 . . . . 42.729999999999997 111.409 176.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.92 -36.72 84.15 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.912 -0.315 . . . . 43.780000000000001 111.338 177.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 55.7 t -59.25 -50.05 81.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-O 121.167 0.508 . . . . 45.270000000000003 110.209 175.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 58.5 mm-40 -65.69 -36.4 83.52 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 119.166 -1.014 . . . . 43.340000000000003 111.166 -179.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' MET . . . . . . . . . . . . . 90.1 mtp -57.49 -47.01 83.05 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.216 -0.594 . . . . 50.640000000000001 110.727 173.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' ALA . . . . . . . . . . . . . . . -63.07 -42.17 99.61 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.647 -0.251 . . . . 44.659999999999997 111.419 -179.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 71.7 t -57.39 -47.5 84.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-O 121.22 0.533 . . . . 41.539999999999999 110.089 175.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' PHE . . . . . 0.489 ' O ' ' HG2' ' A' ' 185' ' ' LYS . 38.1 t80 -53.49 -54.58 35.02 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.041 0.448 . . . . 45.460000000000001 111.159 177.296 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 49.1 mt -57.57 -49.69 79.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 C-N-CA 120.574 -0.45 . . . . 49.43 110.556 -177.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 61.8 t60 -60.07 -45.16 93.79 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 121.791 -0.568 . . . . 52.450000000000003 111.567 -177.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -69.59 -29.86 67.49 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 119.837 -0.745 . . . . 49.460000000000001 111.765 -176.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 181' ' ' PHE . 74.0 mmtt -87.62 -22.8 24.53 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 113.103 0.779 . . . . 69.930000000000007 113.103 -178.925 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 4.8 tppp? -51.79 135.86 28.79 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.324 0.583 . . . . 93.819999999999993 111.148 -178.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 31.5 mmt180 -88.6 138.58 31.29 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.725 -0.671 . . . . 98.230000000000004 109.937 177.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 91.8 mttt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 115.975 -0.557 . . . . 100.76000000000001 111.265 -178.557 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.312 0 N-CA-C 113.623 0.209 . . . . 98.719999999999999 113.623 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -62.67 166.09 5.77 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 122.066 0.936 . . . . 114.09 110.631 179.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 83.5 p -94.98 173.37 7.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.335 -0.848 . . . . 77.430000000000007 110.311 177.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.34 -46.31 90.36 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.261 -0.881 . . . . 56.219999999999999 111.391 179.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -62.73 -46.83 92.85 Favored Glycine 0 C--O 1.24 0.506 0 C-N-CA 119.652 -1.261 . . . . 60.82 112.286 -179.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -57.19 -41.32 79.14 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.35 -0.54 . . . . 82.790000000000006 110.964 174.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' ARG . . . . . . . . . . . . . 73.6 mtm-85 -64.86 -47.59 77.35 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 120.192 -0.603 . . . . 75.890000000000001 111.494 -177.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' ILE . . . . . . . . . . . . . 9.7 tt -60.53 -45.71 96.65 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 C-N-CA 119.252 -0.979 . . . . 56.649999999999999 110.135 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 42.3 t -61.09 -40.76 86.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.474 0 C-N-CA 119.521 -0.872 . . . . 65.439999999999998 110.737 -178.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -72.72 -38.99 67.29 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.806 -0.559 . . . . 78.900000000000006 111.606 -176.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' ILE . . . . . . . . . . . . . 86.1 mt -62.14 -50.72 78.87 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 CA-C-O 121.215 0.531 . . . . 68.890000000000001 110.267 176.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' ILE . . . . . . . . . . . . . 50.3 mt -66.45 -34.49 70.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 C-N-CA 119.372 -0.931 . . . . 71.540000000000006 110.917 -176.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' ALA . . . . . . . . . . . . . . . -68.15 -50.11 56.69 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.146 -0.622 . . . . 73.010000000000005 110.883 177.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' THR . . . . . . . . . . . . . 75.6 m -52.65 -46.08 66.99 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.936 0.398 . . . . 77.909999999999997 111.011 176.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -59.04 -15.13 11.96 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.688 -0.405 . . . . 80.420000000000002 112.024 178.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' ILE . . . . . . . . . . . . . 23.2 mm . . . . . 0 C--N 1.33 -0.261 0 CA-C-O 120.945 0.402 . . . . 87.900000000000006 110.129 177.44 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' 6SK . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' HOH . . . . . 0.681 ' O ' ' O ' ' A' ' 109' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' HOH . . . . . 0.531 ' O ' ' NZ ' ' A' ' 173' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 422' ' ' HOH . . . . . 0.684 ' O ' HG22 ' A' ' 124' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_