data_5w3b_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 5w3b _Structure_validation_residue.Date_analyzed 2017-12-29 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 ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.723 0 N-CA-C 113.902 1.075 . . . . 132.30000000000001 113.902 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.6 mttp -174.29 147.61 1.2 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 105.4 -2.074 . . . . 104.48999999999999 105.4 -171.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -111.17 136.2 50.58 Favored 'General case' 0 CA--C 1.496 -1.125 0 N-CA-C 109.313 -0.625 . . . . 107.34 109.313 -168.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -121.82 167.13 13.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.451 -0.795 . . . . 70.299999999999997 111.155 -178.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 85.3 m -137.34 127.74 26.53 Favored 'General case' 0 CA--C 1.494 -1.198 0 N-CA-C 105.583 -2.006 . . . . 92.519999999999996 105.583 177.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.6 mp -51.53 145.49 8.78 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 115.554 -0.748 . . . . 92.900000000000006 110.505 -177.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -95.02 91.32 6.3 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 101.412 -3.551 . . . . 93.030000000000001 101.412 164.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.5 mttm -47.35 -29.95 2.89 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 113.069 0.766 . . . . 95.219999999999999 113.069 -179.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.65 -20.92 61.89 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 114.986 1.476 . . . . 84.609999999999999 114.986 -179.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 47.6 m80 -128.12 35.2 4.47 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-O 121.852 0.834 . . . . 122.36 112.503 177.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.6 m -130.74 137.62 49.58 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 106.037 -1.838 . . . . 84.959999999999994 106.037 178.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -130.21 116.89 19.06 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.884 -0.784 . . . . 91.340000000000003 108.884 178.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 30.1 t -98.53 88.05 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -1.0 0 N-CA-C 104.231 -2.507 . . . . 79.390000000000001 104.231 178.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -113.82 163.75 12.13 Favored Glycine 0 N--CA 1.476 1.303 0 N-CA-C 117.121 1.608 . . . . 71.219999999999999 117.121 -166.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -149.66 155.84 40.91 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.675 1.19 . . . . 73.569999999999993 110.533 -178.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.4 mttt -136.24 130.16 32.66 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 105.719 -1.956 . . . . 121.45 105.719 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 19.4 tt -138.66 137.32 43.22 Favored 'Isoleucine or valine' 0 C--O 1.249 1.072 0 O-C-N 123.48 0.487 . . . . 57.520000000000003 110.66 174.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -86.06 130.15 34.62 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.929 -0.767 . . . . 96.790000000000006 108.929 -173.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -131.28 163.74 27.13 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 117.73 2.493 . . . . 74.680000000000007 117.73 163.654 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 72.2 mt -94.63 149.79 20.88 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 114.552 -1.204 . . . . 82.049999999999997 111.724 175.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -138.89 131.68 29.21 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-O 121.825 0.821 . . . . 100.31999999999999 109.888 167.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tt -86.42 135.52 24.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 114.389 -1.278 . . . . 75.459999999999994 108.06 173.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.8 p -142.86 152.52 42.22 Favored 'General case' 0 C--O 1.243 0.731 0 N-CA-C 108.384 -0.969 . . . . 88.359999999999999 108.384 174.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -86.23 122.89 30.86 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 118.056 -0.973 . . . . 134.84999999999999 110.784 173.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 22.7 t -78.54 118.79 26.37 Favored 'Isoleucine or valine' 0 C--O 1.255 1.352 0 CA-C-N 119.54 1.064 . . . . 80.790000000000006 108.274 160.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . . . -104.02 145.41 30.2 Favored 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 107.688 -1.227 . . . . 82.780000000000001 107.688 172.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -165.51 163.94 36.94 Favored Glycine 0 CA--C 1.501 -0.789 0 N-CA-C 110.283 -1.127 . . . . 71.840000000000003 110.283 -178.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -138.29 -171.36 3.02 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.537 0.735 . . . . 79.219999999999999 109.787 169.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -124.4 127.79 48.07 Favored 'General case' 0 C--O 1.247 0.947 0 N-CA-C 108.068 -1.086 . . . . 75.120000000000005 108.068 171.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . . . -66.04 -29.81 70.24 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 124.423 1.077 . . . . 85.060000000000002 111.219 -179.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -129.19 113.85 15.57 Favored 'General case' 0 CA--C 1.556 1.207 0 N-CA-C 116.601 2.075 . . . . 124.93000000000001 116.601 -168.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -158.09 159.32 36.14 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.525 0.678 . . . . 72.560000000000002 109.977 -174.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.0 t -122.93 144.21 49.38 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.751 -0.659 . . . . 99.650000000000006 110.01 175.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -140.82 149.93 42.66 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 114.785 1.402 . . . . 78.0 114.785 167.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 98.2 t -107.41 117.81 53.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 127.082 2.153 . . . . 74.700000000000003 111.103 166.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 14.8 mt -122.76 111.67 30.94 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.018 0 N-CA-C 113.457 0.91 . . . . 73.069999999999993 113.457 -175.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -111.06 117.61 33.76 Favored 'General case' 0 C--O 1.248 1.012 0 C-N-CA 124.752 1.221 . . . . 76.950000000000003 111.697 173.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -142.73 134.13 26.28 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 124.434 1.083 . . . . 86.709999999999994 111.655 -172.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -103.37 100.67 19.14 Favored Pre-proline 0 C--O 1.246 0.877 0 C-N-CA 124.242 1.017 . . . . 75.510000000000005 112.555 -179.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_exo -69.05 -14.6 38.63 Favored 'Trans proline' 0 C--N 1.363 1.296 0 O-C-N 123.184 1.097 . . . . 69.519999999999996 114.509 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.12 -37.61 80.56 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.376 0.88 . . . . 74.5 113.376 169.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.9 p -119.17 -7.04 10.37 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.352 0.871 . . . . 78.329999999999998 113.352 -172.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 53.46 47.36 24.23 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.064 0.946 . . . . 76.980000000000004 112.811 -176.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 67.5 mt-10 -115.68 137.99 51.54 Favored 'General case' 0 CA--C 1.515 -0.404 0 C-N-CA 127.122 2.169 . . . . 96.879999999999995 111.684 174.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -84.23 142.78 30.04 Favored 'General case' 0 C--O 1.257 1.478 0 N-CA-C 108.399 -0.963 . . . . 62.289999999999999 108.399 168.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -109.07 -36.94 5.94 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 114.451 -1.25 . . . . 107.20999999999999 109.687 -173.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 19.4 tttp -158.86 133.59 8.13 Favored 'General case' 0 N--CA 1.436 -1.157 0 N-CA-C 105.737 -1.949 . . . . 108.09 105.737 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 11.4 tp -144.47 116.67 8.43 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 109.164 -0.68 . . . . 71.530000000000001 109.164 172.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 -136.74 116.45 13.02 Favored 'General case' 0 CA--C 1.505 -0.785 0 C-N-CA 124.617 1.167 . . . . 82.400000000000006 108.111 -171.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.1 t -120.42 143.78 31.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 107.667 -1.234 . . . . 65.230000000000004 107.667 -174.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 3.6 m -131.24 129.98 42.3 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 107.52 -1.289 . . . . 80.189999999999998 107.52 171.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 7.5 mt -120.64 133.29 67.8 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.363 0 N-CA-C 107.113 -1.439 . . . . 70.409999999999997 107.113 -172.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 36.3 mttm -89.3 108.55 19.69 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 124.294 0.996 . . . . 98.319999999999993 109.114 176.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.2 mm -49.74 -44.03 19.71 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 CA-C-N 114.367 -1.288 . . . . 71.569999999999993 111.398 -178.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -45.89 -27.08 0.8 Allowed 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.144 1.165 . . . . 81.129999999999995 114.144 176.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 56.9 p -95.02 12.0 30.03 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 113.477 0.917 . . . . 74.939999999999998 113.477 -171.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 8.1 p -53.94 139.56 12.1 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 112.385 0.513 . . . . 70.849999999999994 112.385 175.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -140.2 109.87 6.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.701 0.762 . . . . 103.86 111.546 173.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' THR . . . . . 0.688 ' OG1' ' NH1' ' A' ' 84' ' ' ARG . 81.1 p -113.88 30.09 7.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.677 -1.147 . . . . 91.189999999999998 109.645 175.781 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 69.29 9.68 7.43 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.739 1.385 . . . . 150.15000000000001 114.739 175.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -144.35 100.97 3.63 Favored 'General case' 0 N--CA 1.438 -1.054 0 N-CA-C 107.566 -1.272 . . . . 105.38 107.566 -170.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 38.5 tp60 -43.7 -57.41 3.21 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 113.975 -1.466 . . . . 148.84 113.799 178.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . 0.254 40.1 p -62.03 -31.65 72.07 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 119.399 -0.92 . . . . 130.30000000000001 111.257 -175.852 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ARG . . . . . 0.688 ' NH1' ' OG1' ' A' ' 79' ' ' THR . 3.4 ttm105 -74.68 -42.28 58.71 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 112.682 0.623 . . . . 92.620000000000005 112.682 179.882 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -52.37 -43.59 64.78 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 113.522 0.934 . . . . 96.599999999999994 113.522 173.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -64.15 -42.85 96.6 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-O 120.965 0.412 . . . . 114.77 111.892 175.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -65.33 -26.46 68.05 Favored 'General case' 0 CA--C 1.554 1.107 0 N-CA-C 107.579 -1.267 . . . . 123.31 107.579 -174.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 28.0 mt -72.15 -31.74 66.25 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 113.56 0.948 . . . . 79.140000000000001 113.56 -177.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -64.7 -23.39 67.24 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 115.914 1.82 . . . . 88.989999999999995 115.914 170.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 65.6 mm-40 -66.88 168.78 9.17 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 114.188 1.181 . . . . 134.93000000000001 114.188 -173.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -53.5 -27.98 28.44 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 115.597 1.703 . . . . 140.08000000000001 115.597 179.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.9 p-10 -86.07 -5.22 59.25 Favored 'General case' 0 CA--C 1.566 1.573 0 O-C-N 123.578 0.549 . . . . 106.67 112.187 -173.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -126.31 -115.16 0.28 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.171 1.788 . . . . 84.900000000000006 114.024 171.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 -73.7 -22.88 59.78 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 117.023 2.231 . . . . 83.640000000000001 117.023 -168.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LYS . . . . . 0.425 ' NZ ' ' O ' ' A' ' 401' ' ' HOH . 45.9 tttt 49.89 50.62 18.11 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 126.539 1.936 . . . . 92.829999999999998 110.769 -174.302 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -52.49 -27.63 17.06 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 117.055 2.243 . . . . 72.400000000000006 117.055 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . . . -57.54 -58.65 7.39 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 106.928 -1.508 . . . . 74.129999999999995 106.928 175.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -69.88 -42.27 73.7 Favored 'General case' 0 N--CA 1.51 2.539 0 N-CA-C 115.489 1.663 . . . . 79.650000000000006 115.489 176.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -128.91 81.44 70.82 Favored Pre-proline 0 N--CA 1.477 0.889 0 N-CA-C 107.609 -1.256 . . . . 67.019999999999996 107.609 -172.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.28 -15.15 31.6 Favored 'Trans proline' 0 N--CA 1.496 1.649 0 C-N-CA 123.062 2.508 . . . . 77.620000000000005 116.608 -173.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . 0.28 4.9 p30 -138.14 147.72 44.19 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 116.859 2.17 . . . . 88.189999999999998 116.859 -179.103 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' MET . . . . . 0.489 ' CE ' ' CG1' ' A' ' 125' ' ' ILE . 14.6 ptm -106.76 145.78 31.65 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 119.092 -1.043 . . . . 66.939999999999998 108.803 168.4 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 34.3 p -128.02 138.61 52.66 Favored 'General case' 0 C--O 1.248 0.976 0 CA-C-N 113.797 -1.547 . . . . 57.340000000000003 111.54 -172.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -119.41 134.65 55.11 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 114.213 -1.358 . . . . 62.450000000000003 110.957 170.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.7 m -129.87 113.22 14.37 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 123.718 0.807 . . . . 70.829999999999998 113.166 179.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 37.9 ttp -65.92 130.24 42.58 Favored 'General case' 0 C--O 1.199 -1.574 0 C-N-CA 120.193 -0.603 . . . . 63.609999999999999 111.191 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -106.68 -17.61 14.18 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 113.883 1.068 . . . . 91.790000000000006 113.883 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.4 tttp -168.23 131.61 1.55 Allowed 'General case' 0 C--O 1.25 1.117 0 N-CA-C 106.326 -1.731 . . . . 101.13 106.326 -165.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -119.04 127.14 53.15 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 107.6 -1.259 . . . . 73.200000000000003 107.6 164.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -115.86 105.04 12.23 Favored 'General case' 0 C--O 1.245 0.858 0 N-CA-C 106.361 -1.718 . . . . 65.290000000000006 106.361 -178.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -64.96 135.99 56.3 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 124.305 1.003 . . . . 81.260000000000005 111.442 -175.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.1 mt -98.28 -59.89 3.01 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.724 0 N-CA-C 107.044 -1.465 . . . . 59.329999999999998 107.044 169.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 23.1 p30 -145.54 -161.6 1.34 Allowed 'General case' 0 C--O 1.249 1.04 0 N-CA-C 105.887 -1.894 . . . . 83.650000000000006 105.887 165.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 38.9 m-20 -73.79 -13.72 60.99 Favored 'General case' 0 C--O 1.216 -0.695 0 N-CA-C 113.709 1.003 . . . . 86.400000000000006 113.709 -178.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -98.81 -12.38 20.91 Favored 'General case' 0 C--O 1.243 0.763 0 C-N-CA 118.092 -1.443 . . . . 110.59 113.094 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 50.4 mttt -147.13 133.27 19.35 Favored 'General case' 0 C--O 1.245 0.843 0 O-C-N 125.305 1.628 . . . . 100.86 112.676 -157.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -156.29 164.33 32.38 Favored Glycine 0 CA--C 1.499 -0.92 0 C-N-CA 119.488 -1.339 . . . . 58.479999999999997 112.12 171.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 8.7 tttt -101.81 115.7 31.11 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 106.916 -1.512 . . . . 72.510000000000005 106.916 177.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 41.5 ttm -100.46 128.67 46.45 Favored 'General case' 0 C--O 1.215 -0.735 0 C-N-CA 123.068 0.547 . . . . 62.990000000000002 111.001 175.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 45.6 m -114.26 130.53 56.64 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 122.719 0.408 . . . . 58.380000000000003 110.407 175.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -156.99 172.4 34.55 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 114.629 0.611 . . . . 56.700000000000003 114.629 -175.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 52.4 m -102.42 117.95 35.82 Favored 'General case' 0 CA--C 1.497 -1.085 0 N-CA-C 107.771 -1.196 . . . . 53.810000000000002 107.771 -176.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 24.2 tp -97.22 141.41 30.37 Favored 'General case' 0 C--O 1.251 1.183 0 N-CA-C 106.82 -1.548 . . . . 50.039999999999999 106.82 173.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 88.4 m -130.01 115.79 17.62 Favored 'General case' 0 CA--C 1.481 -1.704 0 N-CA-C 108.789 -0.819 . . . . 59.25 108.789 175.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ILE . . . . . 0.489 ' CG1' ' CE ' ' A' ' 102' ' ' MET . 25.6 mt -117.97 127.36 75.22 Favored 'Isoleucine or valine' 0 C--O 1.251 1.138 0 N-CA-C 105.556 -2.016 . . . . 69.780000000000001 105.556 176.472 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . 43.28 49.14 5.85 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 124.702 1.251 . . . . 63.420000000000002 113.91 179.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 73.94 3.41 64.15 Favored Glycine 0 C--N 1.332 0.316 0 N-CA-C 115.233 0.853 . . . . 61.07 115.233 176.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . 0.313 1.5 p -112.73 133.69 57.74 Favored 'Isoleucine or valine' 0 C--O 1.26 1.621 0 C-N-CA 117.081 -1.848 . . . . 68.769999999999996 110.838 172.57 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 15.9 m -118.36 132.03 56.28 Favored 'General case' 0 CA--C 1.476 -1.903 0 CA-C-N 113.3 -1.773 . . . . 60.140000000000001 111.762 -167.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -142.84 153.02 42.78 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 107.45 -1.315 . . . . 89.049999999999997 107.45 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -88.2 126.0 34.92 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.075 -0.966 . . . . 76.390000000000001 111.321 176.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 9.7 pt -121.29 160.62 22.28 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 CA-C-N 115.608 -0.724 . . . . 55.469999999999999 112.305 -175.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 8.6 m -114.93 129.2 71.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 O-C-N 121.973 -0.455 . . . . 64.239999999999995 109.821 175.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 48.8 mt -111.17 144.3 40.54 Favored 'General case' 0 C--O 1.25 1.116 0 CA-C-O 121.367 0.603 . . . . 57.82 109.506 174.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -91.28 109.55 20.82 Favored 'General case' 0 C--O 1.259 1.558 0 CA-C-N 114.926 -1.034 . . . . 76.859999999999999 109.273 174.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -81.02 125.7 30.5 Favored 'General case' 0 CA--C 1.484 -1.572 0 CA-C-N 112.24 -2.254 . . . . 59.149999999999999 106.061 177.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -128.39 103.66 7.27 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 113.285 -1.78 . . . . 132.34999999999999 108.896 172.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 2.4 mp -72.31 99.34 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.853 0 CA-C-N 116.123 -0.49 . . . . 85.459999999999994 111.766 175.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -80.68 15.85 17.65 Favored Glycine 0 CA--C 1.54 1.599 0 N-CA-C 117.019 1.568 . . . . 107.77 117.019 174.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 143.54 132.89 2.66 Favored Glycine 0 N--CA 1.484 1.886 0 N-CA-C 120.444 2.937 . . . . 97.329999999999998 120.444 174.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 60.6 t -128.7 129.09 68.43 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.307 0 N-CA-C 105.545 -2.02 . . . . 111.41 105.545 -175.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -145.84 162.59 37.35 Favored 'General case' 0 C--O 1.252 1.204 0 N-CA-C 114.175 1.176 . . . . 100.64 114.175 -169.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 4.7 mttt -99.76 130.88 46.01 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.155 -0.929 . . . . 124.66 108.94 159.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -76.2 173.52 53.92 Favored Glycine 0 C--O 1.252 1.246 0 N-CA-C 115.253 0.861 . . . . 177.05000000000001 115.253 -169.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -32.11 -62.4 0.22 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 124.258 1.023 . . . . 172.78999999999999 110.251 165.977 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -73.14 6.92 2.42 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 118.035 2.605 . . . . 147.37 118.035 -179.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 72.88 -1.28 40.14 Favored Glycine 0 CA--C 1.546 1.985 0 N-CA-C 119.15 2.42 . . . . 115.73 119.15 -171.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 30.3 mttt -94.04 145.32 24.75 Favored 'General case' 0 C--O 1.249 1.061 0 O-C-N 121.918 -0.754 . . . . 121.95 111.934 168.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -61.68 150.42 36.62 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 118.157 2.651 . . . . 106.03 118.157 -170.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 2.8 pttt -131.62 170.33 14.91 Favored 'General case' 0 C--O 1.262 1.761 0 CA-C-N 113.965 -1.47 . . . . 114.45999999999999 111.279 161.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 14.3 pt -155.04 153.56 7.84 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.311 0 C-N-CA 125.273 1.429 . . . . 75.730000000000004 107.935 170.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -138.7 117.42 1.41 Allowed Glycine 0 C--N 1.331 0.291 0 N-CA-C 107.944 -2.062 . . . . 103.29000000000001 107.944 175.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -137.69 166.9 22.83 Favored 'General case' 0 CA--C 1.489 -1.39 0 C-N-CA 119.804 -0.758 . . . . 76.980000000000004 110.179 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 24.7 p -125.34 153.14 43.79 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-N 114.842 -1.072 . . . . 74.680000000000007 111.724 169.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 81.4 mt -125.7 120.47 30.77 Favored 'General case' 0 C--O 1.248 0.991 0 N-CA-C 106.527 -1.656 . . . . 62.579999999999998 106.527 172.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -124.58 145.18 49.74 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 106.821 -1.548 . . . . 92.480000000000004 106.821 -178.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 178.55 157.36 19.03 Favored Glycine 0 N--CA 1.461 0.342 0 N-CA-C 111.584 -0.607 . . . . 54.880000000000003 111.584 173.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . . . -101.57 131.82 47.56 Favored 'General case' 0 C--O 1.199 -1.576 0 C-N-CA 124.367 1.067 . . . . 56.039999999999999 108.524 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 43.4 pt -120.22 160.71 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 120.502 -1.374 . . . . 65.510000000000005 109.163 168.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -107.31 123.28 48.11 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 113.824 1.046 . . . . 93.849999999999994 113.824 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' ARG . . . . . 0.421 ' NH1' ' O ' ' A' ' 175' ' ' LEU . 18.0 mtp180 -41.37 -41.78 2.06 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.174 0.989 . . . . 75.870000000000005 110.158 171.118 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 14.9 p -70.23 -26.82 64.04 Favored 'General case' 0 N--CA 1.44 -0.953 0 N-CA-C 113.596 0.962 . . . . 56.240000000000002 113.596 -175.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -72.73 -24.43 60.97 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 108.932 -0.766 . . . . 75.739999999999995 108.932 -179.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -107.07 10.52 30.22 Favored 'General case' 0 CA--C 1.499 -0.995 0 C-N-CA 123.821 0.848 . . . . 60.270000000000003 112.099 -179.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp 47.5 36.37 5.12 Favored 'General case' 0 CA--C 1.563 1.466 0 O-C-N 124.737 1.273 . . . . 102.2 110.79 -178.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -97.43 128.55 44.31 Favored 'General case' 0 C--O 1.257 1.498 0 C-N-CA 124.874 1.27 . . . . 67.680000000000007 113.271 -170.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' ALA . . . . . . . . . . . . . . . 53.4 43.87 30.79 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 125.325 1.641 . . . . 70.650000000000006 113.337 -174.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 2.1 p -57.82 -32.82 67.96 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.225 1.194 . . . . 96.969999999999999 114.225 -172.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 59.0 p -57.66 -43.12 84.76 Favored 'General case' 0 C--O 1.252 1.187 0 C-N-CA 124.286 1.034 . . . . 80.700000000000003 111.18 176.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' THR . . . . . . . . . . . . . 4.7 m -72.43 122.67 21.62 Favored 'General case' 0 N--CA 1.484 1.225 0 N-CA-C 115.141 1.534 . . . . 73.379999999999995 115.141 176.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 9.1 t -62.6 150.42 40.7 Favored 'General case' 0 C--O 1.247 0.964 0 C-N-CA 124.029 0.932 . . . . 82.700000000000003 112.222 -176.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' THR . . . . . . . . . . . . . 16.6 p -69.45 -0.54 6.65 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.707 1.373 . . . . 72.219999999999999 114.707 169.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' ILE . . . . . . . . . . . . . 67.2 mt -86.47 -58.35 3.53 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 N-CA-C 107.629 -1.249 . . . . 70.689999999999998 107.629 176.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 82.6 m -54.04 -48.23 70.76 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.095 0.958 . . . . 87.859999999999999 112.565 177.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' LEU . . . . . 0.421 ' O ' ' NH1' ' A' ' 161' ' ' ARG . 15.8 tp -131.23 132.45 44.65 Favored 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 106.78 -1.563 . . . . 66.480000000000004 106.78 -173.454 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 29.1 t -62.86 144.65 56.44 Favored 'General case' 0 C--O 1.239 0.529 0 O-C-N 124.558 1.161 . . . . 71.780000000000001 109.765 -171.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -70.92 -20.13 62.51 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 118.806 -1.158 . . . . 68.430000000000007 111.651 171.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -94.92 122.9 38.04 Favored 'General case' 0 C--O 1.256 1.411 0 O-C-N 123.139 0.274 . . . . 80.859999999999999 111.634 -175.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 45.7 mt -105.49 132.04 53.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 O-C-N 125.51 1.756 . . . . 65.219999999999999 107.146 171.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 58.2 m-20 -102.32 117.24 34.32 Favored 'General case' 0 CA--C 1.493 -1.234 0 CA-C-O 121.119 0.485 . . . . 96.480000000000004 110.746 177.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 9.7 mt -86.95 124.63 33.36 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 107.605 -1.257 . . . . 64.890000000000001 107.605 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' CYS . . . . . 1.061 ' SG ' 'HG ' ' A' ' 304' ' ' MBO . 22.2 t -127.98 83.21 2.14 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 124.61 1.194 . . . . 135.59999999999999 111.077 176.059 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' ILE . . . . . . . . . . . . . 14.6 mm -95.17 117.19 38.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 C-N-CA 124.175 0.99 . . . . 75.180000000000007 111.126 -179.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -112.61 123.72 50.94 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.458 0.703 . . . . 131.18000000000001 110.989 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' VAL . . . . . . . . . . . . . 93.8 t -127.22 122.71 60.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 CA-C-O 118.511 -0.757 . . . . 82.019999999999996 110.722 -174.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . . . -99.02 139.68 34.29 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 104.878 -2.267 . . . . 78.859999999999999 104.878 155.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -157.55 144.49 18.21 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.75 0.648 . . . . 94.280000000000001 112.75 -175.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -119.83 153.16 36.19 Favored 'General case' 0 CA--C 1.499 -0.991 0 C-N-CA 124.167 0.987 . . . . 80.010000000000005 111.113 -170.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -61.13 164.46 5.16 Favored 'General case' 0 CA--C 1.557 1.25 0 O-C-N 123.796 0.685 . . . . 98.049999999999997 110.983 179.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' LYS . . . . . . . . . . . . . 9.4 tttt -101.73 -175.2 2.78 Favored 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 115.147 1.536 . . . . 145.21000000000001 115.147 -171.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.037 0 C-N-CA 126.667 1.987 . . . . 138.63999999999999 112.675 -178.604 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' LFA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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' ' ' MBO . . . . . 1.061 'HG ' ' SG ' ' A' ' 182' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' MBO . . . . . 1.061 'HG ' ' SG ' ' A' ' 182' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' HOH . . . . . 0.425 ' O ' ' NZ ' ' A' ' 95' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.723 0 N-CA-C 113.902 1.075 . . . . 132.30000000000001 113.902 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.6 mttp -174.29 147.61 1.2 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 105.4 -2.074 . . . . 104.48999999999999 105.4 -171.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -111.17 136.2 50.58 Favored 'General case' 0 CA--C 1.496 -1.125 0 N-CA-C 109.313 -0.625 . . . . 107.34 109.313 -168.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -121.82 167.13 13.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.451 -0.795 . . . . 70.299999999999997 111.155 -178.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 85.3 m -137.34 127.74 26.53 Favored 'General case' 0 CA--C 1.494 -1.198 0 N-CA-C 105.583 -2.006 . . . . 92.519999999999996 105.583 177.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . 0.418 HD12 ' H ' ' A' ' 26' ' ' LEU . 2.6 mp -51.53 145.49 8.78 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 115.554 -0.748 . . . . 92.900000000000006 110.505 -177.301 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -95.02 91.32 6.3 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 101.412 -3.551 . . . . 93.030000000000001 101.412 164.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.5 mttm -47.35 -29.95 2.89 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 113.069 0.766 . . . . 95.219999999999999 113.069 -179.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.65 -20.92 61.89 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 114.986 1.476 . . . . 84.609999999999999 114.986 -179.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 47.6 m80 -128.12 35.2 4.47 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-O 121.852 0.834 . . . . 122.36 112.503 177.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' THR . . . . . 0.403 HG21 HD23 ' A' ' 26' ' ' LEU . 27.6 m -130.74 137.62 49.58 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 106.037 -1.838 . . . . 84.959999999999994 106.037 178.95 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -130.21 116.89 19.06 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.884 -0.784 . . . . 91.340000000000003 108.884 178.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 30.1 t -98.53 88.05 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -1.0 0 N-CA-C 104.231 -2.507 . . . . 79.390000000000001 104.231 178.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -113.82 163.75 12.13 Favored Glycine 0 N--CA 1.476 1.303 0 N-CA-C 117.121 1.608 . . . . 71.219999999999999 117.121 -166.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -149.66 155.84 40.91 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.675 1.19 . . . . 73.569999999999993 110.533 -178.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.4 mttt -136.24 130.16 32.66 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 105.719 -1.956 . . . . 121.45 105.719 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 19.4 tt -138.66 137.32 43.22 Favored 'Isoleucine or valine' 0 C--O 1.249 1.072 0 O-C-N 123.48 0.487 . . . . 57.520000000000003 110.66 174.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -86.06 130.15 34.62 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.929 -0.767 . . . . 96.790000000000006 108.929 -173.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -131.28 163.74 27.13 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 117.73 2.493 . . . . 74.680000000000007 117.73 163.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 72.2 mt -94.63 149.79 20.88 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 114.552 -1.204 . . . . 82.049999999999997 111.724 175.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -138.89 131.68 29.21 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-O 121.825 0.821 . . . . 100.31999999999999 109.888 167.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tt -86.42 135.52 24.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 114.389 -1.278 . . . . 75.459999999999994 108.06 173.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.8 p -142.86 152.52 42.22 Favored 'General case' 0 C--O 1.243 0.731 0 N-CA-C 108.384 -0.969 . . . . 88.359999999999999 108.384 174.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -86.23 122.89 30.86 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 118.056 -0.973 . . . . 134.84999999999999 110.784 173.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 22.7 t -78.54 118.79 26.37 Favored 'Isoleucine or valine' 0 C--O 1.255 1.352 0 CA-C-N 119.54 1.064 . . . . 80.790000000000006 108.274 160.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . . . -104.02 145.41 30.2 Favored 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 107.688 -1.227 . . . . 82.780000000000001 107.688 172.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -165.51 163.94 36.94 Favored Glycine 0 CA--C 1.501 -0.789 0 N-CA-C 110.283 -1.127 . . . . 71.840000000000003 110.283 -178.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -138.29 -171.36 3.02 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.537 0.735 . . . . 79.219999999999999 109.787 169.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -124.4 127.79 48.07 Favored 'General case' 0 C--O 1.247 0.947 0 N-CA-C 108.068 -1.086 . . . . 75.120000000000005 108.068 171.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . . . -66.04 -29.81 70.24 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 124.423 1.077 . . . . 85.060000000000002 111.219 -179.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -129.19 113.85 15.57 Favored 'General case' 0 CA--C 1.556 1.207 0 N-CA-C 116.601 2.075 . . . . 124.93000000000001 116.601 -168.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -158.09 159.32 36.14 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.525 0.678 . . . . 72.560000000000002 109.977 -174.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.0 t -122.93 144.21 49.38 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.751 -0.659 . . . . 99.650000000000006 110.01 175.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -140.82 149.93 42.66 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 114.785 1.402 . . . . 78.0 114.785 167.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 98.2 t -107.41 117.81 53.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 127.082 2.153 . . . . 74.700000000000003 111.103 166.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 14.8 mt -122.76 111.67 30.94 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.018 0 N-CA-C 113.457 0.91 . . . . 73.069999999999993 113.457 -175.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -111.06 117.61 33.76 Favored 'General case' 0 C--O 1.248 1.012 0 C-N-CA 124.752 1.221 . . . . 76.950000000000003 111.697 173.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -142.73 134.13 26.28 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 124.434 1.083 . . . . 86.709999999999994 111.655 -172.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -103.37 100.67 19.14 Favored Pre-proline 0 C--O 1.246 0.877 0 C-N-CA 124.242 1.017 . . . . 75.510000000000005 112.555 -179.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_exo -69.05 -14.6 38.63 Favored 'Trans proline' 0 C--N 1.363 1.296 0 O-C-N 123.184 1.097 . . . . 69.519999999999996 114.509 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.12 -37.61 80.56 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.376 0.88 . . . . 74.5 113.376 169.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.9 p -119.17 -7.04 10.37 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.352 0.871 . . . . 78.329999999999998 113.352 -172.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 53.46 47.36 24.23 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.064 0.946 . . . . 76.980000000000004 112.811 -176.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 67.5 mt-10 -115.68 137.99 51.54 Favored 'General case' 0 CA--C 1.515 -0.404 0 C-N-CA 127.122 2.169 . . . . 96.879999999999995 111.684 174.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -84.23 142.78 30.04 Favored 'General case' 0 C--O 1.257 1.478 0 N-CA-C 108.399 -0.963 . . . . 62.289999999999999 108.399 168.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -109.07 -36.94 5.94 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 114.451 -1.25 . . . . 107.20999999999999 109.687 -173.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 19.4 tttp -158.86 133.59 8.13 Favored 'General case' 0 N--CA 1.436 -1.157 0 N-CA-C 105.737 -1.949 . . . . 108.09 105.737 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 11.4 tp -144.47 116.67 8.43 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 109.164 -0.68 . . . . 71.530000000000001 109.164 172.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 -136.74 116.45 13.02 Favored 'General case' 0 CA--C 1.505 -0.785 0 C-N-CA 124.617 1.167 . . . . 82.400000000000006 108.111 -171.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.1 t -120.42 143.78 31.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 107.667 -1.234 . . . . 65.230000000000004 107.667 -174.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' THR . . . . . 0.487 HG23 HG22 ' A' ' 103' ' ' THR . 3.6 m -131.24 129.98 42.3 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 107.52 -1.289 . . . . 80.189999999999998 107.52 171.935 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 7.5 mt -120.64 133.29 67.8 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.363 0 N-CA-C 107.113 -1.439 . . . . 70.409999999999997 107.113 -172.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 36.3 mttm -89.3 108.55 19.69 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 124.294 0.996 . . . . 98.319999999999993 109.114 176.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ILE . . . . . 0.493 HG21 ' HB3' ' A' ' 94' ' ' PHE . 4.2 mm -49.74 -44.03 19.71 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 CA-C-N 114.367 -1.288 . . . . 71.569999999999993 111.398 -178.672 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -45.89 -27.08 0.8 Allowed 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.144 1.165 . . . . 81.129999999999995 114.144 176.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 56.9 p -95.02 12.0 30.03 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 113.477 0.917 . . . . 74.939999999999998 113.477 -171.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 8.1 p -53.94 139.56 12.1 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 112.385 0.513 . . . . 70.849999999999994 112.385 175.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -140.2 109.87 6.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.701 0.762 . . . . 103.86 111.546 173.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' THR . . . . . 0.688 ' OG1' ' NH1' ' A' ' 84' ' ' ARG . 81.1 p -113.88 30.09 7.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.677 -1.147 . . . . 91.189999999999998 109.645 175.781 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 69.29 9.68 7.43 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.739 1.385 . . . . 150.15000000000001 114.739 175.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -144.35 100.97 3.63 Favored 'General case' 0 N--CA 1.438 -1.054 0 N-CA-C 107.566 -1.272 . . . . 105.38 107.566 -170.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 38.5 tp60 -43.7 -57.41 3.21 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 113.975 -1.466 . . . . 148.84 113.799 178.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . 0.51 HG22 ' O ' ' A' ' 417' ' ' HOH 0.254 40.1 p -62.03 -31.65 72.07 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 119.399 -0.92 . . . . 130.30000000000001 111.257 -175.852 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ARG . . . . . 0.688 ' NH1' ' OG1' ' A' ' 79' ' ' THR . 3.4 ttm105 -74.68 -42.28 58.71 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 112.682 0.623 . . . . 92.620000000000005 112.682 179.882 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -52.37 -43.59 64.78 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 113.522 0.934 . . . . 96.599999999999994 113.522 173.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -64.15 -42.85 96.6 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-O 120.965 0.412 . . . . 114.77 111.892 175.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -65.33 -26.46 68.05 Favored 'General case' 0 CA--C 1.554 1.107 0 N-CA-C 107.579 -1.267 . . . . 123.31 107.579 -174.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 28.0 mt -72.15 -31.74 66.25 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 113.56 0.948 . . . . 79.140000000000001 113.56 -177.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLN . . . . . 0.404 ' H ' ' HG2' ' A' ' 89' ' ' GLN . 14.2 mm-40 -64.7 -23.39 67.24 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 115.914 1.82 . . . . 88.989999999999995 115.914 170.513 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 65.6 mm-40 -66.88 168.78 9.17 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 114.188 1.181 . . . . 134.93000000000001 114.188 -173.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -53.5 -27.98 28.44 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 115.597 1.703 . . . . 140.08000000000001 115.597 179.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.9 p-10 -86.07 -5.22 59.25 Favored 'General case' 0 CA--C 1.566 1.573 0 O-C-N 123.578 0.549 . . . . 106.67 112.187 -173.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -126.31 -115.16 0.28 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.171 1.788 . . . . 84.900000000000006 114.024 171.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' PHE . . . . . 0.493 ' HB3' HG21 ' A' ' 74' ' ' ILE . 43.0 m-85 -73.7 -22.88 59.78 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 117.023 2.231 . . . . 83.640000000000001 117.023 -168.466 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 415' ' ' HOH . 45.9 tttt 49.89 50.62 18.11 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 126.539 1.936 . . . . 92.829999999999998 110.769 -174.302 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -52.49 -27.63 17.06 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 117.055 2.243 . . . . 72.400000000000006 117.055 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . . . -57.54 -58.65 7.39 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 106.928 -1.508 . . . . 74.129999999999995 106.928 175.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -69.88 -42.27 73.7 Favored 'General case' 0 N--CA 1.51 2.539 0 N-CA-C 115.489 1.663 . . . . 79.650000000000006 115.489 176.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -128.91 81.44 70.82 Favored Pre-proline 0 N--CA 1.477 0.889 0 N-CA-C 107.609 -1.256 . . . . 67.019999999999996 107.609 -172.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.28 -15.15 31.6 Favored 'Trans proline' 0 N--CA 1.496 1.649 0 C-N-CA 123.062 2.508 . . . . 77.620000000000005 116.608 -173.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . 0.28 4.9 p30 -138.14 147.72 44.19 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 116.859 2.17 . . . . 88.189999999999998 116.859 -179.103 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' MET . . . . . 1.122 ' HE3' HG12 ' A' ' 125' ' ' ILE . 14.6 ptm -106.76 145.78 31.65 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 119.092 -1.043 . . . . 66.939999999999998 108.803 168.4 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' THR . . . . . 0.487 HG22 HG23 ' A' ' 71' ' ' THR . 34.3 p -128.02 138.61 52.66 Favored 'General case' 0 C--O 1.248 0.976 0 CA-C-N 113.797 -1.547 . . . . 57.340000000000003 111.54 -172.846 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -119.41 134.65 55.11 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 114.213 -1.358 . . . . 62.450000000000003 110.957 170.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.7 m -129.87 113.22 14.37 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 123.718 0.807 . . . . 70.829999999999998 113.166 179.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 37.9 ttp -65.92 130.24 42.58 Favored 'General case' 0 C--O 1.199 -1.574 0 C-N-CA 120.193 -0.603 . . . . 63.609999999999999 111.191 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -106.68 -17.61 14.18 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 113.883 1.068 . . . . 91.790000000000006 113.883 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.4 tttp -168.23 131.61 1.55 Allowed 'General case' 0 C--O 1.25 1.117 0 N-CA-C 106.326 -1.731 . . . . 101.13 106.326 -165.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -119.04 127.14 53.15 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 107.6 -1.259 . . . . 73.200000000000003 107.6 164.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -115.86 105.04 12.23 Favored 'General case' 0 C--O 1.245 0.858 0 N-CA-C 106.361 -1.718 . . . . 65.290000000000006 106.361 -178.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -64.96 135.99 56.3 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 124.305 1.003 . . . . 81.260000000000005 111.442 -175.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.1 mt -98.28 -59.89 3.01 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.724 0 N-CA-C 107.044 -1.465 . . . . 59.329999999999998 107.044 169.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 23.1 p30 -145.54 -161.6 1.34 Allowed 'General case' 0 C--O 1.249 1.04 0 N-CA-C 105.887 -1.894 . . . . 83.650000000000006 105.887 165.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 38.9 m-20 -73.79 -13.72 60.99 Favored 'General case' 0 C--O 1.216 -0.695 0 N-CA-C 113.709 1.003 . . . . 86.400000000000006 113.709 -178.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -98.81 -12.38 20.91 Favored 'General case' 0 C--O 1.243 0.763 0 C-N-CA 118.092 -1.443 . . . . 110.59 113.094 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 50.4 mttt -147.13 133.27 19.35 Favored 'General case' 0 C--O 1.245 0.843 0 O-C-N 125.305 1.628 . . . . 100.86 112.676 -157.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -156.29 164.33 32.38 Favored Glycine 0 CA--C 1.499 -0.92 0 C-N-CA 119.488 -1.339 . . . . 58.479999999999997 112.12 171.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' A' ' 405' ' ' HOH . 8.7 tttt -101.81 115.7 31.11 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 106.916 -1.512 . . . . 72.510000000000005 106.916 177.107 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 41.5 ttm -100.46 128.67 46.45 Favored 'General case' 0 C--O 1.215 -0.735 0 C-N-CA 123.068 0.547 . . . . 62.990000000000002 111.001 175.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 45.6 m -114.26 130.53 56.64 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 122.719 0.408 . . . . 58.380000000000003 110.407 175.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -156.99 172.4 34.55 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 114.629 0.611 . . . . 56.700000000000003 114.629 -175.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 52.4 m -102.42 117.95 35.82 Favored 'General case' 0 CA--C 1.497 -1.085 0 N-CA-C 107.771 -1.196 . . . . 53.810000000000002 107.771 -176.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 24.2 tp -97.22 141.41 30.37 Favored 'General case' 0 C--O 1.251 1.183 0 N-CA-C 106.82 -1.548 . . . . 50.039999999999999 106.82 173.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 88.4 m -130.01 115.79 17.62 Favored 'General case' 0 CA--C 1.481 -1.704 0 N-CA-C 108.789 -0.819 . . . . 59.25 108.789 175.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ILE . . . . . 1.122 HG12 ' HE3' ' A' ' 102' ' ' MET . 25.6 mt -117.97 127.36 75.22 Favored 'Isoleucine or valine' 0 C--O 1.251 1.138 0 N-CA-C 105.556 -2.016 . . . . 69.780000000000001 105.556 176.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . 43.28 49.14 5.85 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 124.702 1.251 . . . . 63.420000000000002 113.91 179.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 73.94 3.41 64.15 Favored Glycine 0 C--N 1.332 0.316 0 N-CA-C 115.233 0.853 . . . . 61.07 115.233 176.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . 0.313 1.5 p -112.73 133.69 57.74 Favored 'Isoleucine or valine' 0 C--O 1.26 1.621 0 C-N-CA 117.081 -1.848 . . . . 68.769999999999996 110.838 172.57 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 15.9 m -118.36 132.03 56.28 Favored 'General case' 0 CA--C 1.476 -1.903 0 CA-C-N 113.3 -1.773 . . . . 60.140000000000001 111.762 -167.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' LYS . . . . . 0.488 ' HD2' ' O3 ' ' A' ' 302' ' ' SO4 . 2.5 tptt -142.84 153.02 42.78 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 107.45 -1.315 . . . . 89.049999999999997 107.45 174.288 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ASP . . . . . 0.415 ' N ' ' HG3' ' A' ' 130' ' ' LYS . 84.4 m-20 -88.2 126.0 34.92 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.075 -0.966 . . . . 76.390000000000001 111.321 176.591 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 9.7 pt -121.29 160.62 22.28 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 CA-C-N 115.608 -0.724 . . . . 55.469999999999999 112.305 -175.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 8.6 m -114.93 129.2 71.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 O-C-N 121.973 -0.455 . . . . 64.239999999999995 109.821 175.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 48.8 mt -111.17 144.3 40.54 Favored 'General case' 0 C--O 1.25 1.116 0 CA-C-O 121.367 0.603 . . . . 57.82 109.506 174.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -91.28 109.55 20.82 Favored 'General case' 0 C--O 1.259 1.558 0 CA-C-N 114.926 -1.034 . . . . 76.859999999999999 109.273 174.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -81.02 125.7 30.5 Favored 'General case' 0 CA--C 1.484 -1.572 0 CA-C-N 112.24 -2.254 . . . . 59.149999999999999 106.061 177.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -128.39 103.66 7.27 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 113.285 -1.78 . . . . 132.34999999999999 108.896 172.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 2.4 mp -72.31 99.34 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.853 0 CA-C-N 116.123 -0.49 . . . . 85.459999999999994 111.766 175.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -80.68 15.85 17.65 Favored Glycine 0 CA--C 1.54 1.599 0 N-CA-C 117.019 1.568 . . . . 107.77 117.019 174.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 143.54 132.89 2.66 Favored Glycine 0 N--CA 1.484 1.886 0 N-CA-C 120.444 2.937 . . . . 97.329999999999998 120.444 174.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 60.6 t -128.7 129.09 68.43 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.307 0 N-CA-C 105.545 -2.02 . . . . 111.41 105.545 -175.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -145.84 162.59 37.35 Favored 'General case' 0 C--O 1.252 1.204 0 N-CA-C 114.175 1.176 . . . . 100.64 114.175 -169.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 4.7 mttt -99.76 130.88 46.01 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.155 -0.929 . . . . 124.66 108.94 159.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -76.2 173.52 53.92 Favored Glycine 0 C--O 1.252 1.246 0 N-CA-C 115.253 0.861 . . . . 177.05000000000001 115.253 -169.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -32.11 -62.4 0.22 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 124.258 1.023 . . . . 172.78999999999999 110.251 165.977 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -73.14 6.92 2.42 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 118.035 2.605 . . . . 147.37 118.035 -179.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 72.88 -1.28 40.14 Favored Glycine 0 CA--C 1.546 1.985 0 N-CA-C 119.15 2.42 . . . . 115.73 119.15 -171.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 30.3 mttt -94.04 145.32 24.75 Favored 'General case' 0 C--O 1.249 1.061 0 O-C-N 121.918 -0.754 . . . . 121.95 111.934 168.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' GLU . . . . . 0.44 ' HB2' ' HB2' ' A' ' 189' ' ' GLU . 13.2 mm-40 -61.68 150.42 36.62 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 118.157 2.651 . . . . 106.03 118.157 -170.999 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 2.8 pttt -131.62 170.33 14.91 Favored 'General case' 0 C--O 1.262 1.761 0 CA-C-N 113.965 -1.47 . . . . 114.45999999999999 111.279 161.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 14.3 pt -155.04 153.56 7.84 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.311 0 C-N-CA 125.273 1.429 . . . . 75.730000000000004 107.935 170.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -138.7 117.42 1.41 Allowed Glycine 0 C--N 1.331 0.291 0 N-CA-C 107.944 -2.062 . . . . 103.29000000000001 107.944 175.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -137.69 166.9 22.83 Favored 'General case' 0 CA--C 1.489 -1.39 0 C-N-CA 119.804 -0.758 . . . . 76.980000000000004 110.179 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 24.7 p -125.34 153.14 43.79 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-N 114.842 -1.072 . . . . 74.680000000000007 111.724 169.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 81.4 mt -125.7 120.47 30.77 Favored 'General case' 0 C--O 1.248 0.991 0 N-CA-C 106.527 -1.656 . . . . 62.579999999999998 106.527 172.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -124.58 145.18 49.74 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 106.821 -1.548 . . . . 92.480000000000004 106.821 -178.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 178.55 157.36 19.03 Favored Glycine 0 N--CA 1.461 0.342 0 N-CA-C 111.584 -0.607 . . . . 54.880000000000003 111.584 173.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . . . -101.57 131.82 47.56 Favored 'General case' 0 C--O 1.199 -1.576 0 C-N-CA 124.367 1.067 . . . . 56.039999999999999 108.524 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 43.4 pt -120.22 160.71 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 120.502 -1.374 . . . . 65.510000000000005 109.163 168.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -107.31 123.28 48.11 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 113.824 1.046 . . . . 93.849999999999994 113.824 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' ARG . . . . . 0.421 ' NH1' ' O ' ' A' ' 175' ' ' LEU . 18.0 mtp180 -41.37 -41.78 2.06 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.174 0.989 . . . . 75.870000000000005 110.158 171.118 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 14.9 p -70.23 -26.82 64.04 Favored 'General case' 0 N--CA 1.44 -0.953 0 N-CA-C 113.596 0.962 . . . . 56.240000000000002 113.596 -175.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -72.73 -24.43 60.97 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 108.932 -0.766 . . . . 75.739999999999995 108.932 -179.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -107.07 10.52 30.22 Favored 'General case' 0 CA--C 1.499 -0.995 0 C-N-CA 123.821 0.848 . . . . 60.270000000000003 112.099 -179.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp 47.5 36.37 5.12 Favored 'General case' 0 CA--C 1.563 1.466 0 O-C-N 124.737 1.273 . . . . 102.2 110.79 -178.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -97.43 128.55 44.31 Favored 'General case' 0 C--O 1.257 1.498 0 C-N-CA 124.874 1.27 . . . . 67.680000000000007 113.271 -170.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' ALA . . . . . . . . . . . . . . . 53.4 43.87 30.79 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 125.325 1.641 . . . . 70.650000000000006 113.337 -174.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 2.1 p -57.82 -32.82 67.96 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.225 1.194 . . . . 96.969999999999999 114.225 -172.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 59.0 p -57.66 -43.12 84.76 Favored 'General case' 0 C--O 1.252 1.187 0 C-N-CA 124.286 1.034 . . . . 80.700000000000003 111.18 176.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' THR . . . . . . . . . . . . . 4.7 m -72.43 122.67 21.62 Favored 'General case' 0 N--CA 1.484 1.225 0 N-CA-C 115.141 1.534 . . . . 73.379999999999995 115.141 176.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 9.1 t -62.6 150.42 40.7 Favored 'General case' 0 C--O 1.247 0.964 0 C-N-CA 124.029 0.932 . . . . 82.700000000000003 112.222 -176.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' THR . . . . . . . . . . . . . 16.6 p -69.45 -0.54 6.65 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.707 1.373 . . . . 72.219999999999999 114.707 169.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' ILE . . . . . . . . . . . . . 67.2 mt -86.47 -58.35 3.53 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 N-CA-C 107.629 -1.249 . . . . 70.689999999999998 107.629 176.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 82.6 m -54.04 -48.23 70.76 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.095 0.958 . . . . 87.859999999999999 112.565 177.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' LEU . . . . . 0.421 ' O ' ' NH1' ' A' ' 161' ' ' ARG . 15.8 tp -131.23 132.45 44.65 Favored 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 106.78 -1.563 . . . . 66.480000000000004 106.78 -173.454 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 29.1 t -62.86 144.65 56.44 Favored 'General case' 0 C--O 1.239 0.529 0 O-C-N 124.558 1.161 . . . . 71.780000000000001 109.765 -171.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -70.92 -20.13 62.51 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 118.806 -1.158 . . . . 68.430000000000007 111.651 171.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -94.92 122.9 38.04 Favored 'General case' 0 C--O 1.256 1.411 0 O-C-N 123.139 0.274 . . . . 80.859999999999999 111.634 -175.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 45.7 mt -105.49 132.04 53.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 O-C-N 125.51 1.756 . . . . 65.219999999999999 107.146 171.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 58.2 m-20 -102.32 117.24 34.32 Favored 'General case' 0 CA--C 1.493 -1.234 0 CA-C-O 121.119 0.485 . . . . 96.480000000000004 110.746 177.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 9.7 mt -86.95 124.63 33.36 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 107.605 -1.257 . . . . 64.890000000000001 107.605 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' CYS . . . . . 1.061 ' SG ' 'HG ' ' A' ' 304' ' ' MBO . 22.2 t -127.98 83.21 2.14 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 124.61 1.194 . . . . 135.59999999999999 111.077 176.059 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 183' ' ' ILE . . . . . . . . . . . . . 14.6 mm -95.17 117.19 38.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 C-N-CA 124.175 0.99 . . . . 75.180000000000007 111.126 -179.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -112.61 123.72 50.94 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.458 0.703 . . . . 131.18000000000001 110.989 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' VAL . . . . . . . . . . . . . 93.8 t -127.22 122.71 60.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 CA-C-O 118.511 -0.757 . . . . 82.019999999999996 110.722 -174.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . . . -99.02 139.68 34.29 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 104.878 -2.267 . . . . 78.859999999999999 104.878 155.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -157.55 144.49 18.21 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.75 0.648 . . . . 94.280000000000001 112.75 -175.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 188' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -119.83 153.16 36.19 Favored 'General case' 0 CA--C 1.499 -0.991 0 C-N-CA 124.167 0.987 . . . . 80.010000000000005 111.113 -170.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 189' ' ' GLU . . . . . 0.44 ' HB2' ' HB2' ' A' ' 149' ' ' GLU . 55.2 tt0 -61.13 164.46 5.16 Favored 'General case' 0 CA--C 1.557 1.25 0 O-C-N 123.796 0.685 . . . . 98.049999999999997 110.983 179.46 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 190' ' ' LYS . . . . . . . . . . . . . 9.4 tttt -101.73 -175.2 2.78 Favored 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 115.147 1.536 . . . . 145.21000000000001 115.147 -171.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.037 0 C-N-CA 126.667 1.987 . . . . 138.63999999999999 112.675 -178.604 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' LFA . . . . . 0.645 H142 ' HD3' ' A' ' 84' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 302' ' ' SO4 . . . . . 0.488 ' O3 ' ' HD2' ' A' ' 130' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 303' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' MBO . . . . . 1.061 'HG ' ' SG ' ' A' ' 182' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 305' ' ' MBO . . . . . 1.061 'HG ' ' SG ' ' A' ' 182' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 401' ' ' HOH . . . . . 0.425 ' O ' ' NZ ' ' A' ' 95' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 . . . . . 0.459 ' O ' ' HG3' ' A' ' 118' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.526 ' O ' ' HB2' ' A' ' 95' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 417' ' ' HOH . . . . . 0.51 ' O ' HG22 ' A' ' 83' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.723 0 N-CA-C 113.902 1.075 . . . . 132.3 113.902 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.6 mttp -174.29 147.61 1.2 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 105.4 -2.074 . . . . 104.49 105.4 -171.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -111.17 136.2 50.58 Favored 'General case' 0 CA--C 1.496 -1.125 0 N-CA-C 109.313 -0.625 . . . . 107.34 109.313 -168.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -121.82 167.13 13.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.451 -0.795 . . . . 70.3 111.155 -178.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 85.3 m -137.34 127.74 26.53 Favored 'General case' 0 CA--C 1.494 -1.198 0 N-CA-C 105.583 -2.006 . . . . 92.52 105.583 177.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.418 HD12 ' H ' ' A' ' 26' ' ' LEU . 2.6 mp -51.53 145.49 8.78 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 115.554 -0.748 . . . . 92.9 110.505 -177.301 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -95.02 91.32 6.3 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 101.412 -3.551 . . . . 93.03 101.412 164.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.5 mttm -47.35 -29.95 2.89 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 113.069 0.766 . . . . 95.22 113.069 -179.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.65 -20.92 61.89 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 114.986 1.476 . . . . 84.61 114.986 -179.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 47.6 m80 -128.12 35.2 4.47 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-O 121.852 0.834 . . . . 122.36 112.503 177.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' THR . . . . . 0.403 HG21 HD23 ' A' ' 26' ' ' LEU . 27.6 m -130.74 137.62 49.58 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 106.037 -1.838 . . . . 84.96 106.037 178.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -130.21 116.89 19.06 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.884 -0.784 . . . . 91.34 108.884 178.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 30.1 t -98.53 88.05 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -1.0 0 N-CA-C 104.231 -2.507 . . . . 79.39 104.231 178.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -113.82 163.75 12.13 Favored Glycine 0 N--CA 1.476 1.303 0 N-CA-C 117.121 1.608 . . . . 71.22 117.121 -166.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -149.66 155.84 40.91 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.675 1.19 . . . . 73.57 110.533 -178.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.4 mttt -136.24 130.16 32.66 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 105.719 -1.956 . . . . 121.45 105.719 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 19.4 tt -138.66 137.32 43.22 Favored 'Isoleucine or valine' 0 C--O 1.249 1.072 0 O-C-N 123.48 0.487 . . . . 57.52 110.66 174.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -86.06 130.15 34.62 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.929 -0.767 . . . . 96.79 108.929 -173.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -131.28 163.74 27.13 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 117.73 2.493 . . . . 74.68 117.73 163.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 72.2 mt -94.63 149.79 20.88 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 114.552 -1.204 . . . . 82.05 111.724 175.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -138.89 131.68 29.21 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-O 121.825 0.821 . . . . 100.32 109.888 167.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 tt -86.42 135.52 24.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 114.389 -1.278 . . . . 75.46 108.06 173.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.8 p -142.86 152.52 42.22 Favored 'General case' 0 C--O 1.243 0.731 0 N-CA-C 108.384 -0.969 . . . . 88.36 108.384 174.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -86.23 122.89 30.86 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 118.056 -0.973 . . . . 134.85 110.784 173.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 22.7 t -78.54 118.79 26.37 Favored 'Isoleucine or valine' 0 C--O 1.255 1.352 0 CA-C-N 119.54 1.064 . . . . 80.79 108.274 160.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . . . -104.02 145.41 30.2 Favored 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 107.688 -1.227 . . . . 82.78 107.688 172.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -165.51 163.94 36.94 Favored Glycine 0 CA--C 1.501 -0.789 0 N-CA-C 110.283 -1.127 . . . . 71.84 110.283 -178.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -138.29 -171.36 3.02 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.537 0.735 . . . . 79.22 109.787 169.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -124.4 127.79 48.07 Favored 'General case' 0 C--O 1.247 0.947 0 N-CA-C 108.068 -1.086 . . . . 75.12 108.068 171.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . . . -66.04 -29.81 70.24 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 124.423 1.077 . . . . 85.06 111.219 -179.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -129.19 113.85 15.57 Favored 'General case' 0 CA--C 1.556 1.207 0 N-CA-C 116.601 2.075 . . . . 124.93 116.601 -168.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -158.09 159.32 36.14 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.525 0.678 . . . . 72.56 109.977 -174.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.0 t -122.93 144.21 49.38 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.751 -0.659 . . . . 99.65 110.01 175.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -140.82 149.93 42.66 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 114.785 1.402 . . . . 78.0 114.785 167.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 98.2 t -107.41 117.81 53.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 127.082 2.153 . . . . 74.7 111.103 166.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 14.8 mt -122.76 111.67 30.94 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.018 0 N-CA-C 113.457 0.91 . . . . 73.07 113.457 -175.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -111.06 117.61 33.76 Favored 'General case' 0 C--O 1.248 1.012 0 C-N-CA 124.752 1.221 . . . . 76.95 111.697 173.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -142.73 134.13 26.28 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 124.434 1.083 . . . . 86.71 111.655 -172.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -103.37 100.67 19.14 Favored Pre-proline 0 C--O 1.246 0.877 0 C-N-CA 124.242 1.017 . . . . 75.51 112.555 -179.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_exo -69.05 -14.6 38.63 Favored 'Trans proline' 0 C--N 1.363 1.296 0 O-C-N 123.184 1.097 . . . . 69.52 114.509 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.12 -37.61 80.56 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.376 0.88 . . . . 74.5 113.376 169.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.9 p -119.17 -7.04 10.37 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.352 0.871 . . . . 78.33 113.352 -172.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 53.46 47.36 24.23 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.064 0.946 . . . . 76.98 112.811 -176.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 67.5 mt-10 -115.68 137.99 51.54 Favored 'General case' 0 CA--C 1.515 -0.404 0 C-N-CA 127.122 2.169 . . . . 96.88 111.684 174.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -84.23 142.78 30.04 Favored 'General case' 0 C--O 1.257 1.478 0 N-CA-C 108.399 -0.963 . . . . 62.29 108.399 168.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -109.07 -36.94 5.94 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 114.451 -1.25 . . . . 107.21 109.687 -173.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 19.4 tttp -158.86 133.59 8.13 Favored 'General case' 0 N--CA 1.436 -1.157 0 N-CA-C 105.737 -1.949 . . . . 108.09 105.737 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 11.4 tp -144.47 116.67 8.43 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 109.164 -0.68 . . . . 71.53 109.164 172.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 -136.74 116.45 13.02 Favored 'General case' 0 CA--C 1.505 -0.785 0 C-N-CA 124.617 1.167 . . . . 82.4 108.111 -171.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.1 t -120.42 143.78 31.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 107.667 -1.234 . . . . 65.23 107.667 -174.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' THR . . . . . 0.487 HG23 HG22 ' A' ' 103' ' ' THR . 3.6 m -131.24 129.98 42.3 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 107.52 -1.289 . . . . 80.19 107.52 171.935 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 7.5 mt -120.64 133.29 67.8 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.363 0 N-CA-C 107.113 -1.439 . . . . 70.41 107.113 -172.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 36.3 mttm -89.3 108.55 19.69 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 124.294 0.996 . . . . 98.32 109.114 176.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.493 HG21 ' HB3' ' A' ' 94' ' ' PHE . 4.2 mm -49.74 -44.03 19.71 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 CA-C-N 114.367 -1.288 . . . . 71.57 111.398 -178.672 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -45.89 -27.08 0.8 Allowed 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.144 1.165 . . . . 81.13 114.144 176.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 56.9 p -95.02 12.0 30.03 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 113.477 0.917 . . . . 74.94 113.477 -171.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 8.1 p -53.94 139.56 12.1 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 112.385 0.513 . . . . 70.85 112.385 175.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -140.2 109.87 6.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.701 0.762 . . . . 103.86 111.546 173.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' THR . . . . . 0.688 ' OG1' ' NH1' ' A' ' 84' ' ' ARG . 81.1 p -113.88 30.09 7.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.677 -1.147 . . . . 91.19 109.645 175.781 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 69.29 9.68 7.43 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.739 1.385 . . . . 150.15 114.739 175.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -144.35 100.97 3.63 Favored 'General case' 0 N--CA 1.438 -1.054 0 N-CA-C 107.566 -1.272 . . . . 105.38 107.566 -170.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 38.5 tp60 -43.7 -57.41 3.21 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 113.975 -1.466 . . . . 148.84 113.799 178.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . 0.51 HG22 ' O ' ' A' ' 417' ' ' HOH 0.254 40.1 p -62.03 -31.65 72.07 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 119.399 -0.92 . . . . 130.3 111.257 -175.852 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.688 ' NH1' ' OG1' ' A' ' 79' ' ' THR . 3.4 ttm105 -74.68 -42.28 58.71 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 112.682 0.623 . . . . 92.62 112.682 179.882 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -52.37 -43.59 64.78 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 113.522 0.934 . . . . 96.6 113.522 173.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -64.15 -42.85 96.6 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-O 120.965 0.412 . . . . 114.77 111.892 175.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -65.33 -26.46 68.05 Favored 'General case' 0 CA--C 1.554 1.107 0 N-CA-C 107.579 -1.267 . . . . 123.31 107.579 -174.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 28.0 mt -72.15 -31.74 66.25 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 113.56 0.948 . . . . 79.14 113.56 -177.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.404 ' H ' ' HG2' ' A' ' 89' ' ' GLN . 14.2 mm-40 -64.7 -23.39 67.24 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 115.914 1.82 . . . . 88.99 115.914 170.513 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 65.6 mm-40 -66.88 168.78 9.17 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 114.188 1.181 . . . . 134.93 114.188 -173.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -53.5 -27.98 28.44 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 115.597 1.703 . . . . 140.08 115.597 179.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.9 p-10 -86.07 -5.22 59.25 Favored 'General case' 0 CA--C 1.566 1.573 0 O-C-N 123.578 0.549 . . . . 106.67 112.187 -173.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -126.31 -115.16 0.28 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.171 1.788 . . . . 84.9 114.024 171.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.493 ' HB3' HG21 ' A' ' 74' ' ' ILE . 43.0 m-85 -73.7 -22.88 59.78 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 117.023 2.231 . . . . 83.64 117.023 -168.466 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 415' ' ' HOH . 45.9 tttt 49.89 50.62 18.11 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 126.539 1.936 . . . . 92.83 110.769 -174.302 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -52.49 -27.63 17.06 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 117.055 2.243 . . . . 72.4 117.055 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . . . -57.54 -58.65 7.39 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 106.928 -1.508 . . . . 74.13 106.928 175.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -69.88 -42.27 73.7 Favored 'General case' 0 N--CA 1.51 2.539 0 N-CA-C 115.489 1.663 . . . . 79.65 115.489 176.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -128.91 81.44 70.82 Favored Pre-proline 0 N--CA 1.477 0.889 0 N-CA-C 107.609 -1.256 . . . . 67.02 107.609 -172.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.28 -15.15 31.6 Favored 'Trans proline' 0 N--CA 1.496 1.649 0 C-N-CA 123.062 2.508 . . . . 77.62 116.608 -173.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . 0.28 4.9 p30 -138.14 147.72 44.19 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 116.859 2.17 . . . . 88.19 116.859 -179.103 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' MET . . . . . 1.122 ' HE3' HG12 ' A' ' 125' ' ' ILE . 14.6 ptm -106.76 145.78 31.65 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 119.092 -1.043 . . . . 66.94 108.803 168.4 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' THR . . . . . 0.487 HG22 HG23 ' A' ' 71' ' ' THR . 34.3 p -128.02 138.61 52.66 Favored 'General case' 0 C--O 1.248 0.976 0 CA-C-N 113.797 -1.547 . . . . 57.34 111.54 -172.846 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -119.41 134.65 55.11 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 114.213 -1.358 . . . . 62.45 110.957 170.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.7 m -129.87 113.22 14.37 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 123.718 0.807 . . . . 70.83 113.166 179.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 37.9 ttp -65.92 130.24 42.58 Favored 'General case' 0 C--O 1.199 -1.574 0 C-N-CA 120.193 -0.603 . . . . 63.61 111.191 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -106.68 -17.61 14.18 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 113.883 1.068 . . . . 91.79 113.883 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.4 tttp -168.23 131.61 1.55 Allowed 'General case' 0 C--O 1.25 1.117 0 N-CA-C 106.326 -1.731 . . . . 101.13 106.326 -165.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -119.04 127.14 53.15 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 107.6 -1.259 . . . . 73.2 107.6 164.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -115.86 105.04 12.23 Favored 'General case' 0 C--O 1.245 0.858 0 N-CA-C 106.361 -1.718 . . . . 65.29 106.361 -178.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -64.96 135.99 56.3 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 124.305 1.003 . . . . 81.26 111.442 -175.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.1 mt -98.28 -59.89 3.01 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.724 0 N-CA-C 107.044 -1.465 . . . . 59.33 107.044 169.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 23.1 p30 -145.54 -161.6 1.34 Allowed 'General case' 0 C--O 1.249 1.04 0 N-CA-C 105.887 -1.894 . . . . 83.65 105.887 165.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 38.9 m-20 -73.79 -13.72 60.99 Favored 'General case' 0 C--O 1.216 -0.695 0 N-CA-C 113.709 1.003 . . . . 86.4 113.709 -178.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -98.81 -12.38 20.91 Favored 'General case' 0 C--O 1.243 0.763 0 C-N-CA 118.092 -1.443 . . . . 110.59 113.094 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 50.4 mttt -147.13 133.27 19.35 Favored 'General case' 0 C--O 1.245 0.843 0 O-C-N 125.305 1.628 . . . . 100.86 112.676 -157.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -156.29 164.33 32.38 Favored Glycine 0 CA--C 1.499 -0.92 0 C-N-CA 119.488 -1.339 . . . . 58.48 112.12 171.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' A' ' 405' ' ' HOH . 8.7 tttt -101.81 115.7 31.11 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 106.916 -1.512 . . . . 72.51 106.916 177.107 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 41.5 ttm -100.46 128.67 46.45 Favored 'General case' 0 C--O 1.215 -0.735 0 C-N-CA 123.068 0.547 . . . . 62.99 111.001 175.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 45.6 m -114.26 130.53 56.64 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 122.719 0.408 . . . . 58.38 110.407 175.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -156.99 172.4 34.55 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 114.629 0.611 . . . . 56.7 114.629 -175.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 52.4 m -102.42 117.95 35.82 Favored 'General case' 0 CA--C 1.497 -1.085 0 N-CA-C 107.771 -1.196 . . . . 53.81 107.771 -176.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 24.2 tp -97.22 141.41 30.37 Favored 'General case' 0 C--O 1.251 1.183 0 N-CA-C 106.82 -1.548 . . . . 50.04 106.82 173.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 88.4 m -130.01 115.79 17.62 Favored 'General case' 0 CA--C 1.481 -1.704 0 N-CA-C 108.789 -0.819 . . . . 59.25 108.789 175.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ILE . . . . . 1.122 HG12 ' HE3' ' A' ' 102' ' ' MET . 25.6 mt -117.97 127.36 75.22 Favored 'Isoleucine or valine' 0 C--O 1.251 1.138 0 N-CA-C 105.556 -2.016 . . . . 69.78 105.556 176.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . 43.28 49.14 5.85 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 124.702 1.251 . . . . 63.42 113.91 179.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 73.94 3.41 64.15 Favored Glycine 0 C--N 1.332 0.316 0 N-CA-C 115.233 0.853 . . . . 61.07 115.233 176.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . 0.313 1.5 p -112.73 133.69 57.74 Favored 'Isoleucine or valine' 0 C--O 1.26 1.621 0 C-N-CA 117.081 -1.848 . . . . 68.77 110.838 172.57 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 15.9 m -118.36 132.03 56.28 Favored 'General case' 0 CA--C 1.476 -1.903 0 CA-C-N 113.3 -1.773 . . . . 60.14 111.762 -167.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.488 ' HD2' ' O3 ' ' A' ' 302' ' ' SO4 . 2.5 tptt -142.84 153.02 42.78 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 107.45 -1.315 . . . . 89.05 107.45 174.288 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.415 ' N ' ' HG3' ' A' ' 130' ' ' LYS . 84.4 m-20 -88.2 126.0 34.92 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.075 -0.966 . . . . 76.39 111.321 176.591 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 9.7 pt -121.29 160.62 22.28 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 CA-C-N 115.608 -0.724 . . . . 55.47 112.305 -175.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 8.6 m -114.93 129.2 71.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 O-C-N 121.973 -0.455 . . . . 64.24 109.821 175.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 48.8 mt -111.17 144.3 40.54 Favored 'General case' 0 C--O 1.25 1.116 0 CA-C-O 121.367 0.603 . . . . 57.82 109.506 174.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -91.28 109.55 20.82 Favored 'General case' 0 C--O 1.259 1.558 0 CA-C-N 114.926 -1.034 . . . . 76.86 109.273 174.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -81.02 125.7 30.5 Favored 'General case' 0 CA--C 1.484 -1.572 0 CA-C-N 112.24 -2.254 . . . . 59.15 106.061 177.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -128.39 103.66 7.27 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 113.285 -1.78 . . . . 132.35 108.896 172.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 2.4 mp -72.31 99.34 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.853 0 CA-C-N 116.123 -0.49 . . . . 85.46 111.766 175.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -80.68 15.85 17.65 Favored Glycine 0 CA--C 1.54 1.599 0 N-CA-C 117.019 1.568 . . . . 107.77 117.019 174.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 143.54 132.89 2.66 Favored Glycine 0 N--CA 1.484 1.886 0 N-CA-C 120.444 2.937 . . . . 97.33 120.444 174.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 60.6 t -128.7 129.09 68.43 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.307 0 N-CA-C 105.545 -2.02 . . . . 111.41 105.545 -175.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -145.84 162.59 37.35 Favored 'General case' 0 C--O 1.252 1.204 0 N-CA-C 114.175 1.176 . . . . 100.64 114.175 -169.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 4.7 mttt -99.76 130.88 46.01 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.155 -0.929 . . . . 124.66 108.94 159.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -76.2 173.52 53.92 Favored Glycine 0 C--O 1.252 1.246 0 N-CA-C 115.253 0.861 . . . . 177.05 115.253 -169.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -32.11 -62.4 0.22 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 124.258 1.023 . . . . 172.79 110.251 165.977 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -73.14 6.92 2.42 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 118.035 2.605 . . . . 147.37 118.035 -179.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 72.88 -1.28 40.14 Favored Glycine 0 CA--C 1.546 1.985 0 N-CA-C 119.15 2.42 . . . . 115.73 119.15 -171.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 30.3 mttt -94.04 145.32 24.75 Favored 'General case' 0 C--O 1.249 1.061 0 O-C-N 121.918 -0.754 . . . . 121.95 111.934 168.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.44 ' HB2' ' HB2' ' A' ' 189' ' ' GLU . 13.2 mm-40 -61.68 150.42 36.62 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 118.157 2.651 . . . . 106.03 118.157 -170.999 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 2.8 pttt -131.62 170.33 14.91 Favored 'General case' 0 C--O 1.262 1.761 0 CA-C-N 113.965 -1.47 . . . . 114.46 111.279 161.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 14.3 pt -155.04 153.56 7.84 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.311 0 C-N-CA 125.273 1.429 . . . . 75.73 107.935 170.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -138.7 117.42 1.41 Allowed Glycine 0 C--N 1.331 0.291 0 N-CA-C 107.944 -2.062 . . . . 103.29 107.944 175.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -137.69 166.9 22.83 Favored 'General case' 0 CA--C 1.489 -1.39 0 C-N-CA 119.804 -0.758 . . . . 76.98 110.179 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 24.7 p -125.34 153.14 43.79 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-N 114.842 -1.072 . . . . 74.68 111.724 169.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 81.4 mt -125.7 120.47 30.77 Favored 'General case' 0 C--O 1.248 0.991 0 N-CA-C 106.527 -1.656 . . . . 62.58 106.527 172.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -124.58 145.18 49.74 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 106.821 -1.548 . . . . 92.48 106.821 -178.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 178.55 157.36 19.03 Favored Glycine 0 N--CA 1.461 0.342 0 N-CA-C 111.584 -0.607 . . . . 54.88 111.584 173.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . . . -101.57 131.82 47.56 Favored 'General case' 0 C--O 1.199 -1.576 0 C-N-CA 124.367 1.067 . . . . 56.04 108.524 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 43.4 pt -120.22 160.71 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 120.502 -1.374 . . . . 65.51 109.163 168.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -107.31 123.28 48.11 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 113.824 1.046 . . . . 93.85 113.824 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.421 ' NH1' ' O ' ' A' ' 175' ' ' LEU . 18.0 mtp180 -41.37 -41.78 2.06 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.174 0.989 . . . . 75.87 110.158 171.118 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 14.9 p -70.23 -26.82 64.04 Favored 'General case' 0 N--CA 1.44 -0.953 0 N-CA-C 113.596 0.962 . . . . 56.24 113.596 -175.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -72.73 -24.43 60.97 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 108.932 -0.766 . . . . 75.74 108.932 -179.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -107.07 10.52 30.22 Favored 'General case' 0 CA--C 1.499 -0.995 0 C-N-CA 123.821 0.848 . . . . 60.27 112.099 -179.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp 47.5 36.37 5.12 Favored 'General case' 0 CA--C 1.563 1.466 0 O-C-N 124.737 1.273 . . . . 102.2 110.79 -178.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -97.43 128.55 44.31 Favored 'General case' 0 C--O 1.257 1.498 0 C-N-CA 124.874 1.27 . . . . 67.68 113.271 -170.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' ALA . . . . . . . . . . . . . . . 53.4 43.87 30.79 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 125.325 1.641 . . . . 70.65 113.337 -174.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 2.1 p -57.82 -32.82 67.96 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.225 1.194 . . . . 96.97 114.225 -172.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 59.0 p -57.66 -43.12 84.76 Favored 'General case' 0 C--O 1.252 1.187 0 C-N-CA 124.286 1.034 . . . . 80.7 111.18 176.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' THR . . . . . . . . . . . . . 4.7 m -72.43 122.67 21.62 Favored 'General case' 0 N--CA 1.484 1.225 0 N-CA-C 115.141 1.534 . . . . 73.38 115.141 176.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 9.1 t -62.6 150.42 40.7 Favored 'General case' 0 C--O 1.247 0.964 0 C-N-CA 124.029 0.932 . . . . 82.7 112.222 -176.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' THR . . . . . . . . . . . . . 16.6 p -69.45 -0.54 6.65 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.707 1.373 . . . . 72.22 114.707 169.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' ILE . . . . . . . . . . . . . 67.2 mt -86.47 -58.35 3.53 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 N-CA-C 107.629 -1.249 . . . . 70.69 107.629 176.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 82.6 m -54.04 -48.23 70.76 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.095 0.958 . . . . 87.86 112.565 177.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.421 ' O ' ' NH1' ' A' ' 161' ' ' ARG . 15.8 tp -131.23 132.45 44.65 Favored 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 106.78 -1.563 . . . . 66.48 106.78 -173.454 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 29.1 t -62.86 144.65 56.44 Favored 'General case' 0 C--O 1.239 0.529 0 O-C-N 124.558 1.161 . . . . 71.78 109.765 -171.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -70.92 -20.13 62.51 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 118.806 -1.158 . . . . 68.43 111.651 171.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -94.92 122.9 38.04 Favored 'General case' 0 C--O 1.256 1.411 0 O-C-N 123.139 0.274 . . . . 80.86 111.634 -175.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 45.7 mt -105.49 132.04 53.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 O-C-N 125.51 1.756 . . . . 65.22 107.146 171.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 58.2 m-20 -102.32 117.24 34.32 Favored 'General case' 0 CA--C 1.493 -1.234 0 CA-C-O 121.119 0.485 . . . . 96.48 110.746 177.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 9.7 mt -86.95 124.63 33.36 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 107.605 -1.257 . . . . 64.89 107.605 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' CYS . . . . . 1.061 ' SG ' 'HG ' ' A' ' 304' ' ' MBO . 22.2 t -127.98 83.21 2.14 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 124.61 1.194 . . . . 135.6 111.077 176.059 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' ILE . . . . . . . . . . . . . 14.6 mm -95.17 117.19 38.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 C-N-CA 124.175 0.99 . . . . 75.18 111.126 -179.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -112.61 123.72 50.94 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.458 0.703 . . . . 131.18 110.989 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' VAL . . . . . . . . . . . . . 93.8 t -127.22 122.71 60.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 CA-C-O 118.511 -0.757 . . . . 82.02 110.722 -174.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . . . -99.02 139.68 34.29 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 104.878 -2.267 . . . . 78.86 104.878 155.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -157.55 144.49 18.21 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.75 0.648 . . . . 94.28 112.75 -175.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -119.83 153.16 36.19 Favored 'General case' 0 CA--C 1.499 -0.991 0 C-N-CA 124.167 0.987 . . . . 80.01 111.113 -170.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.44 ' HB2' ' HB2' ' A' ' 149' ' ' GLU . 55.2 tt0 -61.13 164.46 5.16 Favored 'General case' 0 CA--C 1.557 1.25 0 O-C-N 123.796 0.685 . . . . 98.05 110.983 179.46 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' LYS . . . . . . . . . . . . . 9.4 tttt -101.73 -175.2 2.78 Favored 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 115.147 1.536 . . . . 145.21 115.147 -171.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.037 0 C-N-CA 126.667 1.987 . . . . 138.64 112.675 -178.604 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' LFA . . . . . 0.645 H142 ' HD3' ' A' ' 84' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' SO4 . . . . . 0.488 ' O3 ' ' HD2' ' A' ' 130' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' MBO . . . . . 1.061 'HG ' ' SG ' ' A' ' 182' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' MBO . . . . . 1.061 'HG ' ' SG ' ' A' ' 182' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' HOH . . . . . 0.425 ' O ' ' NZ ' ' A' ' 95' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 . . . . . 0.459 ' O ' ' HG3' ' A' ' 118' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.526 ' O ' ' HB2' ' A' ' 95' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 417' ' ' HOH . . . . . 0.51 ' O ' HG22 ' A' ' 83' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 stop_ save_