data_4rof_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 4rof _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 437' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.891 0 CA-C-O 121.057 0.456 . . . . 66.989999999999995 110.97 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 83.08 151.46 10.57 Favored Glycine 0 C--O 1.213 -1.195 0 CA-C-N 115.673 -0.694 . . . . 61.920000000000002 114.119 173.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -69.28 165.81 29.13 Favored 'Trans proline' 0 N--CA 1.438 -1.78 0 N-CA-C 109.282 -1.084 . . . . 58.950000000000003 109.282 -179.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 440' ' ' LEU . . . . . . . . . . . . . 14.8 mt -70.51 150.64 95.62 Favored Pre-proline 0 N--CA 1.434 -1.257 0 N-CA-C 107.217 -1.401 . . . . 44.829999999999998 107.217 173.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 441' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -61.94 152.25 76.2 Favored 'Trans proline' 0 C--O 1.246 0.889 0 C-N-CA 117.446 -1.236 . . . . 38.509999999999998 112.49 170.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 442' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -55.28 140.84 81.86 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 O-C-N 122.378 0.673 . . . . 43.259999999999998 111.575 -177.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 100.45 -21.85 42.43 Favored Glycine 0 C--O 1.241 0.56 0 C-N-CA 120.221 -0.99 . . . . 34.060000000000002 113.315 -178.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -97.91 150.34 21.43 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 120.766 0.317 . . . . 37.219999999999999 110.715 -170.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 445' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -148.19 140.68 24.41 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 107.766 -1.198 . . . . 39.950000000000003 107.766 -179.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 446' ' ' LYS . . . . . . . . . . . . . 11.7 ttpt -91.33 134.69 34.38 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.658 -0.867 . . . . 48.390000000000001 108.658 176.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -137.89 175.71 9.35 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-O 121.681 0.753 . . . . 44.869999999999997 112.031 172.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 448' ' ' THR . . . . . . . . . . . . . 31.8 m -126.77 126.36 43.28 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 113.649 -1.614 . . . . 41.229999999999997 109.228 176.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 449' ' ' ASP . . . . . . . . . . . . . 23.5 p30 -71.03 -177.87 1.79 Allowed 'General case' 0 C--O 1.244 0.792 0 CA-C-O 121.942 0.877 . . . . 41.049999999999997 112.76 176.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 96.3 p -72.27 -16.64 61.92 Favored 'General case' 0 C--O 1.194 -1.835 0 CA-C-N 115.351 -0.84 . . . . 50.719999999999999 112.157 -172.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 451' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -94.05 -0.13 55.61 Favored 'General case' 0 C--O 1.212 -0.904 0 N-CA-C 115.28 1.585 . . . . 59.719999999999999 115.28 173.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . 94.1 2.88 64.0 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 117.609 1.804 . . . . 41.840000000000003 117.609 -175.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 453' ' ' ARG . . . . . . . . . . . . . 28.8 mtm180 -84.11 127.1 33.69 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-N 118.334 1.067 . . . . 81.680000000000007 111.537 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 99.4 t -72.98 137.55 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.191 0 CA-C-N 114.944 -1.026 . . . . 34.740000000000002 109.601 -179.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -143.3 177.41 8.44 Favored 'General case' 0 C--O 1.255 1.378 0 CA-C-O 121.804 0.811 . . . . 30.550000000000001 111.185 170.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 456' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -130.79 139.75 50.24 Favored 'General case' 0 N--CA 1.423 -1.798 0 CA-C-N 115.096 -0.956 . . . . 33.710000000000001 110.342 -176.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 457' ' ' VAL . . . . . . . . . . . . . 48.4 t -120.91 134.79 63.17 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.724 0 N-CA-C 107.475 -1.306 . . . . 40.090000000000003 107.475 -173.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 458' ' ' ASN . . . . . . . . . . . . . 55.2 t-20 -110.46 111.84 23.36 Favored 'General case' 0 C--O 1.267 1.979 0 N-CA-C 108.036 -1.098 . . . . 39.450000000000003 108.036 174.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 459' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -75.13 -15.26 60.6 Favored 'General case' 0 C--O 1.223 -0.308 0 O-C-N 125.114 1.509 . . . . 35.579999999999998 112.663 -170.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 460' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -76.08 -46.81 27.18 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-O 119.36 -0.353 . . . . 43.100000000000001 111.841 174.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 461' ' ' THR . . . . . . . . . . . . . 42.3 p -99.33 -9.33 23.68 Favored 'General case' 0 C--O 1.245 0.86 0 O-C-N 123.699 0.624 . . . . 39.229999999999997 111.401 -173.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 59.3 mtt-85 61.61 31.18 18.79 Favored 'General case' 0 CA--C 1.495 -1.154 0 O-C-N 124.001 0.813 . . . . 75.469999999999999 111.488 -179.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 463' ' ' ILE . . . . . . . . . . . . . 2.7 pt -103.58 144.63 13.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 108.965 -0.754 . . . . 56.829999999999998 108.965 175.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 41.5 p -116.36 145.16 43.42 Favored 'General case' 0 C--O 1.251 1.146 0 N-CA-C 106.973 -1.492 . . . . 37.600000000000001 106.973 172.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -154.37 155.37 34.92 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.574 0.702 . . . . 36.82 109.957 -178.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 466' ' ' TRP . . . . . . . . . . . . . 25.2 m95 -73.86 -27.15 60.94 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.728 -0.669 . . . . 38.200000000000003 109.896 -177.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 53.7 mp0 -84.73 136.21 33.81 Favored 'General case' 0 CA--C 1.496 -1.124 0 CA-C-O 121.709 0.766 . . . . 46.780000000000001 111.092 -166.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -68.82 122.91 86.69 Favored Pre-proline 0 C--N 1.317 -0.843 0 N-CA-C 105.702 -1.962 . . . . 39.799999999999997 105.702 177.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -59.84 -28.15 86.55 Favored 'Trans proline' 0 C--N 1.357 1.005 0 C-N-CA 120.621 0.881 . . . . 48.0 111.782 177.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -67.99 -21.87 65.04 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.699 0.629 . . . . 53.490000000000002 112.699 179.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 69.8 m -76.27 -3.87 38.94 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 112.136 0.421 . . . . 72.379999999999995 112.136 170.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 . . . . . 0 N--CA 1.464 0.274 0 C-N-CA 122.848 0.459 . . . . 70.599999999999994 110.879 -175.863 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 437' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.025 0 N-CA-C 112.142 0.423 . . . . 52.460000000000001 112.142 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 438' ' ' GLY . . . . . . . . . . . . . . . 87.59 170.42 46.32 Favored Glycine 0 N--CA 1.439 -1.129 0 N-CA-C 114.351 0.5 . . . . 48.090000000000003 114.351 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 439' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -74.95 158.59 42.32 Favored 'Trans proline' 0 N--CA 1.444 -1.391 0 O-C-N 123.019 1.01 . . . . 50.509999999999998 111.463 176.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 440' ' ' LEU . . . . . . . . . . . . . 40.7 mt -61.11 156.71 47.39 Favored Pre-proline 0 N--CA 1.45 -0.442 0 N-CA-C 108.884 -0.784 . . . . 37.490000000000002 108.884 173.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 441' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -67.34 156.02 67.98 Favored 'Trans proline' 0 C--O 1.259 1.573 0 N-CA-C 113.712 0.62 . . . . 35.649999999999999 113.712 176.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 442' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -43.14 130.01 6.04 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 O-C-N 122.646 0.814 . . . . 40.439999999999998 111.919 174.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 443' ' ' GLY . . . . . . . . . . . . . . . 98.11 -12.93 63.71 Favored Glycine 0 N--CA 1.467 0.739 0 N-CA-C 116.441 1.336 . . . . 33.109999999999999 116.441 175.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 444' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -101.59 151.35 22.09 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 113.641 0.978 . . . . 34.57 113.641 -170.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 445' ' ' GLU . . . . . . . . . . . . . 61.8 tt0 -138.64 144.37 39.66 Favored 'General case' 0 C--O 1.195 -1.777 0 N-CA-C 108.486 -0.931 . . . . 31.170000000000002 108.486 176.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 446' ' ' LYS . . . . . . . . . . . . . 15.7 ttpt -97.94 134.74 40.65 Favored 'General case' 0 CA--C 1.487 -1.446 0 N-CA-C 106.086 -1.82 . . . . 49.75 106.086 178.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 447' ' ' ARG . . . . . . . . . . . . . 4.8 mmt85 -134.56 167.38 20.91 Favored 'General case' 0 C--O 1.216 -0.705 0 O-C-N 123.99 0.806 . . . . 51.18 111.208 172.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 448' ' ' THR . . . . . . . . . . . . . 93.8 m -118.31 139.67 50.99 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 124.428 1.091 . . . . 44.170000000000002 108.961 168.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 449' ' ' ASP . . . . . . . . . . . . . 30.6 p30 -82.28 174.97 10.66 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.181 0.808 . . . . 43.869999999999997 113.181 172.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 450' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.3 -34.02 73.19 Favored 'General case' 0 C--N 1.32 -0.707 0 O-C-N 121.945 -0.472 . . . . 52.530000000000001 110.996 -176.686 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 451' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -70.27 -13.57 62.23 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 115.842 1.793 . . . . 65.409999999999997 115.842 173.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 452' ' ' GLY . . . . . . . . . . . . . . . 101.84 0.53 52.17 Favored Glycine 0 CA--C 1.523 0.561 0 CA-C-O 119.676 -0.513 . . . . 48.009999999999998 113.865 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 453' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -84.06 129.25 34.92 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 118.092 0.946 . . . . 44.5 110.942 -175.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 454' ' ' VAL . . . . . . . . . . . . . 61.0 t -75.82 132.45 33.13 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-N 116.142 -0.481 . . . . 31.100000000000001 111.195 -177.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 455' ' ' TYR . . . . . . . . . . . . . 33.2 p90 -139.05 175.67 9.35 Favored 'General case' 0 C--O 1.251 1.145 0 C-N-CA 119.894 -0.722 . . . . 28.460000000000001 110.225 172.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 456' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -128.4 136.14 50.49 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 114.988 -1.005 . . . . 31.23 109.848 -172.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 457' ' ' VAL . . . . . . . . . . . . . 24.0 t -111.94 129.02 68.14 Favored 'Isoleucine or valine' 0 C--O 1.246 0.901 0 N-CA-C 109.289 -0.634 . . . . 31.219999999999999 109.289 -177.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 458' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -103.04 108.49 19.69 Favored 'General case' 0 C--O 1.245 0.849 0 N-CA-C 108.443 -0.947 . . . . 35.740000000000002 108.443 173.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -80.06 -15.56 56.91 Favored 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.51 -0.768 . . . . 37.719999999999999 112.921 -172.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 460' ' ' ASN . . . . . 0.433 ' ND2' ' O ' ' B' ' 505' ' ' HOH . 80.4 m-20 -72.55 -50.38 26.03 Favored 'General case' 0 C--O 1.204 -1.291 0 N-CA-C 113.022 0.749 . . . . 41.740000000000002 113.022 171.42 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 33.3 p -92.72 -9.08 41.97 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 112.732 0.641 . . . . 40.329999999999998 112.732 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 462' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 60.95 51.32 4.63 Favored 'General case' 0 C--O 1.195 -1.776 0 N-CA-C 112.999 0.74 . . . . 59.710000000000001 112.999 -177.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 43.0 pt -127.64 169.41 19.11 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.715 0 CA-C-O 121.145 0.498 . . . . 52.130000000000003 111.355 173.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 464' ' ' THR . . . . . . . . . . . . . 43.9 p -131.04 151.82 51.0 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-N 114.637 -1.165 . . . . 39.490000000000002 108.371 176.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 465' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -158.99 162.76 36.82 Favored 'General case' 0 CA--C 1.554 1.104 0 CA-C-N 116.049 -0.523 . . . . 31.07 109.737 178.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 466' ' ' TRP . . . . . . . . . . . . . 37.1 m95 -79.99 -24.21 41.03 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 120.951 0.405 . . . . 33.990000000000002 111.984 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 467' ' ' GLU . . . . . . . . . . . . . 39.3 mp0 -77.94 129.98 35.99 Favored 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 113.822 1.045 . . . . 42.369999999999997 113.822 -172.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 468' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -69.38 122.44 85.55 Favored Pre-proline 0 CA--C 1.543 0.705 0 N-CA-C 107.87 -1.159 . . . . 31.719999999999999 107.87 173.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 469' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -57.95 -30.29 89.35 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.134 1.889 . . . . 33.969999999999999 112.422 178.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 470' ' ' ARG . . . . . . . . . . . . . 60.0 mtm180 -66.47 -18.48 65.39 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.515 1.302 . . . . 40.560000000000002 114.515 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 471' ' ' SER . . . . . . . . . . . . . 73.3 m -73.47 -12.19 60.71 Favored 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 113.664 0.987 . . . . 45.140000000000001 113.664 171.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 . . . . . 0 N--CA 1.455 -0.192 0 C-N-CA 124.788 1.235 . . . . 65.390000000000001 108.606 166.053 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 329' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.443 0 CA-C-O 121.256 0.551 . . . . 52.189999999999998 110.046 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 330' ' ' ALA . . . . . . . . . . . . . . . -119.15 159.04 46.7 Favored Pre-proline 0 C--O 1.244 0.779 0 N-CA-C 108.158 -1.052 . . . . 46.329999999999998 108.158 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 331' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -67.75 170.64 13.58 Favored 'Trans proline' 0 C--O 1.22 -0.406 0 C-N-CA 121.621 1.547 . . . . 36.719999999999999 111.032 174.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 332' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -64.15 154.61 69.75 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 117.82 -0.986 . . . . 40.469999999999999 112.5 -175.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 333' ' ' CYS . . . . . . . . . . . . . 57.7 m -62.17 135.48 57.52 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 107.45 -1.315 . . . . 42.859999999999999 107.45 170.3 -54.468 -69.798 -71.154 105.701 2.049 104.884 -77.643 71.498 1 1 . 1 . 001 ecloud orig full ' C' C ' 334' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -39.78 -48.39 2.22 Favored 'General case' 0 N--CA 1.418 -2.034 0 CA-C-N 115.386 -0.824 . . . . 40.329999999999998 112.841 172.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 335' ' ' MET . . . . . . . . . . . . . 61.1 mmm -69.94 -15.18 63.01 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 119.755 -0.778 . . . . 69.439999999999998 112.569 -174.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 336' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -81.59 -40.45 23.02 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.48 0.712 . . . . 73.950000000000003 111.507 163.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 337' ' ' VAL . . . . . . . . . . . . . 22.4 t -52.24 -68.78 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 123.468 0.707 . . . . 62.189999999999998 110.263 175.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 338' ' ' ILE . . . . . . . . . . . . . 2.6 pp -68.28 -5.34 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 N-CA-C 112.863 0.69 . . . . 64.170000000000002 112.863 -179.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 339' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.111 0 CA-C-N 119.097 0.862 . . . . 63.060000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 329' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.893 0 CA-C-O 121.405 0.622 . . . . 54.0 110.71 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 330' ' ' ALA . . . . . . . . . . . . . . . -116.77 151.1 46.85 Favored Pre-proline 0 N--CA 1.436 -1.159 0 N-CA-C 108.441 -0.948 . . . . 44.189999999999998 108.441 176.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 331' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -72.86 160.95 44.94 Favored 'Trans proline' 0 N--CA 1.444 -1.384 0 O-C-N 122.974 0.986 . . . . 37.350000000000001 111.522 172.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 332' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -52.8 141.54 54.53 Favored 'Trans proline' 0 N--CA 1.45 -1.082 0 O-C-N 123.736 1.387 . . . . 43.909999999999997 112.546 -178.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 333' ' ' CYS . . . . . . . . . . . . . 17.9 p -72.23 158.41 35.92 Favored 'General case' 0 C--O 1.247 0.971 0 C-N-CA 119.08 -1.048 . . . . 42.719999999999999 109.563 178.587 71.498 -77.643 -71.154 104.884 2.049 105.701 -69.798 -54.468 1 1 . 1 . 001 ecloud orig full ' D' D ' 334' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -54.22 -36.52 63.6 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 115.086 -0.961 . . . . 44.880000000000003 112.203 -173.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 335' ' ' MET . . . . . . . . . . . . . 46.9 mmm -70.38 -21.62 62.84 Favored 'General case' 0 C--O 1.221 -0.442 0 N-CA-C 112.456 0.539 . . . . 72.560000000000002 112.456 -176.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 336' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -86.33 -30.49 22.19 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.933 -0.479 . . . . 59.880000000000003 110.857 174.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 337' ' ' VAL . . . . . . . . . . . . . 31.3 t -56.59 -67.33 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.408 0 N-CA-C 107.88 -1.156 . . . . 51.049999999999997 107.88 175.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 338' ' ' ILE . . . . . . . . . . . . . 8.0 pt -72.58 -17.7 18.57 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.902 0 CA-C-N 115.899 -0.592 . . . . 53.579999999999998 111.507 -176.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 339' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.455 0 O-C-N 120.248 -1.533 . . . . 48.079999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 505' ' ' HOH . . . . . 0.433 ' O ' ' ND2' ' B' ' 460' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 437' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.891 0 CA-C-O 121.057 0.456 . . . . 66.989999999999995 110.97 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 83.08 151.46 10.57 Favored Glycine 0 C--O 1.213 -1.195 0 CA-C-N 115.673 -0.694 . . . . 61.920000000000002 114.119 173.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -69.28 165.81 29.13 Favored 'Trans proline' 0 N--CA 1.438 -1.78 0 N-CA-C 109.282 -1.084 . . . . 58.950000000000003 109.282 -179.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 440' ' ' LEU . . . . . . . . . . . . . 14.8 mt -70.51 150.64 95.62 Favored Pre-proline 0 N--CA 1.434 -1.257 0 N-CA-C 107.217 -1.401 . . . . 44.829999999999998 107.217 173.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 441' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -61.94 152.25 76.2 Favored 'Trans proline' 0 C--O 1.246 0.889 0 C-N-CA 117.446 -1.236 . . . . 38.509999999999998 112.49 170.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 442' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -55.28 140.84 81.86 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 O-C-N 122.378 0.673 . . . . 43.259999999999998 111.575 -177.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 100.45 -21.85 42.43 Favored Glycine 0 C--O 1.241 0.56 0 C-N-CA 120.221 -0.99 . . . . 34.060000000000002 113.315 -178.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -97.91 150.34 21.43 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 120.766 0.317 . . . . 37.219999999999999 110.715 -170.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 445' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -148.19 140.68 24.41 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 107.766 -1.198 . . . . 39.950000000000003 107.766 -179.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 446' ' ' LYS . . . . . . . . . . . . . 11.7 ttpt -91.33 134.69 34.38 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.658 -0.867 . . . . 48.390000000000001 108.658 176.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -137.89 175.71 9.35 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-O 121.681 0.753 . . . . 44.869999999999997 112.031 172.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 448' ' ' THR . . . . . . . . . . . . . 31.8 m -126.77 126.36 43.28 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 113.649 -1.614 . . . . 41.229999999999997 109.228 176.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 449' ' ' ASP . . . . . . . . . . . . . 23.5 p30 -71.03 -177.87 1.79 Allowed 'General case' 0 C--O 1.244 0.792 0 CA-C-O 121.942 0.877 . . . . 41.049999999999997 112.76 176.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 96.3 p -72.27 -16.64 61.92 Favored 'General case' 0 C--O 1.194 -1.835 0 CA-C-N 115.351 -0.84 . . . . 50.719999999999999 112.157 -172.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 451' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -94.05 -0.13 55.61 Favored 'General case' 0 C--O 1.212 -0.904 0 N-CA-C 115.28 1.585 . . . . 59.719999999999999 115.28 173.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . 94.1 2.88 64.0 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 117.609 1.804 . . . . 41.840000000000003 117.609 -175.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 453' ' ' ARG . . . . . . . . . . . . . 28.8 mtm180 -84.11 127.1 33.69 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-N 118.334 1.067 . . . . 81.680000000000007 111.537 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 99.4 t -72.98 137.55 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.191 0 CA-C-N 114.944 -1.026 . . . . 34.740000000000002 109.601 -179.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -143.3 177.41 8.44 Favored 'General case' 0 C--O 1.255 1.378 0 CA-C-O 121.804 0.811 . . . . 30.550000000000001 111.185 170.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 456' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -130.79 139.75 50.24 Favored 'General case' 0 N--CA 1.423 -1.798 0 CA-C-N 115.096 -0.956 . . . . 33.710000000000001 110.342 -176.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 457' ' ' VAL . . . . . 0.558 HG22 HG22 ' A' ' 464' ' ' THR . 48.4 t -120.91 134.79 63.17 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.724 0 N-CA-C 107.475 -1.306 . . . . 40.090000000000003 107.475 -173.613 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 458' ' ' ASN . . . . . . . . . . . . . 55.2 t-20 -110.46 111.84 23.36 Favored 'General case' 0 C--O 1.267 1.979 0 N-CA-C 108.036 -1.098 . . . . 39.450000000000003 108.036 174.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 459' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -75.13 -15.26 60.6 Favored 'General case' 0 C--O 1.223 -0.308 0 O-C-N 125.114 1.509 . . . . 35.579999999999998 112.663 -170.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 460' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -76.08 -46.81 27.18 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-O 119.36 -0.353 . . . . 43.100000000000001 111.841 174.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 461' ' ' THR . . . . . . . . . . . . . 42.3 p -99.33 -9.33 23.68 Favored 'General case' 0 C--O 1.245 0.86 0 O-C-N 123.699 0.624 . . . . 39.229999999999997 111.401 -173.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 59.3 mtt-85 61.61 31.18 18.79 Favored 'General case' 0 CA--C 1.495 -1.154 0 O-C-N 124.001 0.813 . . . . 75.469999999999999 111.488 -179.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 463' ' ' ILE . . . . . . . . . . . . . 2.7 pt -103.58 144.63 13.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 108.965 -0.754 . . . . 56.829999999999998 108.965 175.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 464' ' ' THR . . . . . 0.558 HG22 HG22 ' A' ' 457' ' ' VAL . 41.5 p -116.36 145.16 43.42 Favored 'General case' 0 C--O 1.251 1.146 0 N-CA-C 106.973 -1.492 . . . . 37.600000000000001 106.973 172.31 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -154.37 155.37 34.92 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.574 0.702 . . . . 36.82 109.957 -178.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 466' ' ' TRP . . . . . . . . . . . . . 25.2 m95 -73.86 -27.15 60.94 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.728 -0.669 . . . . 38.200000000000003 109.896 -177.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 53.7 mp0 -84.73 136.21 33.81 Favored 'General case' 0 CA--C 1.496 -1.124 0 CA-C-O 121.709 0.766 . . . . 46.780000000000001 111.092 -166.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -68.82 122.91 86.69 Favored Pre-proline 0 C--N 1.317 -0.843 0 N-CA-C 105.702 -1.962 . . . . 39.799999999999997 105.702 177.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -59.84 -28.15 86.55 Favored 'Trans proline' 0 C--N 1.357 1.005 0 C-N-CA 120.621 0.881 . . . . 48.0 111.782 177.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -67.99 -21.87 65.04 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.699 0.629 . . . . 53.490000000000002 112.699 179.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 69.8 m -76.27 -3.87 38.94 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 112.136 0.421 . . . . 72.379999999999995 112.136 170.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 . . . . . 0 N--CA 1.464 0.274 0 C-N-CA 122.848 0.459 . . . . 70.599999999999994 110.879 -175.863 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 437' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.025 0 N-CA-C 112.142 0.423 . . . . 52.460000000000001 112.142 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 438' ' ' GLY . . . . . . . . . . . . . . . 87.59 170.42 46.32 Favored Glycine 0 N--CA 1.439 -1.129 0 N-CA-C 114.351 0.5 . . . . 48.090000000000003 114.351 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 439' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -74.95 158.59 42.32 Favored 'Trans proline' 0 N--CA 1.444 -1.391 0 O-C-N 123.019 1.01 . . . . 50.509999999999998 111.463 176.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 440' ' ' LEU . . . . . . . . . . . . . 40.7 mt -61.11 156.71 47.39 Favored Pre-proline 0 N--CA 1.45 -0.442 0 N-CA-C 108.884 -0.784 . . . . 37.490000000000002 108.884 173.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 441' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -67.34 156.02 67.98 Favored 'Trans proline' 0 C--O 1.259 1.573 0 N-CA-C 113.712 0.62 . . . . 35.649999999999999 113.712 176.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 442' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -43.14 130.01 6.04 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 O-C-N 122.646 0.814 . . . . 40.439999999999998 111.919 174.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 443' ' ' GLY . . . . . . . . . . . . . . . 98.11 -12.93 63.71 Favored Glycine 0 N--CA 1.467 0.739 0 N-CA-C 116.441 1.336 . . . . 33.109999999999999 116.441 175.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 444' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -101.59 151.35 22.09 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 113.641 0.978 . . . . 34.57 113.641 -170.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 445' ' ' GLU . . . . . . . . . . . . . 61.8 tt0 -138.64 144.37 39.66 Favored 'General case' 0 C--O 1.195 -1.777 0 N-CA-C 108.486 -0.931 . . . . 31.170000000000002 108.486 176.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 446' ' ' LYS . . . . . . . . . . . . . 15.7 ttpt -97.94 134.74 40.65 Favored 'General case' 0 CA--C 1.487 -1.446 0 N-CA-C 106.086 -1.82 . . . . 49.75 106.086 178.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 447' ' ' ARG . . . . . . . . . . . . . 4.8 mmt85 -134.56 167.38 20.91 Favored 'General case' 0 C--O 1.216 -0.705 0 O-C-N 123.99 0.806 . . . . 51.18 111.208 172.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 448' ' ' THR . . . . . . . . . . . . . 93.8 m -118.31 139.67 50.99 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 124.428 1.091 . . . . 44.170000000000002 108.961 168.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 449' ' ' ASP . . . . . . . . . . . . . 30.6 p30 -82.28 174.97 10.66 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.181 0.808 . . . . 43.869999999999997 113.181 172.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 450' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.3 -34.02 73.19 Favored 'General case' 0 C--N 1.32 -0.707 0 O-C-N 121.945 -0.472 . . . . 52.530000000000001 110.996 -176.686 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 451' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -70.27 -13.57 62.23 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 115.842 1.793 . . . . 65.409999999999997 115.842 173.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 452' ' ' GLY . . . . . . . . . . . . . . . 101.84 0.53 52.17 Favored Glycine 0 CA--C 1.523 0.561 0 CA-C-O 119.676 -0.513 . . . . 48.009999999999998 113.865 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 453' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -84.06 129.25 34.92 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 118.092 0.946 . . . . 44.5 110.942 -175.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 454' ' ' VAL . . . . . . . . . . . . . 61.0 t -75.82 132.45 33.13 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-N 116.142 -0.481 . . . . 31.100000000000001 111.195 -177.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 455' ' ' TYR . . . . . . . . . . . . . 33.2 p90 -139.05 175.67 9.35 Favored 'General case' 0 C--O 1.251 1.145 0 C-N-CA 119.894 -0.722 . . . . 28.460000000000001 110.225 172.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 456' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -128.4 136.14 50.49 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 114.988 -1.005 . . . . 31.23 109.848 -172.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 457' ' ' VAL . . . . . . . . . . . . . 24.0 t -111.94 129.02 68.14 Favored 'Isoleucine or valine' 0 C--O 1.246 0.901 0 N-CA-C 109.289 -0.634 . . . . 31.219999999999999 109.289 -177.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 458' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -103.04 108.49 19.69 Favored 'General case' 0 C--O 1.245 0.849 0 N-CA-C 108.443 -0.947 . . . . 35.740000000000002 108.443 173.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -80.06 -15.56 56.91 Favored 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.51 -0.768 . . . . 37.719999999999999 112.921 -172.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 460' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -72.55 -50.38 26.03 Favored 'General case' 0 C--O 1.204 -1.291 0 N-CA-C 113.022 0.749 . . . . 41.740000000000002 113.022 171.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 33.3 p -92.72 -9.08 41.97 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 112.732 0.641 . . . . 40.329999999999998 112.732 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 462' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 60.95 51.32 4.63 Favored 'General case' 0 C--O 1.195 -1.776 0 N-CA-C 112.999 0.74 . . . . 59.710000000000001 112.999 -177.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 43.0 pt -127.64 169.41 19.11 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.715 0 CA-C-O 121.145 0.498 . . . . 52.130000000000003 111.355 173.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 464' ' ' THR . . . . . . . . . . . . . 43.9 p -131.04 151.82 51.0 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-N 114.637 -1.165 . . . . 39.490000000000002 108.371 176.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 465' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -158.99 162.76 36.82 Favored 'General case' 0 CA--C 1.554 1.104 0 CA-C-N 116.049 -0.523 . . . . 31.07 109.737 178.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 466' ' ' TRP . . . . . . . . . . . . . 37.1 m95 -79.99 -24.21 41.03 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 120.951 0.405 . . . . 33.990000000000002 111.984 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 467' ' ' GLU . . . . . . . . . . . . . 39.3 mp0 -77.94 129.98 35.99 Favored 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 113.822 1.045 . . . . 42.369999999999997 113.822 -172.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 468' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -69.38 122.44 85.55 Favored Pre-proline 0 CA--C 1.543 0.705 0 N-CA-C 107.87 -1.159 . . . . 31.719999999999999 107.87 173.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 469' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -57.95 -30.29 89.35 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.134 1.889 . . . . 33.969999999999999 112.422 178.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 470' ' ' ARG . . . . . . . . . . . . . 60.0 mtm180 -66.47 -18.48 65.39 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.515 1.302 . . . . 40.560000000000002 114.515 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 471' ' ' SER . . . . . . . . . . . . . 73.3 m -73.47 -12.19 60.71 Favored 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 113.664 0.987 . . . . 45.140000000000001 113.664 171.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 . . . . . 0 N--CA 1.455 -0.192 0 C-N-CA 124.788 1.235 . . . . 65.390000000000001 108.606 166.053 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 329' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.443 0 CA-C-O 121.256 0.551 . . . . 52.189999999999998 110.046 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 330' ' ' ALA . . . . . . . . . . . . . . . -119.15 159.04 46.7 Favored Pre-proline 0 C--O 1.244 0.779 0 N-CA-C 108.158 -1.052 . . . . 46.329999999999998 108.158 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 331' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -67.75 170.64 13.58 Favored 'Trans proline' 0 C--O 1.22 -0.406 0 C-N-CA 121.621 1.547 . . . . 36.719999999999999 111.032 174.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 332' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -64.15 154.61 69.75 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 117.82 -0.986 . . . . 40.469999999999999 112.5 -175.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 333' ' ' CYS . . . . . . . . . . . . . 57.7 m -62.17 135.48 57.52 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 107.45 -1.315 . . . . 42.859999999999999 107.45 170.3 -54.468 -69.798 -71.154 105.701 2.049 104.884 -77.643 71.498 1 1 . 1 . 001 ecloud build full ' C' C ' 334' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -39.78 -48.39 2.22 Favored 'General case' 0 N--CA 1.418 -2.034 0 CA-C-N 115.386 -0.824 . . . . 40.329999999999998 112.841 172.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 335' ' ' MET . . . . . . . . . . . . . 61.1 mmm -69.94 -15.18 63.01 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 119.755 -0.778 . . . . 69.439999999999998 112.569 -174.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 336' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -81.59 -40.45 23.02 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.48 0.712 . . . . 73.950000000000003 111.507 163.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 337' ' ' VAL . . . . . . . . . . . . . 22.4 t -52.24 -68.78 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 123.468 0.707 . . . . 62.189999999999998 110.263 175.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 338' ' ' ILE . . . . . . . . . . . . . 2.6 pp -68.28 -5.34 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 N-CA-C 112.863 0.69 . . . . 64.170000000000002 112.863 -179.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 339' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.111 0 CA-C-N 119.097 0.862 . . . . 63.060000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 329' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.893 0 CA-C-O 121.405 0.622 . . . . 54.0 110.71 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 330' ' ' ALA . . . . . . . . . . . . . . . -116.77 151.1 46.85 Favored Pre-proline 0 N--CA 1.436 -1.159 0 N-CA-C 108.441 -0.948 . . . . 44.189999999999998 108.441 176.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 331' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -72.86 160.95 44.94 Favored 'Trans proline' 0 N--CA 1.444 -1.384 0 O-C-N 122.974 0.986 . . . . 37.350000000000001 111.522 172.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 332' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -52.8 141.54 54.53 Favored 'Trans proline' 0 N--CA 1.45 -1.082 0 O-C-N 123.736 1.387 . . . . 43.909999999999997 112.546 -178.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 333' ' ' CYS . . . . . . . . . . . . . 17.9 p -72.23 158.41 35.92 Favored 'General case' 0 C--O 1.247 0.971 0 C-N-CA 119.08 -1.048 . . . . 42.719999999999999 109.563 178.587 71.498 -77.643 -71.154 104.884 2.049 105.701 -69.798 -54.468 1 1 . 1 . 001 ecloud build full ' D' D ' 334' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -54.22 -36.52 63.6 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 115.086 -0.961 . . . . 44.880000000000003 112.203 -173.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 335' ' ' MET . . . . . . . . . . . . . 46.9 mmm -70.38 -21.62 62.84 Favored 'General case' 0 C--O 1.221 -0.442 0 N-CA-C 112.456 0.539 . . . . 72.560000000000002 112.456 -176.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 336' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -86.33 -30.49 22.19 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.933 -0.479 . . . . 59.880000000000003 110.857 174.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 337' ' ' VAL . . . . . . . . . . . . . 31.3 t -56.59 -67.33 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.408 0 N-CA-C 107.88 -1.156 . . . . 51.049999999999997 107.88 175.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 338' ' ' ILE . . . . . . . . . . . . . 8.0 pt -72.58 -17.7 18.57 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.902 0 CA-C-N 115.899 -0.592 . . . . 53.579999999999998 111.507 -176.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 339' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.455 0 O-C-N 120.248 -1.533 . . . . 48.079999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 437' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.891 0 CA-C-O 121.057 0.456 . . . . 66.989999999999995 110.97 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 438' ' ' GLY . . . . . . . . . . . . . . . 83.08 151.46 10.57 Favored Glycine 0 C--O 1.213 -1.195 0 CA-C-N 115.673 -0.694 . . . . 61.920000000000002 114.119 173.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 439' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -69.28 165.81 29.13 Favored 'Trans proline' 0 N--CA 1.438 -1.78 0 N-CA-C 109.282 -1.084 . . . . 58.950000000000003 109.282 -179.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 440' ' ' LEU . . . . . . . . . . . . . 14.8 mt -70.51 150.64 95.62 Favored Pre-proline 0 N--CA 1.434 -1.257 0 N-CA-C 107.217 -1.401 . . . . 44.829999999999998 107.217 173.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 441' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -61.94 152.25 76.2 Favored 'Trans proline' 0 C--O 1.246 0.889 0 C-N-CA 117.446 -1.236 . . . . 38.509999999999998 112.49 170.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 442' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -55.28 140.84 81.86 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 O-C-N 122.378 0.673 . . . . 43.259999999999998 111.575 -177.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 100.45 -21.85 42.43 Favored Glycine 0 C--O 1.241 0.56 0 C-N-CA 120.221 -0.99 . . . . 34.060000000000002 113.315 -178.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -97.91 150.34 21.43 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 120.766 0.317 . . . . 37.219999999999999 110.715 -170.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 445' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -148.19 140.68 24.41 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 107.766 -1.198 . . . . 39.950000000000003 107.766 -179.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 446' ' ' LYS . . . . . . . . . . . . . 11.7 ttpt -91.33 134.69 34.38 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.658 -0.867 . . . . 48.390000000000001 108.658 176.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -137.89 175.71 9.35 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-O 121.681 0.753 . . . . 44.869999999999997 112.031 172.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 448' ' ' THR . . . . . . . . . . . . . 31.8 m -126.77 126.36 43.28 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 113.649 -1.614 . . . . 41.229999999999997 109.228 176.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 449' ' ' ASP . . . . . . . . . . . . . 23.5 p30 -71.03 -177.87 1.79 Allowed 'General case' 0 C--O 1.244 0.792 0 CA-C-O 121.942 0.877 . . . . 41.049999999999997 112.76 176.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 96.3 p -72.27 -16.64 61.92 Favored 'General case' 0 C--O 1.194 -1.835 0 CA-C-N 115.351 -0.84 . . . . 50.719999999999999 112.157 -172.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 451' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -94.05 -0.13 55.61 Favored 'General case' 0 C--O 1.212 -0.904 0 N-CA-C 115.28 1.585 . . . . 59.719999999999999 115.28 173.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . 94.1 2.88 64.0 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 117.609 1.804 . . . . 41.840000000000003 117.609 -175.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 453' ' ' ARG . . . . . . . . . . . . . 28.8 mtm180 -84.11 127.1 33.69 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-N 118.334 1.067 . . . . 81.680000000000007 111.537 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 99.4 t -72.98 137.55 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.191 0 CA-C-N 114.944 -1.026 . . . . 34.740000000000002 109.601 -179.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -143.3 177.41 8.44 Favored 'General case' 0 C--O 1.255 1.378 0 CA-C-O 121.804 0.811 . . . . 30.550000000000001 111.185 170.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 456' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -130.79 139.75 50.24 Favored 'General case' 0 N--CA 1.423 -1.798 0 CA-C-N 115.096 -0.956 . . . . 33.710000000000001 110.342 -176.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 457' ' ' VAL . . . . . 0.558 HG22 HG22 ' A' ' 464' ' ' THR . 48.4 t -120.91 134.79 63.17 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.724 0 N-CA-C 107.475 -1.306 . . . . 40.090000000000003 107.475 -173.613 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 458' ' ' ASN . . . . . . . . . . . . . 55.2 t-20 -110.46 111.84 23.36 Favored 'General case' 0 C--O 1.267 1.979 0 N-CA-C 108.036 -1.098 . . . . 39.450000000000003 108.036 174.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 459' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -75.13 -15.26 60.6 Favored 'General case' 0 C--O 1.223 -0.308 0 O-C-N 125.114 1.509 . . . . 35.579999999999998 112.663 -170.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 460' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -76.08 -46.81 27.18 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-O 119.36 -0.353 . . . . 43.100000000000001 111.841 174.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 461' ' ' THR . . . . . . . . . . . . . 42.3 p -99.33 -9.33 23.68 Favored 'General case' 0 C--O 1.245 0.86 0 O-C-N 123.699 0.624 . . . . 39.229999999999997 111.401 -173.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 59.3 mtt-85 61.61 31.18 18.79 Favored 'General case' 0 CA--C 1.495 -1.154 0 O-C-N 124.001 0.813 . . . . 75.469999999999999 111.488 -179.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 463' ' ' ILE . . . . . . . . . . . . . 2.7 pt -103.58 144.63 13.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 108.965 -0.754 . . . . 56.829999999999998 108.965 175.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 464' ' ' THR . . . . . 0.558 HG22 HG22 ' A' ' 457' ' ' VAL . 41.5 p -116.36 145.16 43.42 Favored 'General case' 0 C--O 1.251 1.146 0 N-CA-C 106.973 -1.492 . . . . 37.600000000000001 106.973 172.31 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -154.37 155.37 34.92 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.574 0.702 . . . . 36.82 109.957 -178.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 466' ' ' TRP . . . . . . . . . . . . . 25.2 m95 -73.86 -27.15 60.94 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.728 -0.669 . . . . 38.200000000000003 109.896 -177.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 467' ' ' GLU . . . . . . . . . . . . . 53.7 mp0 -84.73 136.21 33.81 Favored 'General case' 0 CA--C 1.496 -1.124 0 CA-C-O 121.709 0.766 . . . . 46.780000000000001 111.092 -166.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 468' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -68.82 122.91 86.69 Favored Pre-proline 0 C--N 1.317 -0.843 0 N-CA-C 105.702 -1.962 . . . . 39.799999999999997 105.702 177.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -59.84 -28.15 86.55 Favored 'Trans proline' 0 C--N 1.357 1.005 0 C-N-CA 120.621 0.881 . . . . 48.0 111.782 177.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -67.99 -21.87 65.04 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.699 0.629 . . . . 53.490000000000002 112.699 179.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 69.8 m -76.27 -3.87 38.94 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 112.136 0.421 . . . . 72.379999999999995 112.136 170.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 . . . . . 0 N--CA 1.464 0.274 0 C-N-CA 122.848 0.459 . . . . 70.599999999999994 110.879 -175.863 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 437' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.025 0 N-CA-C 112.142 0.423 . . . . 52.460000000000001 112.142 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 438' ' ' GLY . . . . . . . . . . . . . . . 87.59 170.42 46.32 Favored Glycine 0 N--CA 1.439 -1.129 0 N-CA-C 114.351 0.5 . . . . 48.090000000000003 114.351 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 439' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -74.95 158.59 42.32 Favored 'Trans proline' 0 N--CA 1.444 -1.391 0 O-C-N 123.019 1.01 . . . . 50.509999999999998 111.463 176.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 440' ' ' LEU . . . . . . . . . . . . . 40.7 mt -61.11 156.71 47.39 Favored Pre-proline 0 N--CA 1.45 -0.442 0 N-CA-C 108.884 -0.784 . . . . 37.490000000000002 108.884 173.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 441' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -67.34 156.02 67.98 Favored 'Trans proline' 0 C--O 1.259 1.573 0 N-CA-C 113.712 0.62 . . . . 35.649999999999999 113.712 176.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 442' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -43.14 130.01 6.04 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 O-C-N 122.646 0.814 . . . . 40.439999999999998 111.919 174.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 443' ' ' GLY . . . . . . . . . . . . . . . 98.11 -12.93 63.71 Favored Glycine 0 N--CA 1.467 0.739 0 N-CA-C 116.441 1.336 . . . . 33.109999999999999 116.441 175.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 444' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -101.59 151.35 22.09 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 113.641 0.978 . . . . 34.57 113.641 -170.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 445' ' ' GLU . . . . . . . . . . . . . 61.8 tt0 -138.64 144.37 39.66 Favored 'General case' 0 C--O 1.195 -1.777 0 N-CA-C 108.486 -0.931 . . . . 31.170000000000002 108.486 176.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 446' ' ' LYS . . . . . . . . . . . . . 15.7 ttpt -97.94 134.74 40.65 Favored 'General case' 0 CA--C 1.487 -1.446 0 N-CA-C 106.086 -1.82 . . . . 49.75 106.086 178.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 447' ' ' ARG . . . . . . . . . . . . . 4.8 mmt85 -134.56 167.38 20.91 Favored 'General case' 0 C--O 1.216 -0.705 0 O-C-N 123.99 0.806 . . . . 51.18 111.208 172.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 448' ' ' THR . . . . . . . . . . . . . 93.8 m -118.31 139.67 50.99 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 124.428 1.091 . . . . 44.170000000000002 108.961 168.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 449' ' ' ASP . . . . . . . . . . . . . 30.6 p30 -82.28 174.97 10.66 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.181 0.808 . . . . 43.869999999999997 113.181 172.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 450' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.3 -34.02 73.19 Favored 'General case' 0 C--N 1.32 -0.707 0 O-C-N 121.945 -0.472 . . . . 52.530000000000001 110.996 -176.686 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 451' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -70.27 -13.57 62.23 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 115.842 1.793 . . . . 65.409999999999997 115.842 173.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 452' ' ' GLY . . . . . . . . . . . . . . . 101.84 0.53 52.17 Favored Glycine 0 CA--C 1.523 0.561 0 CA-C-O 119.676 -0.513 . . . . 48.009999999999998 113.865 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 453' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -84.06 129.25 34.92 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 118.092 0.946 . . . . 44.5 110.942 -175.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 454' ' ' VAL . . . . . . . . . . . . . 61.0 t -75.82 132.45 33.13 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-N 116.142 -0.481 . . . . 31.100000000000001 111.195 -177.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 455' ' ' TYR . . . . . . . . . . . . . 33.2 p90 -139.05 175.67 9.35 Favored 'General case' 0 C--O 1.251 1.145 0 C-N-CA 119.894 -0.722 . . . . 28.460000000000001 110.225 172.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 456' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -128.4 136.14 50.49 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 114.988 -1.005 . . . . 31.23 109.848 -172.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 457' ' ' VAL . . . . . . . . . . . . . 24.0 t -111.94 129.02 68.14 Favored 'Isoleucine or valine' 0 C--O 1.246 0.901 0 N-CA-C 109.289 -0.634 . . . . 31.219999999999999 109.289 -177.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 458' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -103.04 108.49 19.69 Favored 'General case' 0 C--O 1.245 0.849 0 N-CA-C 108.443 -0.947 . . . . 35.740000000000002 108.443 173.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -80.06 -15.56 56.91 Favored 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.51 -0.768 . . . . 37.719999999999999 112.921 -172.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 460' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -72.55 -50.38 26.03 Favored 'General case' 0 C--O 1.204 -1.291 0 N-CA-C 113.022 0.749 . . . . 41.740000000000002 113.022 171.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 33.3 p -92.72 -9.08 41.97 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 112.732 0.641 . . . . 40.329999999999998 112.732 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 462' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 60.95 51.32 4.63 Favored 'General case' 0 C--O 1.195 -1.776 0 N-CA-C 112.999 0.74 . . . . 59.710000000000001 112.999 -177.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 43.0 pt -127.64 169.41 19.11 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.715 0 CA-C-O 121.145 0.498 . . . . 52.130000000000003 111.355 173.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 464' ' ' THR . . . . . . . . . . . . . 43.9 p -131.04 151.82 51.0 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-N 114.637 -1.165 . . . . 39.490000000000002 108.371 176.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 465' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -158.99 162.76 36.82 Favored 'General case' 0 CA--C 1.554 1.104 0 CA-C-N 116.049 -0.523 . . . . 31.07 109.737 178.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 466' ' ' TRP . . . . . . . . . . . . . 37.1 m95 -79.99 -24.21 41.03 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 120.951 0.405 . . . . 33.990000000000002 111.984 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 467' ' ' GLU . . . . . . . . . . . . . 39.3 mp0 -77.94 129.98 35.99 Favored 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 113.822 1.045 . . . . 42.369999999999997 113.822 -172.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 468' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -69.38 122.44 85.55 Favored Pre-proline 0 CA--C 1.543 0.705 0 N-CA-C 107.87 -1.159 . . . . 31.719999999999999 107.87 173.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 469' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -57.95 -30.29 89.35 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.134 1.889 . . . . 33.969999999999999 112.422 178.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 470' ' ' ARG . . . . . . . . . . . . . 60.0 mtm180 -66.47 -18.48 65.39 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.515 1.302 . . . . 40.560000000000002 114.515 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 471' ' ' SER . . . . . . . . . . . . . 73.3 m -73.47 -12.19 60.71 Favored 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 113.664 0.987 . . . . 45.140000000000001 113.664 171.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 . . . . . 0 N--CA 1.455 -0.192 0 C-N-CA 124.788 1.235 . . . . 65.390000000000001 108.606 166.053 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 329' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.443 0 CA-C-O 121.256 0.551 . . . . 52.189999999999998 110.046 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 330' ' ' ALA . . . . . . . . . . . . . . . -119.15 159.04 46.7 Favored Pre-proline 0 C--O 1.244 0.779 0 N-CA-C 108.158 -1.052 . . . . 46.329999999999998 108.158 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 331' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -67.75 170.64 13.58 Favored 'Trans proline' 0 C--O 1.22 -0.406 0 C-N-CA 121.621 1.547 . . . . 36.719999999999999 111.032 174.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 332' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -64.15 154.61 69.75 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 117.82 -0.986 . . . . 40.469999999999999 112.5 -175.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 333' ' ' CYS . . . . . . . . . . . . . 57.7 m -62.17 135.48 57.52 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 107.45 -1.315 . . . . 42.859999999999999 107.45 170.3 -54.468 -69.798 -71.154 105.701 2.049 104.884 -77.643 71.498 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 334' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -39.78 -48.39 2.22 Favored 'General case' 0 N--CA 1.418 -2.034 0 CA-C-N 115.386 -0.824 . . . . 40.329999999999998 112.841 172.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 335' ' ' MET . . . . . . . . . . . . . 61.1 mmm -69.94 -15.18 63.01 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 119.755 -0.778 . . . . 69.439999999999998 112.569 -174.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 336' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -81.59 -40.45 23.02 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.48 0.712 . . . . 73.950000000000003 111.507 163.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 337' ' ' VAL . . . . . . . . . . . . . 22.4 t -52.24 -68.78 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 123.468 0.707 . . . . 62.189999999999998 110.263 175.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 338' ' ' ILE . . . . . . . . . . . . . 2.6 pp -68.28 -5.34 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 N-CA-C 112.863 0.69 . . . . 64.170000000000002 112.863 -179.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 339' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.111 0 CA-C-N 119.097 0.862 . . . . 63.060000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 329' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.893 0 CA-C-O 121.405 0.622 . . . . 54.0 110.71 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 330' ' ' ALA . . . . . . . . . . . . . . . -116.77 151.1 46.85 Favored Pre-proline 0 N--CA 1.436 -1.159 0 N-CA-C 108.441 -0.948 . . . . 44.189999999999998 108.441 176.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 331' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -72.86 160.95 44.94 Favored 'Trans proline' 0 N--CA 1.444 -1.384 0 O-C-N 122.974 0.986 . . . . 37.350000000000001 111.522 172.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 332' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -52.8 141.54 54.53 Favored 'Trans proline' 0 N--CA 1.45 -1.082 0 O-C-N 123.736 1.387 . . . . 43.909999999999997 112.546 -178.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 333' ' ' CYS . . . . . . . . . . . . . 17.9 p -72.23 158.41 35.92 Favored 'General case' 0 C--O 1.247 0.971 0 C-N-CA 119.08 -1.048 . . . . 42.719999999999999 109.563 178.587 71.498 -77.643 -71.154 104.884 2.049 105.701 -69.798 -54.468 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 334' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -54.22 -36.52 63.6 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 115.086 -0.961 . . . . 44.880000000000003 112.203 -173.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 335' ' ' MET . . . . . . . . . . . . . 46.9 mmm -70.38 -21.62 62.84 Favored 'General case' 0 C--O 1.221 -0.442 0 N-CA-C 112.456 0.539 . . . . 72.560000000000002 112.456 -176.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 336' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -86.33 -30.49 22.19 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.933 -0.479 . . . . 59.880000000000003 110.857 174.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 337' ' ' VAL . . . . . . . . . . . . . 31.3 t -56.59 -67.33 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.408 0 N-CA-C 107.88 -1.156 . . . . 51.049999999999997 107.88 175.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 338' ' ' ILE . . . . . . . . . . . . . 8.0 pt -72.58 -17.7 18.57 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.902 0 CA-C-N 115.899 -0.592 . . . . 53.579999999999998 111.507 -176.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 339' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.455 0 O-C-N 120.248 -1.533 . . . . 48.079999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_