################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list _Assigned_chem_shift_list.Entry_ID 26963 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 'hbcbcgcdcehe (H[C[caro]])' . . isotropic 26963 1 2 'hbcbcgcdhd (H[C[caro]])' . . isotropic 26963 1 3 '2D 1H-15N HSQC/HMQC' . . isotropic 26963 1 4 '2D 1H-13C HSQC/HMQC' . . isotropic 26963 1 5 '3D 1H-13C NOESY' . . isotropic 26963 1 6 'newCBCACONH (H[N[co[{CA|ca[C]}]]])' . . isotropic 26963 1 7 '3D HNCACB' . . isotropic 26963 1 8 '3D C(CO)NH' . . isotropic 26963 1 9 '3D HCCH-TOCSY' . . isotropic 26963 1 10 '3D 1H-15N NOESY' . . isotropic 26963 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $CCPNMR_Analysis . . 26963 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 14 14 LEU H H 1 7.989 0.03 . 1 . . 988 . . -7 LEU H . 26963 1 2 . 1 1 14 14 LEU HA H 1 4.304 0.002 . 1 . . 979 . . -7 LEU HA . 26963 1 3 . 1 1 14 14 LEU HB2 H 1 1.522 0.015 . 2 . . 976 . . -7 LEU HB2 . 26963 1 4 . 1 1 14 14 LEU HB3 H 1 1.494 0.03 . 2 . . 980 . . -7 LEU HB3 . 26963 1 5 . 1 1 14 14 LEU HG H 1 1.496 0.002 . 1 . . 982 . . -7 LEU HG . 26963 1 6 . 1 1 14 14 LEU HD11 H 1 0.782 0.002 . 2 . . 984 . . -7 LEU HD11 . 26963 1 7 . 1 1 14 14 LEU HD12 H 1 0.782 0.002 . 2 . . 984 . . -7 LEU HD12 . 26963 1 8 . 1 1 14 14 LEU HD13 H 1 0.782 0.002 . 2 . . 984 . . -7 LEU HD13 . 26963 1 9 . 1 1 14 14 LEU HD21 H 1 0.834 0.001 . 2 . . 986 . . -7 LEU HD21 . 26963 1 10 . 1 1 14 14 LEU HD22 H 1 0.834 0.001 . 2 . . 986 . . -7 LEU HD22 . 26963 1 11 . 1 1 14 14 LEU HD23 H 1 0.834 0.001 . 2 . . 986 . . -7 LEU HD23 . 26963 1 12 . 1 1 14 14 LEU CA C 13 55.121 0.014 . 1 . . 978 . . -7 LEU CA . 26963 1 13 . 1 1 14 14 LEU CB C 13 42.400 0.001 . 1 . . 977 . . -7 LEU CB . 26963 1 14 . 1 1 14 14 LEU CG C 13 26.931 0.009 . 1 . . 981 . . -7 LEU CG . 26963 1 15 . 1 1 14 14 LEU CD1 C 13 23.450 0.01 . 2 . . 983 . . -7 LEU CD1 . 26963 1 16 . 1 1 14 14 LEU CD2 C 13 24.753 0.011 . 2 . . 985 . . -7 LEU CD2 . 26963 1 17 . 1 1 14 14 LEU N N 15 121.402 0.3 . 1 . . 987 . . -7 LEU N . 26963 1 18 . 1 1 15 15 VAL HA H 1 4.340 0.003 . 1 . . 936 . . -6 VAL HA . 26963 1 19 . 1 1 15 15 VAL HB H 1 1.999 0.003 . 1 . . 938 . . -6 VAL HB . 26963 1 20 . 1 1 15 15 VAL HG11 H 1 0.887 0.005 . 2 . . 940 . . -6 VAL HG11 . 26963 1 21 . 1 1 15 15 VAL HG12 H 1 0.887 0.005 . 2 . . 940 . . -6 VAL HG12 . 26963 1 22 . 1 1 15 15 VAL HG13 H 1 0.887 0.005 . 2 . . 940 . . -6 VAL HG13 . 26963 1 23 . 1 1 15 15 VAL HG21 H 1 0.863 0.005 . 2 . . 942 . . -6 VAL HG21 . 26963 1 24 . 1 1 15 15 VAL HG22 H 1 0.863 0.005 . 2 . . 942 . . -6 VAL HG22 . 26963 1 25 . 1 1 15 15 VAL HG23 H 1 0.863 0.005 . 2 . . 942 . . -6 VAL HG23 . 26963 1 26 . 1 1 15 15 VAL CA C 13 59.761 0.004 . 1 . . 935 . . -6 VAL CA . 26963 1 27 . 1 1 15 15 VAL CB C 13 32.667 0.017 . 1 . . 937 . . -6 VAL CB . 26963 1 28 . 1 1 15 15 VAL CG1 C 13 21.033 0.007 . 2 . . 939 . . -6 VAL CG1 . 26963 1 29 . 1 1 15 15 VAL CG2 C 13 20.461 0.123 . 2 . . 941 . . -6 VAL CG2 . 26963 1 30 . 1 1 16 16 PRO HA H 1 4.350 0.002 . 1 . . 1079 . . -5 PRO HA . 26963 1 31 . 1 1 16 16 PRO HB2 H 1 2.222 0.002 . 2 . . 1082 . . -5 PRO HB2 . 26963 1 32 . 1 1 16 16 PRO HB3 H 1 1.825 0.003 . 2 . . 1083 . . -5 PRO HB3 . 26963 1 33 . 1 1 16 16 PRO HG2 H 1 1.979 0.004 . 2 . . 1085 . . -5 PRO HG2 . 26963 1 34 . 1 1 16 16 PRO HG3 H 1 1.887 0.003 . 2 . . 1086 . . -5 PRO HG3 . 26963 1 35 . 1 1 16 16 PRO HD2 H 1 3.800 0.002 . 2 . . 1077 . . -5 PRO HD2 . 26963 1 36 . 1 1 16 16 PRO HD3 H 1 3.595 0.002 . 2 . . 1078 . . -5 PRO HD3 . 26963 1 37 . 1 1 16 16 PRO CA C 13 63.117 0.003 . 1 . . 1080 . . -5 PRO CA . 26963 1 38 . 1 1 16 16 PRO CB C 13 32.112 0.012 . 1 . . 1081 . . -5 PRO CB . 26963 1 39 . 1 1 16 16 PRO CG C 13 27.435 0.015 . 1 . . 1084 . . -5 PRO CG . 26963 1 40 . 1 1 16 16 PRO CD C 13 51.058 0.013 . 1 . . 1076 . . -5 PRO CD . 26963 1 41 . 1 1 17 17 ARG HA H 1 4.259 0.001 . 1 . . 996 . . -4 ARG HA . 26963 1 42 . 1 1 17 17 ARG HB2 H 1 1.807 0.003 . 2 . . 1001 . . -4 ARG HB2 . 26963 1 43 . 1 1 17 17 ARG HB3 H 1 1.737 0.004 . 2 . . 1002 . . -4 ARG HB3 . 26963 1 44 . 1 1 17 17 ARG HG2 H 1 1.618 0.01 . 2 . . 998 . . -4 ARG HG2 . 26963 1 45 . 1 1 17 17 ARG HG3 H 1 1.640 0.008 . 2 . . 999 . . -4 ARG HG3 . 26963 1 46 . 1 1 17 17 ARG HD2 H 1 3.144 0.003 . 1 . . 1004 . . -4 ARG HD2 . 26963 1 47 . 1 1 17 17 ARG HD3 H 1 3.144 0.003 . 1 . . 1005 . . -4 ARG HD3 . 26963 1 48 . 1 1 17 17 ARG CA C 13 56.428 0.01 . 1 . . 995 . . -4 ARG CA . 26963 1 49 . 1 1 17 17 ARG CB C 13 30.846 0.04 . 1 . . 1000 . . -4 ARG CB . 26963 1 50 . 1 1 17 17 ARG CG C 13 27.018 0.3 . 1 . . 997 . . -4 ARG CG . 26963 1 51 . 1 1 17 17 ARG CD C 13 43.328 0.052 . 1 . . 1003 . . -4 ARG CD . 26963 1 52 . 1 1 22 22 GLN HA H 1 4.241 0.001 . 1 . . 1052 . . 1 GLN HA . 26963 1 53 . 1 1 22 22 GLN HB2 H 1 2.044 0.002 . 2 . . 1055 . . 1 GLN HB2 . 26963 1 54 . 1 1 22 22 GLN HB3 H 1 1.910 0.002 . 2 . . 1056 . . 1 GLN HB3 . 26963 1 55 . 1 1 22 22 GLN HG2 H 1 2.288 0.001 . 1 . . 1053 . . 1 GLN HG2 . 26963 1 56 . 1 1 22 22 GLN HG3 H 1 2.288 0.001 . 1 . . 1054 . . 1 GLN HG3 . 26963 1 57 . 1 1 22 22 GLN CA C 13 55.939 0.052 . 1 . . 1048 . . 1 GLN CA . 26963 1 58 . 1 1 22 22 GLN CB C 13 29.323 0.058 . 1 . . 1047 . . 1 GLN CB . 26963 1 59 . 1 1 22 22 GLN CG C 13 33.829 0.024 . 1 . . 1051 . . 1 GLN CG . 26963 1 60 . 1 1 23 23 LYS H H 1 8.237 0.007 . 1 . . 1050 . . 2 LYS H . 26963 1 61 . 1 1 23 23 LYS HA H 1 4.577 0.006 . 1 . . 1015 . . 2 LYS HA . 26963 1 62 . 1 1 23 23 LYS HB2 H 1 1.805 0.002 . 2 . . 1017 . . 2 LYS HB2 . 26963 1 63 . 1 1 23 23 LYS HB3 H 1 1.656 0.002 . 2 . . 1018 . . 2 LYS HB3 . 26963 1 64 . 1 1 23 23 LYS HG2 H 1 1.423 0.008 . 2 . . 1026 . . 2 LYS HG2 . 26963 1 65 . 1 1 23 23 LYS HG3 H 1 1.406 0.009 . 2 . . 1027 . . 2 LYS HG3 . 26963 1 66 . 1 1 23 23 LYS HD2 H 1 1.698 0.001 . 1 . . 1020 . . 2 LYS HD2 . 26963 1 67 . 1 1 23 23 LYS HD3 H 1 1.698 0.001 . 1 . . 1021 . . 2 LYS HD3 . 26963 1 68 . 1 1 23 23 LYS HE2 H 1 3.017 0.001 . 2 . . 1023 . . 2 LYS HE2 . 26963 1 69 . 1 1 23 23 LYS HE3 H 1 3.018 0.002 . 2 . . 1024 . . 2 LYS HE3 . 26963 1 70 . 1 1 23 23 LYS CA C 13 54.141 0.045 . 1 . . 1014 . . 2 LYS CA . 26963 1 71 . 1 1 23 23 LYS CB C 13 32.770 0.024 . 1 . . 1016 . . 2 LYS CB . 26963 1 72 . 1 1 23 23 LYS CG C 13 24.865 0.3 . 1 . . 1025 . . 2 LYS CG . 26963 1 73 . 1 1 23 23 LYS CD C 13 29.455 0.3 . 1 . . 1019 . . 2 LYS CD . 26963 1 74 . 1 1 23 23 LYS CE C 13 42.201 0.003 . 1 . . 1022 . . 2 LYS CE . 26963 1 75 . 1 1 23 23 LYS N N 15 122.687 0.009 . 1 . . 1049 . . 2 LYS N . 26963 1 76 . 1 1 24 24 PRO HA H 1 4.493 0.004 . 1 . . 533 . . 3 PRO HA . 26963 1 77 . 1 1 24 24 PRO HB2 H 1 2.285 0.005 . 2 . . 539 . . 3 PRO HB2 . 26963 1 78 . 1 1 24 24 PRO HB3 H 1 1.997 0.002 . 2 . . 540 . . 3 PRO HB3 . 26963 1 79 . 1 1 24 24 PRO HG2 H 1 2.035 0.004 . 2 . . 534 . . 3 PRO HG2 . 26963 1 80 . 1 1 24 24 PRO HG3 H 1 2.033 0.001 . 2 . . 535 . . 3 PRO HG3 . 26963 1 81 . 1 1 24 24 PRO HD2 H 1 3.701 0.005 . 2 . . 531 . . 3 PRO HD2 . 26963 1 82 . 1 1 24 24 PRO HD3 H 1 3.817 0.007 . 2 . . 532 . . 3 PRO HD3 . 26963 1 83 . 1 1 24 24 PRO CA C 13 64.341 0.044 . 1 . . 537 . . 3 PRO CA . 26963 1 84 . 1 1 24 24 PRO CB C 13 32.165 0.077 . 1 . . 536 . . 3 PRO CB . 26963 1 85 . 1 1 24 24 PRO CG C 13 27.411 0.038 . 1 . . 538 . . 3 PRO CG . 26963 1 86 . 1 1 24 24 PRO CD C 13 50.551 0.019 . 1 . . 896 . . 3 PRO CD . 26963 1 87 . 1 1 25 25 VAL H H 1 7.513 0.004 . 1 . . 370 . . 4 VAL H . 26963 1 88 . 1 1 25 25 VAL HA H 1 4.789 0.002 . 1 . . 369 . . 4 VAL HA . 26963 1 89 . 1 1 25 25 VAL HB H 1 1.843 0.003 . 1 . . 791 . . 4 VAL HB . 26963 1 90 . 1 1 25 25 VAL HG11 H 1 0.738 0.002 . 2 . . 374 . . 4 VAL HG11 . 26963 1 91 . 1 1 25 25 VAL HG12 H 1 0.738 0.002 . 2 . . 374 . . 4 VAL HG12 . 26963 1 92 . 1 1 25 25 VAL HG13 H 1 0.738 0.002 . 2 . . 374 . . 4 VAL HG13 . 26963 1 93 . 1 1 25 25 VAL HG21 H 1 0.844 0.001 . 2 . . 792 . . 4 VAL HG21 . 26963 1 94 . 1 1 25 25 VAL HG22 H 1 0.844 0.001 . 2 . . 792 . . 4 VAL HG22 . 26963 1 95 . 1 1 25 25 VAL HG23 H 1 0.844 0.001 . 2 . . 792 . . 4 VAL HG23 . 26963 1 96 . 1 1 25 25 VAL CA C 13 60.890 0.043 . 1 . . 371 . . 4 VAL CA . 26963 1 97 . 1 1 25 25 VAL CB C 13 34.709 0.024 . 1 . . 372 . . 4 VAL CB . 26963 1 98 . 1 1 25 25 VAL CG1 C 13 21.329 0.055 . 2 . . 793 . . 4 VAL CG1 . 26963 1 99 . 1 1 25 25 VAL CG2 C 13 21.090 0.009 . 2 . . 1101 . . 4 VAL CG2 . 26963 1 100 . 1 1 25 25 VAL N N 15 118.111 0.009 . 1 . . 368 . . 4 VAL N . 26963 1 101 . 1 1 26 26 VAL H H 1 9.164 0.003 . 1 . . 211 . . 5 VAL H . 26963 1 102 . 1 1 26 26 VAL HA H 1 4.172 0.004 . 1 . . 208 . . 5 VAL HA . 26963 1 103 . 1 1 26 26 VAL HB H 1 1.833 0.002 . 1 . . 214 . . 5 VAL HB . 26963 1 104 . 1 1 26 26 VAL HG11 H 1 0.790 0.003 . 1 . . 215 . . 5 VAL HG11 . 26963 1 105 . 1 1 26 26 VAL HG12 H 1 0.790 0.003 . 1 . . 215 . . 5 VAL HG12 . 26963 1 106 . 1 1 26 26 VAL HG13 H 1 0.790 0.003 . 1 . . 215 . . 5 VAL HG13 . 26963 1 107 . 1 1 26 26 VAL HG21 H 1 0.874 0.002 . 1 . . 373 . . 5 VAL HG21 . 26963 1 108 . 1 1 26 26 VAL HG22 H 1 0.874 0.002 . 1 . . 373 . . 5 VAL HG22 . 26963 1 109 . 1 1 26 26 VAL HG23 H 1 0.874 0.002 . 1 . . 373 . . 5 VAL HG23 . 26963 1 110 . 1 1 26 26 VAL CA C 13 61.623 0.029 . 1 . . 212 . . 5 VAL CA . 26963 1 111 . 1 1 26 26 VAL CB C 13 34.018 0.078 . 1 . . 213 . . 5 VAL CB . 26963 1 112 . 1 1 26 26 VAL CG1 C 13 20.629 0.07 . 1 . . 210 . . 5 VAL CG1 . 26963 1 113 . 1 1 26 26 VAL CG2 C 13 21.567 0.048 . 1 . . 209 . . 5 VAL CG2 . 26963 1 114 . 1 1 26 26 VAL N N 15 129.827 0.011 . 1 . . 207 . . 5 VAL N . 26963 1 115 . 1 1 27 27 THR H H 1 8.383 0.003 . 1 . . 675 . . 6 THR H . 26963 1 116 . 1 1 27 27 THR HA H 1 4.920 0.006 . 1 . . 915 . . 6 THR HA . 26963 1 117 . 1 1 27 27 THR HB H 1 4.106 0.002 . 1 . . 916 . . 6 THR HB . 26963 1 118 . 1 1 27 27 THR HG21 H 1 1.041 0.001 . 1 . . 673 . . 6 THR HG21 . 26963 1 119 . 1 1 27 27 THR HG22 H 1 1.041 0.001 . 1 . . 673 . . 6 THR HG22 . 26963 1 120 . 1 1 27 27 THR HG23 H 1 1.041 0.001 . 1 . . 673 . . 6 THR HG23 . 26963 1 121 . 1 1 27 27 THR CA C 13 60.715 0.007 . 1 . . 914 . . 6 THR CA . 26963 1 122 . 1 1 27 27 THR CB C 13 69.786 0.131 . 1 . . 674 . . 6 THR CB . 26963 1 123 . 1 1 27 27 THR CG2 C 13 21.388 0.04 . 1 . . 672 . . 6 THR CG2 . 26963 1 124 . 1 1 27 27 THR N N 15 120.154 0.033 . 1 . . 671 . . 6 THR N . 26963 1 125 . 1 1 28 28 LEU H H 1 9.019 0.006 . 1 . . 201 . . 7 LEU H . 26963 1 126 . 1 1 28 28 LEU HA H 1 4.769 0.002 . 1 . . 198 . . 7 LEU HA . 26963 1 127 . 1 1 28 28 LEU HB2 H 1 1.626 0.011 . 2 . . 206 . . 7 LEU HB2 . 26963 1 128 . 1 1 28 28 LEU HB3 H 1 1.162 0.03 . 2 . . 794 . . 7 LEU HB3 . 26963 1 129 . 1 1 28 28 LEU HG H 1 1.390 0.005 . 1 . . 796 . . 7 LEU HG . 26963 1 130 . 1 1 28 28 LEU HD11 H 1 0.860 0.001 . 2 . . 200 . . 7 LEU HD11 . 26963 1 131 . 1 1 28 28 LEU HD12 H 1 0.860 0.001 . 2 . . 200 . . 7 LEU HD12 . 26963 1 132 . 1 1 28 28 LEU HD13 H 1 0.860 0.001 . 2 . . 200 . . 7 LEU HD13 . 26963 1 133 . 1 1 28 28 LEU HD21 H 1 1.120 0.003 . 2 . . 204 . . 7 LEU HD21 . 26963 1 134 . 1 1 28 28 LEU HD22 H 1 1.120 0.003 . 2 . . 204 . . 7 LEU HD22 . 26963 1 135 . 1 1 28 28 LEU HD23 H 1 1.120 0.003 . 2 . . 204 . . 7 LEU HD23 . 26963 1 136 . 1 1 28 28 LEU CA C 13 53.779 0.031 . 1 . . 202 . . 7 LEU CA . 26963 1 137 . 1 1 28 28 LEU CB C 13 46.288 0.15 . 1 . . 203 . . 7 LEU CB . 26963 1 138 . 1 1 28 28 LEU CG C 13 27.488 0.3 . 1 . . 795 . . 7 LEU CG . 26963 1 139 . 1 1 28 28 LEU CD1 C 13 27.444 0.014 . 2 . . 205 . . 7 LEU CD1 . 26963 1 140 . 1 1 28 28 LEU CD2 C 13 23.626 0.018 . 2 . . 199 . . 7 LEU CD2 . 26963 1 141 . 1 1 28 28 LEU N N 15 127.883 0.011 . 1 . . 197 . . 7 LEU N . 26963 1 142 . 1 1 29 29 ASP H H 1 8.946 0.007 . 1 . . 558 . . 8 ASP H . 26963 1 143 . 1 1 29 29 ASP HA H 1 4.726 0.03 . 1 . . 555 . . 8 ASP HA . 26963 1 144 . 1 1 29 29 ASP HB2 H 1 2.984 0.03 . 2 . . 559 . . 8 ASP HB2 . 26963 1 145 . 1 1 29 29 ASP HB3 H 1 2.613 0.03 . 2 . . 560 . . 8 ASP HB3 . 26963 1 146 . 1 1 29 29 ASP CA C 13 53.229 0.066 . 1 . . 557 . . 8 ASP CA . 26963 1 147 . 1 1 29 29 ASP CB C 13 42.642 0.062 . 1 . . 556 . . 8 ASP CB . 26963 1 148 . 1 1 29 29 ASP N N 15 122.350 0.026 . 1 . . 554 . . 8 ASP N . 26963 1 149 . 1 1 30 30 ASP H H 1 7.518 0.004 . 1 . . 731 . . 9 ASP H . 26963 1 150 . 1 1 30 30 ASP HA H 1 4.826 0.03 . 1 . . 520 . . 9 ASP HA . 26963 1 151 . 1 1 30 30 ASP HB2 H 1 2.855 0.001 . 2 . . 523 . . 9 ASP HB2 . 26963 1 152 . 1 1 30 30 ASP HB3 H 1 2.584 0.001 . 2 . . 524 . . 9 ASP HB3 . 26963 1 153 . 1 1 30 30 ASP CA C 13 52.989 0.3 . 1 . . 522 . . 9 ASP CA . 26963 1 154 . 1 1 30 30 ASP CB C 13 42.764 0.035 . 1 . . 521 . . 9 ASP CB . 26963 1 155 . 1 1 30 30 ASP N N 15 118.117 0.012 . 1 . . 730 . . 9 ASP N . 26963 1 156 . 1 1 31 31 ALA H H 1 8.999 0.03 . 1 . . 1089 . . 10 ALA H . 26963 1 157 . 1 1 31 31 ALA HA H 1 4.063 0.003 . 1 . . 834 . . 10 ALA HA . 26963 1 158 . 1 1 31 31 ALA HB1 H 1 0.954 0.03 . 1 . . 729 . . 10 ALA HB1 . 26963 1 159 . 1 1 31 31 ALA HB2 H 1 0.954 0.03 . 1 . . 729 . . 10 ALA HB2 . 26963 1 160 . 1 1 31 31 ALA HB3 H 1 0.954 0.03 . 1 . . 729 . . 10 ALA HB3 . 26963 1 161 . 1 1 31 31 ALA CA C 13 54.008 0.3 . 1 . . 727 . . 10 ALA CA . 26963 1 162 . 1 1 31 31 ALA CB C 13 17.376 0.3 . 1 . . 728 . . 10 ALA CB . 26963 1 163 . 1 1 31 31 ALA N N 15 128.195 0.3 . 1 . . 1090 . . 10 ALA N . 26963 1 164 . 1 1 32 32 ASP H H 1 8.972 0.03 . 1 . . 1066 . . 11 ASP H . 26963 1 165 . 1 1 32 32 ASP HA H 1 4.337 0.003 . 1 . . 461 . . 11 ASP HA . 26963 1 166 . 1 1 32 32 ASP HB2 H 1 2.706 0.002 . 2 . . 464 . . 11 ASP HB2 . 26963 1 167 . 1 1 32 32 ASP HB3 H 1 2.533 0.005 . 2 . . 797 . . 11 ASP HB3 . 26963 1 168 . 1 1 32 32 ASP CA C 13 56.658 0.086 . 1 . . 462 . . 11 ASP CA . 26963 1 169 . 1 1 32 32 ASP CB C 13 39.976 0.218 . 1 . . 463 . . 11 ASP CB . 26963 1 170 . 1 1 32 32 ASP N N 15 121.439 0.3 . 1 . . 1067 . . 11 ASP N . 26963 1 171 . 1 1 33 33 ASP H H 1 7.888 0.005 . 1 . . 439 . . 12 ASP H . 26963 1 172 . 1 1 33 33 ASP HA H 1 4.551 0.002 . 1 . . 436 . . 12 ASP HA . 26963 1 173 . 1 1 33 33 ASP HB2 H 1 2.790 0.005 . 2 . . 440 . . 12 ASP HB2 . 26963 1 174 . 1 1 33 33 ASP HB3 H 1 2.687 0.03 . 2 . . 441 . . 12 ASP HB3 . 26963 1 175 . 1 1 33 33 ASP CA C 13 55.273 0.03 . 1 . . 438 . . 12 ASP CA . 26963 1 176 . 1 1 33 33 ASP CB C 13 40.529 0.03 . 1 . . 437 . . 12 ASP CB . 26963 1 177 . 1 1 33 33 ASP N N 15 117.949 0.081 . 1 . . 435 . . 12 ASP N . 26963 1 178 . 1 1 34 34 CYS H H 1 7.885 0.006 . 1 . . 574 . . 13 CYS H . 26963 1 179 . 1 1 34 34 CYS HA H 1 4.855 0.003 . 1 . . 572 . . 13 CYS HA . 26963 1 180 . 1 1 34 34 CYS HB2 H 1 3.636 0.03 . 2 . . 575 . . 13 CYS HB2 . 26963 1 181 . 1 1 34 34 CYS HB3 H 1 4.294 0.03 . 2 . . 576 . . 13 CYS HB3 . 26963 1 182 . 1 1 34 34 CYS CA C 13 55.662 0.141 . 1 . . 737 . . 13 CYS CA . 26963 1 183 . 1 1 34 34 CYS CB C 13 44.866 0.134 . 1 . . 573 . . 13 CYS CB . 26963 1 184 . 1 1 34 34 CYS N N 15 118.486 0.024 . 1 . . 571 . . 13 CYS N . 26963 1 185 . 1 1 35 35 SER H H 1 7.521 0.005 . 1 . . 734 . . 14 SER H . 26963 1 186 . 1 1 35 35 SER HA H 1 4.649 0.004 . 1 . . 906 . . 14 SER HA . 26963 1 187 . 1 1 35 35 SER HB2 H 1 4.124 0.002 . 2 . . 905 . . 14 SER HB2 . 26963 1 188 . 1 1 35 35 SER HB3 H 1 3.587 0.006 . 2 . . 907 . . 14 SER HB3 . 26963 1 189 . 1 1 35 35 SER CA C 13 57.162 0.059 . 1 . . 736 . . 14 SER CA . 26963 1 190 . 1 1 35 35 SER CB C 13 65.029 0.04 . 1 . . 735 . . 14 SER CB . 26963 1 191 . 1 1 35 35 SER N N 15 118.124 0.014 . 1 . . 733 . . 14 SER N . 26963 1 192 . 1 1 36 36 PRO HA H 1 4.329 0.009 . 1 . . 97 . . 15 PRO HA . 26963 1 193 . 1 1 36 36 PRO HB2 H 1 2.013 0.013 . 2 . . 103 . . 15 PRO HB2 . 26963 1 194 . 1 1 36 36 PRO HB3 H 1 1.614 0.007 . 2 . . 104 . . 15 PRO HB3 . 26963 1 195 . 1 1 36 36 PRO HG2 H 1 1.700 0.009 . 2 . . 98 . . 15 PRO HG2 . 26963 1 196 . 1 1 36 36 PRO HG3 H 1 1.267 0.009 . 2 . . 99 . . 15 PRO HG3 . 26963 1 197 . 1 1 36 36 PRO HD2 H 1 3.401 0.011 . 2 . . 95 . . 15 PRO HD2 . 26963 1 198 . 1 1 36 36 PRO HD3 H 1 3.556 0.008 . 2 . . 96 . . 15 PRO HD3 . 26963 1 199 . 1 1 36 36 PRO CA C 13 62.284 0.152 . 1 . . 100 . . 15 PRO CA . 26963 1 200 . 1 1 36 36 PRO CB C 13 35.162 0.098 . 1 . . 101 . . 15 PRO CB . 26963 1 201 . 1 1 36 36 PRO CG C 13 23.219 0.042 . 1 . . 102 . . 15 PRO CG . 26963 1 202 . 1 1 36 36 PRO CD C 13 52.223 0.077 . 1 . . 94 . . 15 PRO CD . 26963 1 203 . 1 1 37 37 LEU H H 1 8.947 0.004 . 1 . . 310 . . 16 LEU H . 26963 1 204 . 1 1 37 37 LEU HA H 1 4.437 0.004 . 1 . . 304 . . 16 LEU HA . 26963 1 205 . 1 1 37 37 LEU HB2 H 1 1.463 0.03 . 2 . . 314 . . 16 LEU HB2 . 26963 1 206 . 1 1 37 37 LEU HB3 H 1 1.983 0.009 . 2 . . 315 . . 16 LEU HB3 . 26963 1 207 . 1 1 37 37 LEU HG H 1 1.296 0.006 . 1 . . 307 . . 16 LEU HG . 26963 1 208 . 1 1 37 37 LEU HD11 H 1 0.908 0.003 . 2 . . 311 . . 16 LEU HD11 . 26963 1 209 . 1 1 37 37 LEU HD12 H 1 0.908 0.003 . 2 . . 311 . . 16 LEU HD12 . 26963 1 210 . 1 1 37 37 LEU HD13 H 1 0.908 0.003 . 2 . . 311 . . 16 LEU HD13 . 26963 1 211 . 1 1 37 37 LEU HD21 H 1 0.818 0.002 . 2 . . 312 . . 16 LEU HD21 . 26963 1 212 . 1 1 37 37 LEU HD22 H 1 0.818 0.002 . 2 . . 312 . . 16 LEU HD22 . 26963 1 213 . 1 1 37 37 LEU HD23 H 1 0.818 0.002 . 2 . . 312 . . 16 LEU HD23 . 26963 1 214 . 1 1 37 37 LEU CA C 13 55.258 0.026 . 1 . . 309 . . 16 LEU CA . 26963 1 215 . 1 1 37 37 LEU CB C 13 42.368 0.125 . 1 . . 308 . . 16 LEU CB . 26963 1 216 . 1 1 37 37 LEU CG C 13 27.527 0.052 . 1 . . 313 . . 16 LEU CG . 26963 1 217 . 1 1 37 37 LEU CD1 C 13 23.447 0.081 . 2 . . 306 . . 16 LEU CD1 . 26963 1 218 . 1 1 37 37 LEU CD2 C 13 27.918 0.01 . 2 . . 305 . . 16 LEU CD2 . 26963 1 219 . 1 1 37 37 LEU N N 15 120.372 0.025 . 1 . . 303 . . 16 LEU N . 26963 1 220 . 1 1 38 38 LYS H H 1 8.550 0.002 . 1 . . 738 . . 17 LYS H . 26963 1 221 . 1 1 38 38 LYS HA H 1 5.113 0.005 . 1 . . 809 . . 17 LYS HA . 26963 1 222 . 1 1 38 38 LYS HB2 H 1 1.746 0.005 . 1 . . 807 . . 17 LYS HB2 . 26963 1 223 . 1 1 38 38 LYS HB3 H 1 1.746 0.005 . 1 . . 808 . . 17 LYS HB3 . 26963 1 224 . 1 1 38 38 LYS HG2 H 1 1.225 0.002 . 2 . . 805 . . 17 LYS HG2 . 26963 1 225 . 1 1 38 38 LYS HG3 H 1 1.492 0.004 . 2 . . 806 . . 17 LYS HG3 . 26963 1 226 . 1 1 38 38 LYS HD2 H 1 1.651 0.003 . 1 . . 799 . . 17 LYS HD2 . 26963 1 227 . 1 1 38 38 LYS HD3 H 1 1.651 0.003 . 1 . . 803 . . 17 LYS HD3 . 26963 1 228 . 1 1 38 38 LYS HE2 H 1 2.914 0.013 . 2 . . 801 . . 17 LYS HE2 . 26963 1 229 . 1 1 38 38 LYS HE3 H 1 2.914 0.013 . 2 . . 802 . . 17 LYS HE3 . 26963 1 230 . 1 1 38 38 LYS CA C 13 56.277 0.092 . 1 . . 732 . . 17 LYS CA . 26963 1 231 . 1 1 38 38 LYS CB C 13 32.035 0.039 . 1 . . 740 . . 17 LYS CB . 26963 1 232 . 1 1 38 38 LYS CG C 13 25.359 0.055 . 1 . . 804 . . 17 LYS CG . 26963 1 233 . 1 1 38 38 LYS CD C 13 29.289 0.061 . 1 . . 798 . . 17 LYS CD . 26963 1 234 . 1 1 38 38 LYS CE C 13 41.996 0.002 . 1 . . 800 . . 17 LYS CE . 26963 1 235 . 1 1 38 38 LYS N N 15 129.523 0.04 . 1 . . 739 . . 17 LYS N . 26963 1 236 . 1 1 39 39 LEU H H 1 8.313 0.005 . 1 . . 19 . . 18 LEU H . 26963 1 237 . 1 1 39 39 LEU HA H 1 5.044 0.003 . 1 . . 17 . . 18 LEU HA . 26963 1 238 . 1 1 39 39 LEU HB2 H 1 1.432 0.002 . 2 . . 24 . . 18 LEU HB2 . 26963 1 239 . 1 1 39 39 LEU HB3 H 1 1.703 0.004 . 2 . . 25 . . 18 LEU HB3 . 26963 1 240 . 1 1 39 39 LEU HG H 1 0.665 0.003 . 1 . . 18 . . 18 LEU HG . 26963 1 241 . 1 1 39 39 LEU HD11 H 1 0.852 0.001 . 2 . . 22 . . 18 LEU HD11 . 26963 1 242 . 1 1 39 39 LEU HD12 H 1 0.852 0.001 . 2 . . 22 . . 18 LEU HD12 . 26963 1 243 . 1 1 39 39 LEU HD13 H 1 0.852 0.001 . 2 . . 22 . . 18 LEU HD13 . 26963 1 244 . 1 1 39 39 LEU HD21 H 1 0.855 0.03 . 2 . . 1059 . . 18 LEU HD21 . 26963 1 245 . 1 1 39 39 LEU HD22 H 1 0.855 0.03 . 2 . . 1059 . . 18 LEU HD22 . 26963 1 246 . 1 1 39 39 LEU HD23 H 1 0.855 0.03 . 2 . . 1059 . . 18 LEU HD23 . 26963 1 247 . 1 1 39 39 LEU CA C 13 52.862 0.161 . 1 . . 20 . . 18 LEU CA . 26963 1 248 . 1 1 39 39 LEU CB C 13 47.052 0.066 . 1 . . 21 . . 18 LEU CB . 26963 1 249 . 1 1 39 39 LEU CG C 13 27.287 0.082 . 1 . . 23 . . 18 LEU CG . 26963 1 250 . 1 1 39 39 LEU CD1 C 13 23.315 0.3 . 2 . . 846 . . 18 LEU CD1 . 26963 1 251 . 1 1 39 39 LEU CD2 C 13 23.318 0.3 . 2 . . 845 . . 18 LEU CD2 . 26963 1 252 . 1 1 39 39 LEU N N 15 123.790 0.08 . 1 . . 16 . . 18 LEU N . 26963 1 253 . 1 1 40 40 THR H H 1 8.828 0.004 . 1 . . 741 . . 19 THR H . 26963 1 254 . 1 1 40 40 THR HA H 1 4.815 0.001 . 1 . . 810 . . 19 THR HA . 26963 1 255 . 1 1 40 40 THR HB H 1 3.825 0.001 . 1 . . 811 . . 19 THR HB . 26963 1 256 . 1 1 40 40 THR HG21 H 1 1.136 0.001 . 1 . . 813 . . 19 THR HG21 . 26963 1 257 . 1 1 40 40 THR HG22 H 1 1.136 0.001 . 1 . . 813 . . 19 THR HG22 . 26963 1 258 . 1 1 40 40 THR HG23 H 1 1.136 0.001 . 1 . . 813 . . 19 THR HG23 . 26963 1 259 . 1 1 40 40 THR CA C 13 60.411 0.068 . 1 . . 744 . . 19 THR CA . 26963 1 260 . 1 1 40 40 THR CB C 13 71.660 0.204 . 1 . . 743 . . 19 THR CB . 26963 1 261 . 1 1 40 40 THR CG2 C 13 20.839 0.003 . 1 . . 812 . . 19 THR CG2 . 26963 1 262 . 1 1 40 40 THR N N 15 114.212 0.021 . 1 . . 742 . . 19 THR N . 26963 1 263 . 1 1 41 41 GLN H H 1 8.621 0.005 . 1 . . 605 . . 20 GLN H . 26963 1 264 . 1 1 41 41 GLN HA H 1 3.475 0.006 . 1 . . 602 . . 20 GLN HA . 26963 1 265 . 1 1 41 41 GLN HB2 H 1 1.766 0.002 . 2 . . 608 . . 20 GLN HB2 . 26963 1 266 . 1 1 41 41 GLN HB3 H 1 1.924 0.002 . 2 . . 609 . . 20 GLN HB3 . 26963 1 267 . 1 1 41 41 GLN HG2 H 1 2.142 0.002 . 2 . . 603 . . 20 GLN HG2 . 26963 1 268 . 1 1 41 41 GLN HG3 H 1 1.821 0.004 . 2 . . 604 . . 20 GLN HG3 . 26963 1 269 . 1 1 41 41 GLN HE21 H 1 7.467 0.03 . 1 . . 1029 . . 20 GLN HE21 . 26963 1 270 . 1 1 41 41 GLN HE22 H 1 6.729 0.03 . 1 . . 1030 . . 20 GLN HE22 . 26963 1 271 . 1 1 41 41 GLN CA C 13 58.755 0.034 . 1 . . 606 . . 20 GLN CA . 26963 1 272 . 1 1 41 41 GLN CB C 13 28.994 0.123 . 1 . . 745 . . 20 GLN CB . 26963 1 273 . 1 1 41 41 GLN CG C 13 34.811 0.037 . 1 . . 607 . . 20 GLN CG . 26963 1 274 . 1 1 41 41 GLN N N 15 122.956 0.022 . 1 . . 601 . . 20 GLN N . 26963 1 275 . 1 1 41 41 GLN NE2 N 15 111.648 0.009 . 1 . . 1028 . . 20 GLN NE2 . 26963 1 276 . 1 1 42 42 GLY H H 1 8.827 0.002 . 1 . . 422 . . 21 GLY H . 26963 1 277 . 1 1 42 42 GLY HA2 H 1 4.473 0.002 . 2 . . 420 . . 21 GLY HA2 . 26963 1 278 . 1 1 42 42 GLY HA3 H 1 3.555 0.002 . 2 . . 421 . . 21 GLY HA3 . 26963 1 279 . 1 1 42 42 GLY CA C 13 44.718 0.035 . 1 . . 419 . . 21 GLY CA . 26963 1 280 . 1 1 42 42 GLY N N 15 111.970 0.021 . 1 . . 418 . . 21 GLY N . 26963 1 281 . 1 1 43 43 GLN H H 1 7.658 0.002 . 1 . . 392 . . 22 GLN H . 26963 1 282 . 1 1 43 43 GLN HA H 1 4.376 0.007 . 1 . . 386 . . 22 GLN HA . 26963 1 283 . 1 1 43 43 GLN HB2 H 1 1.802 0.009 . 2 . . 394 . . 22 GLN HB2 . 26963 1 284 . 1 1 43 43 GLN HB3 H 1 2.233 0.007 . 2 . . 395 . . 22 GLN HB3 . 26963 1 285 . 1 1 43 43 GLN HG2 H 1 2.385 0.006 . 1 . . 388 . . 22 GLN HG2 . 26963 1 286 . 1 1 43 43 GLN HG3 H 1 2.385 0.006 . 1 . . 389 . . 22 GLN HG3 . 26963 1 287 . 1 1 43 43 GLN HE21 H 1 6.565 0.03 . 1 . . 396 . . 22 GLN HE21 . 26963 1 288 . 1 1 43 43 GLN HE22 H 1 8.029 0.03 . 1 . . 397 . . 22 GLN HE22 . 26963 1 289 . 1 1 43 43 GLN CA C 13 57.613 0.047 . 1 . . 391 . . 22 GLN CA . 26963 1 290 . 1 1 43 43 GLN CB C 13 30.942 0.021 . 1 . . 390 . . 22 GLN CB . 26963 1 291 . 1 1 43 43 GLN CG C 13 36.009 0.09 . 1 . . 393 . . 22 GLN CG . 26963 1 292 . 1 1 43 43 GLN N N 15 119.086 0.007 . 1 . . 385 . . 22 GLN N . 26963 1 293 . 1 1 43 43 GLN NE2 N 15 111.866 0.065 . 1 . . 387 . . 22 GLN NE2 . 26963 1 294 . 1 1 44 44 GLU H H 1 8.431 0.003 . 1 . . 490 . . 23 GLU H . 26963 1 295 . 1 1 44 44 GLU HA H 1 5.163 0.012 . 1 . . 487 . . 23 GLU HA . 26963 1 296 . 1 1 44 44 GLU HB2 H 1 2.041 0.03 . 2 . . 494 . . 23 GLU HB2 . 26963 1 297 . 1 1 44 44 GLU HB3 H 1 1.934 0.009 . 2 . . 495 . . 23 GLU HB3 . 26963 1 298 . 1 1 44 44 GLU HG2 H 1 2.286 0.003 . 2 . . 488 . . 23 GLU HG2 . 26963 1 299 . 1 1 44 44 GLU HG3 H 1 2.018 0.004 . 2 . . 489 . . 23 GLU HG3 . 26963 1 300 . 1 1 44 44 GLU CA C 13 55.004 0.07 . 1 . . 491 . . 23 GLU CA . 26963 1 301 . 1 1 44 44 GLU CB C 13 32.463 0.04 . 1 . . 492 . . 23 GLU CB . 26963 1 302 . 1 1 44 44 GLU CG C 13 36.883 0.095 . 1 . . 493 . . 23 GLU CG . 26963 1 303 . 1 1 44 44 GLU N N 15 121.720 0.014 . 1 . . 486 . . 23 GLU N . 26963 1 304 . 1 1 45 45 LEU H H 1 9.142 0.003 . 1 . . 721 . . 24 LEU H . 26963 1 305 . 1 1 45 45 LEU HA H 1 5.245 0.005 . 1 . . 717 . . 24 LEU HA . 26963 1 306 . 1 1 45 45 LEU HB2 H 1 0.939 0.009 . 2 . . 814 . . 24 LEU HB2 . 26963 1 307 . 1 1 45 45 LEU HB3 H 1 1.731 0.006 . 2 . . 815 . . 24 LEU HB3 . 26963 1 308 . 1 1 45 45 LEU HG H 1 1.307 0.003 . 1 . . 720 . . 24 LEU HG . 26963 1 309 . 1 1 45 45 LEU HD11 H 1 0.435 0.005 . 2 . . 724 . . 24 LEU HD11 . 26963 1 310 . 1 1 45 45 LEU HD12 H 1 0.435 0.005 . 2 . . 724 . . 24 LEU HD12 . 26963 1 311 . 1 1 45 45 LEU HD13 H 1 0.435 0.005 . 2 . . 724 . . 24 LEU HD13 . 26963 1 312 . 1 1 45 45 LEU HD21 H 1 0.767 0.003 . 2 . . 725 . . 24 LEU HD21 . 26963 1 313 . 1 1 45 45 LEU HD22 H 1 0.767 0.003 . 2 . . 725 . . 24 LEU HD22 . 26963 1 314 . 1 1 45 45 LEU HD23 H 1 0.767 0.003 . 2 . . 725 . . 24 LEU HD23 . 26963 1 315 . 1 1 45 45 LEU CA C 13 52.911 0.045 . 1 . . 722 . . 24 LEU CA . 26963 1 316 . 1 1 45 45 LEU CB C 13 46.583 0.151 . 1 . . 723 . . 24 LEU CB . 26963 1 317 . 1 1 45 45 LEU CG C 13 27.394 0.3 . 1 . . 726 . . 24 LEU CG . 26963 1 318 . 1 1 45 45 LEU CD1 C 13 25.963 0.011 . 2 . . 718 . . 24 LEU CD1 . 26963 1 319 . 1 1 45 45 LEU CD2 C 13 24.403 0.027 . 2 . . 719 . . 24 LEU CD2 . 26963 1 320 . 1 1 45 45 LEU N N 15 126.856 0.034 . 1 . . 716 . . 24 LEU N . 26963 1 321 . 1 1 46 46 VAL H H 1 9.132 0.007 . 1 . . 417 . . 25 VAL H . 26963 1 322 . 1 1 46 46 VAL HA H 1 4.741 0.002 . 1 . . 818 . . 25 VAL HA . 26963 1 323 . 1 1 46 46 VAL HB H 1 1.911 0.006 . 1 . . 819 . . 25 VAL HB . 26963 1 324 . 1 1 46 46 VAL HG11 H 1 0.803 0.001 . 2 . . 820 . . 25 VAL HG11 . 26963 1 325 . 1 1 46 46 VAL HG12 H 1 0.803 0.001 . 2 . . 820 . . 25 VAL HG12 . 26963 1 326 . 1 1 46 46 VAL HG13 H 1 0.803 0.001 . 2 . . 820 . . 25 VAL HG13 . 26963 1 327 . 1 1 46 46 VAL HG21 H 1 0.735 0.001 . 2 . . 821 . . 25 VAL HG21 . 26963 1 328 . 1 1 46 46 VAL HG22 H 1 0.735 0.001 . 2 . . 821 . . 25 VAL HG22 . 26963 1 329 . 1 1 46 46 VAL HG23 H 1 0.735 0.001 . 2 . . 821 . . 25 VAL HG23 . 26963 1 330 . 1 1 46 46 VAL CA C 13 61.435 0.094 . 1 . . 747 . . 25 VAL CA . 26963 1 331 . 1 1 46 46 VAL CB C 13 33.387 0.119 . 1 . . 746 . . 25 VAL CB . 26963 1 332 . 1 1 46 46 VAL CG1 C 13 21.411 0.3 . 2 . . 1099 . . 25 VAL CG1 . 26963 1 333 . 1 1 46 46 VAL CG2 C 13 21.290 0.002 . 2 . . 1100 . . 25 VAL CG2 . 26963 1 334 . 1 1 46 46 VAL N N 15 127.876 0.021 . 1 . . 416 . . 25 VAL N . 26963 1 335 . 1 1 47 47 LEU H H 1 9.262 0.006 . 1 . . 471 . . 26 LEU H . 26963 1 336 . 1 1 47 47 LEU HA H 1 5.361 0.004 . 1 . . 468 . . 26 LEU HA . 26963 1 337 . 1 1 47 47 LEU HB2 H 1 1.031 0.015 . 2 . . 477 . . 26 LEU HB2 . 26963 1 338 . 1 1 47 47 LEU HB3 H 1 2.091 0.01 . 2 . . 478 . . 26 LEU HB3 . 26963 1 339 . 1 1 47 47 LEU HG H 1 1.149 0.006 . 1 . . 475 . . 26 LEU HG . 26963 1 340 . 1 1 47 47 LEU HD11 H 1 0.111 0.006 . 2 . . 470 . . 26 LEU HD11 . 26963 1 341 . 1 1 47 47 LEU HD12 H 1 0.111 0.006 . 2 . . 470 . . 26 LEU HD12 . 26963 1 342 . 1 1 47 47 LEU HD13 H 1 0.111 0.006 . 2 . . 470 . . 26 LEU HD13 . 26963 1 343 . 1 1 47 47 LEU HD21 H 1 0.148 0.005 . 2 . . 474 . . 26 LEU HD21 . 26963 1 344 . 1 1 47 47 LEU HD22 H 1 0.148 0.005 . 2 . . 474 . . 26 LEU HD22 . 26963 1 345 . 1 1 47 47 LEU HD23 H 1 0.148 0.005 . 2 . . 474 . . 26 LEU HD23 . 26963 1 346 . 1 1 47 47 LEU CA C 13 53.210 0.045 . 1 . . 472 . . 26 LEU CA . 26963 1 347 . 1 1 47 47 LEU CB C 13 45.714 0.072 . 1 . . 473 . . 26 LEU CB . 26963 1 348 . 1 1 47 47 LEU CG C 13 27.560 0.027 . 1 . . 847 . . 26 LEU CG . 26963 1 349 . 1 1 47 47 LEU CD1 C 13 23.213 0.027 . 2 . . 476 . . 26 LEU CD1 . 26963 1 350 . 1 1 47 47 LEU CD2 C 13 27.302 0.053 . 2 . . 469 . . 26 LEU CD2 . 26963 1 351 . 1 1 47 47 LEU N N 15 132.100 0.013 . 1 . . 467 . . 26 LEU N . 26963 1 352 . 1 1 48 48 THR H H 1 8.201 0.003 . 1 . . 458 . . 27 THR H . 26963 1 353 . 1 1 48 48 THR HA H 1 5.433 0.006 . 1 . . 459 . . 27 THR HA . 26963 1 354 . 1 1 48 48 THR HB H 1 3.682 0.001 . 1 . . 460 . . 27 THR HB . 26963 1 355 . 1 1 48 48 THR HG21 H 1 0.952 0.001 . 1 . . 455 . . 27 THR HG21 . 26963 1 356 . 1 1 48 48 THR HG22 H 1 0.952 0.001 . 1 . . 455 . . 27 THR HG22 . 26963 1 357 . 1 1 48 48 THR HG23 H 1 0.952 0.001 . 1 . . 455 . . 27 THR HG23 . 26963 1 358 . 1 1 48 48 THR CA C 13 60.772 0.095 . 1 . . 457 . . 27 THR CA . 26963 1 359 . 1 1 48 48 THR CB C 13 71.411 0.15 . 1 . . 456 . . 27 THR CB . 26963 1 360 . 1 1 48 48 THR CG2 C 13 21.528 0.007 . 1 . . 454 . . 27 THR CG2 . 26963 1 361 . 1 1 48 48 THR N N 15 122.609 0.042 . 1 . . 453 . . 27 THR N . 26963 1 362 . 1 1 49 49 LEU H H 1 8.804 0.004 . 1 . . 429 . . 28 LEU H . 26963 1 363 . 1 1 49 49 LEU HA H 1 4.797 0.005 . 1 . . 424 . . 28 LEU HA . 26963 1 364 . 1 1 49 49 LEU HB2 H 1 0.669 0.006 . 1 . . 433 . . 28 LEU HB2 . 26963 1 365 . 1 1 49 49 LEU HB3 H 1 0.669 0.006 . 1 . . 434 . . 28 LEU HB3 . 26963 1 366 . 1 1 49 49 LEU HG H 1 0.623 0.008 . 1 . . 426 . . 28 LEU HG . 26963 1 367 . 1 1 49 49 LEU HD11 H 1 0.040 0.002 . 2 . . 430 . . 28 LEU HD11 . 26963 1 368 . 1 1 49 49 LEU HD12 H 1 0.040 0.002 . 2 . . 430 . . 28 LEU HD12 . 26963 1 369 . 1 1 49 49 LEU HD13 H 1 0.040 0.002 . 2 . . 430 . . 28 LEU HD13 . 26963 1 370 . 1 1 49 49 LEU HD21 H 1 -1.109 0.003 . 2 . . 431 . . 28 LEU HD21 . 26963 1 371 . 1 1 49 49 LEU HD22 H 1 -1.109 0.003 . 2 . . 431 . . 28 LEU HD22 . 26963 1 372 . 1 1 49 49 LEU HD23 H 1 -1.109 0.003 . 2 . . 431 . . 28 LEU HD23 . 26963 1 373 . 1 1 49 49 LEU CA C 13 50.952 0.047 . 1 . . 428 . . 28 LEU CA . 26963 1 374 . 1 1 49 49 LEU CB C 13 43.907 0.035 . 1 . . 427 . . 28 LEU CB . 26963 1 375 . 1 1 49 49 LEU CG C 13 25.961 0.024 . 1 . . 432 . . 28 LEU CG . 26963 1 376 . 1 1 49 49 LEU CD1 C 13 22.472 0.3 . 2 . . 425 . . 28 LEU CD1 . 26963 1 377 . 1 1 49 49 LEU CD2 C 13 23.681 0.016 . 2 . . 871 . . 28 LEU CD2 . 26963 1 378 . 1 1 49 49 LEU N N 15 125.297 0.012 . 1 . . 423 . . 28 LEU N . 26963 1 379 . 1 1 50 50 PRO HA H 1 4.796 0.006 . 1 . . 927 . . 29 PRO HA . 26963 1 380 . 1 1 50 50 PRO HB2 H 1 2.381 0.005 . 2 . . 931 . . 29 PRO HB2 . 26963 1 381 . 1 1 50 50 PRO HB3 H 1 1.960 0.009 . 2 . . 932 . . 29 PRO HB3 . 26963 1 382 . 1 1 50 50 PRO HG2 H 1 2.191 0.004 . 2 . . 929 . . 29 PRO HG2 . 26963 1 383 . 1 1 50 50 PRO HG3 H 1 2.056 0.005 . 2 . . 930 . . 29 PRO HG3 . 26963 1 384 . 1 1 50 50 PRO HD2 H 1 3.893 0.01 . 2 . . 917 . . 29 PRO HD2 . 26963 1 385 . 1 1 50 50 PRO HD3 H 1 3.555 0.003 . 2 . . 919 . . 29 PRO HD3 . 26963 1 386 . 1 1 50 50 PRO CA C 13 62.826 0.023 . 1 . . 646 . . 29 PRO CA . 26963 1 387 . 1 1 50 50 PRO CB C 13 32.282 0.08 . 1 . . 647 . . 29 PRO CB . 26963 1 388 . 1 1 50 50 PRO CG C 13 27.481 0.056 . 1 . . 928 . . 29 PRO CG . 26963 1 389 . 1 1 50 50 PRO CD C 13 50.616 0.041 . 1 . . 918 . . 29 PRO CD . 26963 1 390 . 1 1 51 51 SER H H 1 8.449 0.004 . 1 . . 1074 . . 30 SER H . 26963 1 391 . 1 1 51 51 SER HA H 1 4.726 0.03 . 1 . . 1071 . . 30 SER HA . 26963 1 392 . 1 1 51 51 SER HB2 H 1 4.018 0.03 . 2 . . 1072 . . 30 SER HB2 . 26963 1 393 . 1 1 51 51 SER HB3 H 1 4.065 0.03 . 2 . . 1073 . . 30 SER HB3 . 26963 1 394 . 1 1 51 51 SER CA C 13 57.839 0.077 . 1 . . 1070 . . 30 SER CA . 26963 1 395 . 1 1 51 51 SER CB C 13 66.484 0.3 . 1 . . 1092 . . 30 SER CB . 26963 1 396 . 1 1 51 51 SER N N 15 117.030 0.045 . 1 . . 1075 . . 30 SER N . 26963 1 397 . 1 1 52 52 ASN HA H 1 5.321 0.006 . 1 . . 1006 . . 31 ASN HA . 26963 1 398 . 1 1 52 52 ASN HB2 H 1 3.150 0.005 . 2 . . 1007 . . 31 ASN HB2 . 26963 1 399 . 1 1 52 52 ASN HB3 H 1 2.820 0.004 . 2 . . 1010 . . 31 ASN HB3 . 26963 1 400 . 1 1 52 52 ASN CA C 13 50.335 0.013 . 1 . . 1008 . . 31 ASN CA . 26963 1 401 . 1 1 52 52 ASN CB C 13 39.143 0.015 . 1 . . 1011 . . 31 ASN CB . 26963 1 402 . 1 1 53 53 PRO HA H 1 4.563 0.002 . 1 . . 353 . . 32 PRO HA . 26963 1 403 . 1 1 53 53 PRO HB2 H 1 2.235 0.007 . 2 . . 359 . . 32 PRO HB2 . 26963 1 404 . 1 1 53 53 PRO HB3 H 1 1.941 0.007 . 2 . . 360 . . 32 PRO HB3 . 26963 1 405 . 1 1 53 53 PRO HG2 H 1 1.670 0.012 . 2 . . 354 . . 32 PRO HG2 . 26963 1 406 . 1 1 53 53 PRO HG3 H 1 1.585 0.008 . 2 . . 355 . . 32 PRO HG3 . 26963 1 407 . 1 1 53 53 PRO HD2 H 1 3.899 0.007 . 2 . . 351 . . 32 PRO HD2 . 26963 1 408 . 1 1 53 53 PRO HD3 H 1 3.600 0.008 . 2 . . 352 . . 32 PRO HD3 . 26963 1 409 . 1 1 53 53 PRO CA C 13 64.807 0.014 . 1 . . 357 . . 32 PRO CA . 26963 1 410 . 1 1 53 53 PRO CB C 13 32.173 0.034 . 1 . . 356 . . 32 PRO CB . 26963 1 411 . 1 1 53 53 PRO CG C 13 26.664 0.047 . 1 . . 358 . . 32 PRO CG . 26963 1 412 . 1 1 53 53 PRO CD C 13 51.245 0.086 . 1 . . 350 . . 32 PRO CD . 26963 1 413 . 1 1 54 54 THR HA H 1 4.211 0.001 . 1 . . 505 . . 33 THR HA . 26963 1 414 . 1 1 54 54 THR HB H 1 4.302 0.001 . 1 . . 506 . . 33 THR HB . 26963 1 415 . 1 1 54 54 THR HG21 H 1 1.288 0.002 . 1 . . 502 . . 33 THR HG21 . 26963 1 416 . 1 1 54 54 THR HG22 H 1 1.288 0.002 . 1 . . 502 . . 33 THR HG22 . 26963 1 417 . 1 1 54 54 THR HG23 H 1 1.288 0.002 . 1 . . 502 . . 33 THR HG23 . 26963 1 418 . 1 1 54 54 THR CA C 13 64.647 0.05 . 1 . . 503 . . 33 THR CA . 26963 1 419 . 1 1 54 54 THR CB C 13 69.009 0.106 . 1 . . 504 . . 33 THR CB . 26963 1 420 . 1 1 54 54 THR CG2 C 13 21.804 0.011 . 1 . . 501 . . 33 THR CG2 . 26963 1 421 . 1 1 55 55 THR H H 1 7.678 0.007 . 1 . . 633 . . 34 THR H . 26963 1 422 . 1 1 55 55 THR HA H 1 4.393 0.002 . 1 . . 635 . . 34 THR HA . 26963 1 423 . 1 1 55 55 THR HB H 1 4.539 0.008 . 1 . . 636 . . 34 THR HB . 26963 1 424 . 1 1 55 55 THR HG21 H 1 1.307 0.003 . 1 . . 632 . . 34 THR HG21 . 26963 1 425 . 1 1 55 55 THR HG22 H 1 1.307 0.003 . 1 . . 632 . . 34 THR HG22 . 26963 1 426 . 1 1 55 55 THR HG23 H 1 1.307 0.003 . 1 . . 632 . . 34 THR HG23 . 26963 1 427 . 1 1 55 55 THR CA C 13 62.724 0.072 . 1 . . 748 . . 34 THR CA . 26963 1 428 . 1 1 55 55 THR CB C 13 70.862 0.14 . 1 . . 634 . . 34 THR CB . 26963 1 429 . 1 1 55 55 THR CG2 C 13 21.459 0.048 . 1 . . 631 . . 34 THR CG2 . 26963 1 430 . 1 1 55 55 THR N N 15 109.957 0.046 . 1 . . 630 . . 34 THR N . 26963 1 431 . 1 1 56 56 GLY H H 1 7.891 0.003 . 1 . . 53 . . 35 GLY H . 26963 1 432 . 1 1 56 56 GLY HA2 H 1 4.246 0.03 . 2 . . 51 . . 35 GLY HA2 . 26963 1 433 . 1 1 56 56 GLY HA3 H 1 3.715 0.03 . 2 . . 52 . . 35 GLY HA3 . 26963 1 434 . 1 1 56 56 GLY CA C 13 45.376 0.062 . 1 . . 50 . . 35 GLY CA . 26963 1 435 . 1 1 56 56 GLY N N 15 109.410 0.056 . 1 . . 49 . . 35 GLY N . 26963 1 436 . 1 1 57 57 PHE H H 1 7.343 0.003 . 1 . . 749 . . 36 PHE H . 26963 1 437 . 1 1 57 57 PHE HA H 1 3.487 0.002 . 1 . . 135 . . 36 PHE HA . 26963 1 438 . 1 1 57 57 PHE HB2 H 1 0.709 0.001 . 2 . . 141 . . 36 PHE HB2 . 26963 1 439 . 1 1 57 57 PHE HB3 H 1 2.258 0.03 . 2 . . 142 . . 36 PHE HB3 . 26963 1 440 . 1 1 57 57 PHE HD1 H 1 6.483 0.003 . 1 . . 136 . . 36 PHE HD1 . 26963 1 441 . 1 1 57 57 PHE HD2 H 1 6.483 0.003 . 1 . . 136 . . 36 PHE HD2 . 26963 1 442 . 1 1 57 57 PHE HE1 H 1 7.218 0.03 . 1 . . 137 . . 36 PHE HE1 . 26963 1 443 . 1 1 57 57 PHE HE2 H 1 7.218 0.03 . 1 . . 137 . . 36 PHE HE2 . 26963 1 444 . 1 1 57 57 PHE HZ H 1 6.653 0.03 . 1 . . 1102 . . 36 PHE HZ . 26963 1 445 . 1 1 57 57 PHE CA C 13 58.315 0.154 . 1 . . 140 . . 36 PHE CA . 26963 1 446 . 1 1 57 57 PHE CB C 13 39.177 0.138 . 1 . . 138 . . 36 PHE CB . 26963 1 447 . 1 1 57 57 PHE CD1 C 13 131.153 0.3 . 1 . . 139 . . 36 PHE CD1 . 26963 1 448 . 1 1 57 57 PHE CD2 C 13 131.153 0.3 . 1 . . 139 . . 36 PHE CD2 . 26963 1 449 . 1 1 57 57 PHE CE1 C 13 131.368 0.3 . 1 . . 143 . . 36 PHE CE1 . 26963 1 450 . 1 1 57 57 PHE CE2 C 13 131.368 0.3 . 1 . . 143 . . 36 PHE CE2 . 26963 1 451 . 1 1 57 57 PHE N N 15 118.883 0.041 . 1 . . 750 . . 36 PHE N . 26963 1 452 . 1 1 58 58 ARG H H 1 8.137 0.005 . 1 . . 482 . . 37 ARG H . 26963 1 453 . 1 1 58 58 ARG HA H 1 4.592 0.009 . 1 . . 481 . . 37 ARG HA . 26963 1 454 . 1 1 58 58 ARG HB2 H 1 1.892 0.012 . 1 . . 850 . . 37 ARG HB2 . 26963 1 455 . 1 1 58 58 ARG HG2 H 1 1.583 0.002 . 2 . . 851 . . 37 ARG HG2 . 26963 1 456 . 1 1 58 58 ARG HG3 H 1 1.582 0.002 . 2 . . 852 . . 37 ARG HG3 . 26963 1 457 . 1 1 58 58 ARG HD2 H 1 3.260 0.009 . 2 . . 848 . . 37 ARG HD2 . 26963 1 458 . 1 1 58 58 ARG HD3 H 1 3.152 0.01 . 2 . . 849 . . 37 ARG HD3 . 26963 1 459 . 1 1 58 58 ARG CA C 13 54.370 0.06 . 1 . . 483 . . 37 ARG CA . 26963 1 460 . 1 1 58 58 ARG CB C 13 33.738 0.053 . 1 . . 484 . . 37 ARG CB . 26963 1 461 . 1 1 58 58 ARG CG C 13 26.420 0.143 . 1 . . 485 . . 37 ARG CG . 26963 1 462 . 1 1 58 58 ARG CD C 13 43.336 0.038 . 1 . . 480 . . 37 ARG CD . 26963 1 463 . 1 1 58 58 ARG N N 15 118.444 0.008 . 1 . . 479 . . 37 ARG N . 26963 1 464 . 1 1 59 59 TRP H H 1 9.146 0.005 . 1 . . 713 . . 38 TRP H . 26963 1 465 . 1 1 59 59 TRP HA H 1 5.388 0.008 . 1 . . 710 . . 38 TRP HA . 26963 1 466 . 1 1 59 59 TRP HB2 H 1 3.125 0.013 . 2 . . 714 . . 38 TRP HB2 . 26963 1 467 . 1 1 59 59 TRP HB3 H 1 3.483 0.003 . 2 . . 715 . . 38 TRP HB3 . 26963 1 468 . 1 1 59 59 TRP HD1 H 1 7.401 0.012 . 1 . . 969 . . 38 TRP HD1 . 26963 1 469 . 1 1 59 59 TRP HE1 H 1 10.061 0.03 . 1 . . 787 . . 38 TRP HE1 . 26963 1 470 . 1 1 59 59 TRP HZ2 H 1 7.019 0.03 . 1 . . 965 . . 38 TRP HZ2 . 26963 1 471 . 1 1 59 59 TRP HH2 H 1 6.815 0.03 . 1 . . 960 . . 38 TRP HH2 . 26963 1 472 . 1 1 59 59 TRP CA C 13 57.823 0.085 . 1 . . 712 . . 38 TRP CA . 26963 1 473 . 1 1 59 59 TRP CB C 13 31.803 0.174 . 1 . . 711 . . 38 TRP CB . 26963 1 474 . 1 1 59 59 TRP CD1 C 13 126.890 0.3 . 1 . . 968 . . 38 TRP CD1 . 26963 1 475 . 1 1 59 59 TRP CZ2 C 13 115.007 0.3 . 1 . . 956 . . 38 TRP CZ2 . 26963 1 476 . 1 1 59 59 TRP CH2 C 13 124.222 0.3 . 1 . . 959 . . 38 TRP CH2 . 26963 1 477 . 1 1 59 59 TRP N N 15 122.039 0.014 . 1 . . 709 . . 38 TRP N . 26963 1 478 . 1 1 59 59 TRP NE1 N 15 131.267 0.3 . 1 . . 788 . . 38 TRP NE1 . 26963 1 479 . 1 1 60 60 GLU H H 1 9.789 0.007 . 1 . . 147 . . 39 GLU H . 26963 1 480 . 1 1 60 60 GLU CA C 13 54.731 0.111 . 1 . . 146 . . 39 GLU CA . 26963 1 481 . 1 1 60 60 GLU CB C 13 32.408 0.3 . 1 . . 145 . . 39 GLU CB . 26963 1 482 . 1 1 60 60 GLU N N 15 122.279 0.029 . 1 . . 144 . . 39 GLU N . 26963 1 483 . 1 1 61 61 LEU H H 1 9.052 0.006 . 1 . . 752 . . 40 LEU H . 26963 1 484 . 1 1 61 61 LEU HA H 1 4.304 0.005 . 1 . . 655 . . 40 LEU HA . 26963 1 485 . 1 1 61 61 LEU HB2 H 1 1.788 0.002 . 2 . . 664 . . 40 LEU HB2 . 26963 1 486 . 1 1 61 61 LEU HB3 H 1 1.264 0.006 . 2 . . 1065 . . 40 LEU HB3 . 26963 1 487 . 1 1 61 61 LEU HG H 1 1.302 0.005 . 1 . . 658 . . 40 LEU HG . 26963 1 488 . 1 1 61 61 LEU HD11 H 1 0.762 0.003 . 2 . . 661 . . 40 LEU HD11 . 26963 1 489 . 1 1 61 61 LEU HD12 H 1 0.762 0.003 . 2 . . 661 . . 40 LEU HD12 . 26963 1 490 . 1 1 61 61 LEU HD13 H 1 0.762 0.003 . 2 . . 661 . . 40 LEU HD13 . 26963 1 491 . 1 1 61 61 LEU HD21 H 1 0.601 0.002 . 2 . . 662 . . 40 LEU HD21 . 26963 1 492 . 1 1 61 61 LEU HD22 H 1 0.601 0.002 . 2 . . 662 . . 40 LEU HD22 . 26963 1 493 . 1 1 61 61 LEU HD23 H 1 0.601 0.002 . 2 . . 662 . . 40 LEU HD23 . 26963 1 494 . 1 1 61 61 LEU CA C 13 54.784 0.101 . 1 . . 659 . . 40 LEU CA . 26963 1 495 . 1 1 61 61 LEU CB C 13 41.230 0.105 . 1 . . 660 . . 40 LEU CB . 26963 1 496 . 1 1 61 61 LEU CG C 13 27.155 0.053 . 1 . . 663 . . 40 LEU CG . 26963 1 497 . 1 1 61 61 LEU CD1 C 13 25.954 0.047 . 2 . . 657 . . 40 LEU CD1 . 26963 1 498 . 1 1 61 61 LEU CD2 C 13 24.041 0.024 . 2 . . 656 . . 40 LEU CD2 . 26963 1 499 . 1 1 61 61 LEU N N 15 126.981 0.114 . 1 . . 751 . . 40 LEU N . 26963 1 500 . 1 1 62 62 ARG H H 1 8.317 0.007 . 1 . . 527 . . 41 ARG H . 26963 1 501 . 1 1 62 62 ARG HA H 1 4.358 0.003 . 1 . . 853 . . 41 ARG HA . 26963 1 502 . 1 1 62 62 ARG HB2 H 1 1.686 0.03 . 2 . . 991 . . 41 ARG HB2 . 26963 1 503 . 1 1 62 62 ARG HB3 H 1 1.682 0.003 . 2 . . 992 . . 41 ARG HB3 . 26963 1 504 . 1 1 62 62 ARG HG2 H 1 1.581 0.007 . 2 . . 993 . . 41 ARG HG2 . 26963 1 505 . 1 1 62 62 ARG HG3 H 1 1.716 0.003 . 2 . . 994 . . 41 ARG HG3 . 26963 1 506 . 1 1 62 62 ARG HD2 H 1 3.146 0.007 . 1 . . 989 . . 41 ARG HD2 . 26963 1 507 . 1 1 62 62 ARG HD3 H 1 3.146 0.007 . 1 . . 990 . . 41 ARG HD3 . 26963 1 508 . 1 1 62 62 ARG CA C 13 57.352 0.054 . 1 . . 528 . . 41 ARG CA . 26963 1 509 . 1 1 62 62 ARG CB C 13 31.287 0.149 . 1 . . 529 . . 41 ARG CB . 26963 1 510 . 1 1 62 62 ARG CG C 13 27.169 0.015 . 1 . . 530 . . 41 ARG CG . 26963 1 511 . 1 1 62 62 ARG CD C 13 43.199 0.3 . 1 . . 525 . . 41 ARG CD . 26963 1 512 . 1 1 62 62 ARG N N 15 128.507 0.027 . 1 . . 526 . . 41 ARG N . 26963 1 513 . 1 1 63 63 ASN H H 1 8.388 0.002 . 1 . . 625 . . 42 ASN H . 26963 1 514 . 1 1 63 63 ASN HA H 1 5.297 0.004 . 1 . . 624 . . 42 ASN HA . 26963 1 515 . 1 1 63 63 ASN HB2 H 1 3.112 0.01 . 2 . . 628 . . 42 ASN HB2 . 26963 1 516 . 1 1 63 63 ASN HB3 H 1 2.668 0.002 . 2 . . 629 . . 42 ASN HB3 . 26963 1 517 . 1 1 63 63 ASN HD21 H 1 7.642 0.03 . 1 . . 1032 . . 42 ASN HD21 . 26963 1 518 . 1 1 63 63 ASN HD22 H 1 7.136 0.03 . 1 . . 1033 . . 42 ASN HD22 . 26963 1 519 . 1 1 63 63 ASN CA C 13 50.065 0.078 . 1 . . 626 . . 42 ASN CA . 26963 1 520 . 1 1 63 63 ASN CB C 13 41.257 0.003 . 1 . . 627 . . 42 ASN CB . 26963 1 521 . 1 1 63 63 ASN N N 15 115.209 0.006 . 1 . . 623 . . 42 ASN N . 26963 1 522 . 1 1 63 63 ASN ND2 N 15 111.049 0.003 . 1 . . 1031 . . 42 ASN ND2 . 26963 1 523 . 1 1 64 64 PRO HA H 1 4.395 0.002 . 1 . . 1091 . . 43 PRO HA . 26963 1 524 . 1 1 64 64 PRO HB2 H 1 2.380 0.006 . 2 . . 1094 . . 43 PRO HB2 . 26963 1 525 . 1 1 64 64 PRO HB3 H 1 1.938 0.006 . 2 . . 1095 . . 43 PRO HB3 . 26963 1 526 . 1 1 64 64 PRO HG2 H 1 1.787 0.013 . 2 . . 1096 . . 43 PRO HG2 . 26963 1 527 . 1 1 64 64 PRO HG3 H 1 2.158 0.01 . 2 . . 1097 . . 43 PRO HG3 . 26963 1 528 . 1 1 64 64 PRO HD2 H 1 4.047 0.008 . 2 . . 1009 . . 43 PRO HD2 . 26963 1 529 . 1 1 64 64 PRO HD3 H 1 3.569 0.008 . 2 . . 1087 . . 43 PRO HD3 . 26963 1 530 . 1 1 64 64 PRO CA C 13 62.573 0.04 . 1 . . 466 . . 43 PRO CA . 26963 1 531 . 1 1 64 64 PRO CB C 13 31.177 0.172 . 1 . . 1093 . . 43 PRO CB . 26963 1 532 . 1 1 64 64 PRO CG C 13 26.532 0.028 . 1 . . 1098 . . 43 PRO CG . 26963 1 533 . 1 1 64 64 PRO CD C 13 50.534 0.026 . 1 . . 465 . . 43 PRO CD . 26963 1 534 . 1 1 65 65 ALA H H 1 8.215 0.004 . 1 . . 550 . . 44 ALA H . 26963 1 535 . 1 1 65 65 ALA HA H 1 3.822 0.002 . 1 . . 549 . . 44 ALA HA . 26963 1 536 . 1 1 65 65 ALA HB1 H 1 0.784 0.03 . 1 . . 553 . . 44 ALA HB1 . 26963 1 537 . 1 1 65 65 ALA HB2 H 1 0.784 0.03 . 1 . . 553 . . 44 ALA HB2 . 26963 1 538 . 1 1 65 65 ALA HB3 H 1 0.784 0.03 . 1 . . 553 . . 44 ALA HB3 . 26963 1 539 . 1 1 65 65 ALA CA C 13 52.778 0.209 . 1 . . 551 . . 44 ALA CA . 26963 1 540 . 1 1 65 65 ALA CB C 13 15.852 0.065 . 1 . . 552 . . 44 ALA CB . 26963 1 541 . 1 1 65 65 ALA N N 15 124.234 0.022 . 1 . . 548 . . 44 ALA N . 26963 1 542 . 1 1 66 66 ALA H H 1 8.248 0.003 . 1 . . 696 . . 45 ALA H . 26963 1 543 . 1 1 66 66 ALA HA H 1 4.375 0.003 . 1 . . 693 . . 45 ALA HA . 26963 1 544 . 1 1 66 66 ALA HB1 H 1 1.455 0.03 . 1 . . 697 . . 45 ALA HB1 . 26963 1 545 . 1 1 66 66 ALA HB2 H 1 1.455 0.03 . 1 . . 697 . . 45 ALA HB2 . 26963 1 546 . 1 1 66 66 ALA HB3 H 1 1.455 0.03 . 1 . . 697 . . 45 ALA HB3 . 26963 1 547 . 1 1 66 66 ALA CA C 13 54.082 0.063 . 1 . . 695 . . 45 ALA CA . 26963 1 548 . 1 1 66 66 ALA CB C 13 19.209 0.09 . 1 . . 694 . . 45 ALA CB . 26963 1 549 . 1 1 66 66 ALA N N 15 117.262 0.04 . 1 . . 692 . . 45 ALA N . 26963 1 550 . 1 1 67 67 SER H H 1 8.298 0.006 . 1 . . 614 . . 46 SER H . 26963 1 551 . 1 1 67 67 SER HA H 1 4.278 0.001 . 1 . . 611 . . 46 SER HA . 26963 1 552 . 1 1 67 67 SER HB2 H 1 3.877 0.003 . 1 . . 615 . . 46 SER HB2 . 26963 1 553 . 1 1 67 67 SER HB3 H 1 3.877 0.003 . 1 . . 616 . . 46 SER HB3 . 26963 1 554 . 1 1 67 67 SER CA C 13 61.373 0.022 . 1 . . 613 . . 46 SER CA . 26963 1 555 . 1 1 67 67 SER CB C 13 62.648 0.144 . 1 . . 612 . . 46 SER CB . 26963 1 556 . 1 1 67 67 SER N N 15 112.605 0.011 . 1 . . 610 . . 46 SER N . 26963 1 557 . 1 1 68 68 VAL H H 1 7.295 0.002 . 1 . . 322 . . 47 VAL H . 26963 1 558 . 1 1 68 68 VAL HA H 1 4.672 0.001 . 1 . . 317 . . 47 VAL HA . 26963 1 559 . 1 1 68 68 VAL HB H 1 2.445 0.003 . 1 . . 323 . . 47 VAL HB . 26963 1 560 . 1 1 68 68 VAL HG11 H 1 0.420 0.001 . 1 . . 324 . . 47 VAL HG11 . 26963 1 561 . 1 1 68 68 VAL HG12 H 1 0.420 0.001 . 1 . . 324 . . 47 VAL HG12 . 26963 1 562 . 1 1 68 68 VAL HG13 H 1 0.420 0.001 . 1 . . 324 . . 47 VAL HG13 . 26963 1 563 . 1 1 68 68 VAL HG21 H 1 0.531 0.001 . 1 . . 325 . . 47 VAL HG21 . 26963 1 564 . 1 1 68 68 VAL HG22 H 1 0.531 0.001 . 1 . . 325 . . 47 VAL HG22 . 26963 1 565 . 1 1 68 68 VAL HG23 H 1 0.531 0.001 . 1 . . 325 . . 47 VAL HG23 . 26963 1 566 . 1 1 68 68 VAL CA C 13 61.391 0.035 . 1 . . 321 . . 47 VAL CA . 26963 1 567 . 1 1 68 68 VAL CB C 13 34.150 0.028 . 1 . . 320 . . 47 VAL CB . 26963 1 568 . 1 1 68 68 VAL CG1 C 13 20.910 0.028 . 1 . . 319 . . 47 VAL CG1 . 26963 1 569 . 1 1 68 68 VAL CG2 C 13 18.472 0.048 . 1 . . 318 . . 47 VAL CG2 . 26963 1 570 . 1 1 68 68 VAL N N 15 110.235 0.048 . 1 . . 316 . . 47 VAL N . 26963 1 571 . 1 1 69 69 LEU H H 1 8.309 0.006 . 1 . . 231 . . 48 LEU H . 26963 1 572 . 1 1 69 69 LEU HA H 1 5.232 0.002 . 1 . . 225 . . 48 LEU HA . 26963 1 573 . 1 1 69 69 LEU HB2 H 1 1.871 0.003 . 2 . . 235 . . 48 LEU HB2 . 26963 1 574 . 1 1 69 69 LEU HB3 H 1 1.057 0.006 . 2 . . 236 . . 48 LEU HB3 . 26963 1 575 . 1 1 69 69 LEU HG H 1 1.588 0.006 . 1 . . 228 . . 48 LEU HG . 26963 1 576 . 1 1 69 69 LEU HD11 H 1 -0.124 0.003 . 2 . . 232 . . 48 LEU HD11 . 26963 1 577 . 1 1 69 69 LEU HD12 H 1 -0.124 0.003 . 2 . . 232 . . 48 LEU HD12 . 26963 1 578 . 1 1 69 69 LEU HD13 H 1 -0.124 0.003 . 2 . . 232 . . 48 LEU HD13 . 26963 1 579 . 1 1 69 69 LEU HD21 H 1 0.534 0.003 . 2 . . 233 . . 48 LEU HD21 . 26963 1 580 . 1 1 69 69 LEU HD22 H 1 0.534 0.003 . 2 . . 233 . . 48 LEU HD22 . 26963 1 581 . 1 1 69 69 LEU HD23 H 1 0.534 0.003 . 2 . . 233 . . 48 LEU HD23 . 26963 1 582 . 1 1 69 69 LEU CA C 13 53.405 0.221 . 1 . . 230 . . 48 LEU CA . 26963 1 583 . 1 1 69 69 LEU CB C 13 43.817 0.078 . 1 . . 229 . . 48 LEU CB . 26963 1 584 . 1 1 69 69 LEU CG C 13 26.479 0.065 . 1 . . 234 . . 48 LEU CG . 26963 1 585 . 1 1 69 69 LEU CD1 C 13 25.226 0.058 . 2 . . 227 . . 48 LEU CD1 . 26963 1 586 . 1 1 69 69 LEU CD2 C 13 23.092 0.104 . 2 . . 226 . . 48 LEU CD2 . 26963 1 587 . 1 1 69 69 LEU N N 15 119.103 0.006 . 1 . . 224 . . 48 LEU N . 26963 1 588 . 1 1 70 70 LYS H H 1 9.306 0.008 . 1 . . 165 . . 49 LYS H . 26963 1 589 . 1 1 70 70 LYS HA H 1 4.785 0.003 . 1 . . 169 . . 49 LYS HA . 26963 1 590 . 1 1 70 70 LYS HB2 H 1 1.831 0.006 . 2 . . 170 . . 49 LYS HB2 . 26963 1 591 . 1 1 70 70 LYS HB3 H 1 1.658 0.006 . 2 . . 171 . . 49 LYS HB3 . 26963 1 592 . 1 1 70 70 LYS HG2 H 1 1.652 0.009 . 2 . . 163 . . 49 LYS HG2 . 26963 1 593 . 1 1 70 70 LYS HG3 H 1 1.650 0.01 . 2 . . 164 . . 49 LYS HG3 . 26963 1 594 . 1 1 70 70 LYS HD2 H 1 1.369 0.017 . 2 . . 160 . . 49 LYS HD2 . 26963 1 595 . 1 1 70 70 LYS HD3 H 1 1.394 0.008 . 2 . . 161 . . 49 LYS HD3 . 26963 1 596 . 1 1 70 70 LYS HE2 H 1 2.938 0.002 . 1 . . 162 . . 49 LYS HE2 . 26963 1 597 . 1 1 70 70 LYS HE3 H 1 2.938 0.002 . 1 . . 883 . . 49 LYS HE3 . 26963 1 598 . 1 1 70 70 LYS CA C 13 54.258 0.031 . 1 . . 166 . . 49 LYS CA . 26963 1 599 . 1 1 70 70 LYS CB C 13 35.394 0.145 . 1 . . 167 . . 49 LYS CB . 26963 1 600 . 1 1 70 70 LYS CG C 13 29.193 0.049 . 1 . . 168 . . 49 LYS CG . 26963 1 601 . 1 1 70 70 LYS CD C 13 24.854 0.05 . 1 . . 158 . . 49 LYS CD . 26963 1 602 . 1 1 70 70 LYS CE C 13 42.187 0.009 . 1 . . 172 . . 49 LYS CE . 26963 1 603 . 1 1 70 70 LYS N N 15 123.412 0.052 . 1 . . 159 . . 49 LYS N . 26963 1 604 . 1 1 71 71 ARG H H 1 9.198 0.006 . 1 . . 268 . . 50 ARG H . 26963 1 605 . 1 1 71 71 ARG HA H 1 4.159 0.006 . 1 . . 265 . . 50 ARG HA . 26963 1 606 . 1 1 71 71 ARG HB2 H 1 1.891 0.048 . 2 . . 272 . . 50 ARG HB2 . 26963 1 607 . 1 1 71 71 ARG HB3 H 1 1.939 0.03 . 2 . . 273 . . 50 ARG HB3 . 26963 1 608 . 1 1 71 71 ARG HG2 H 1 1.928 0.002 . 2 . . 266 . . 50 ARG HG2 . 26963 1 609 . 1 1 71 71 ARG HG3 H 1 1.689 0.006 . 2 . . 267 . . 50 ARG HG3 . 26963 1 610 . 1 1 71 71 ARG HD2 H 1 3.161 0.03 . 1 . . 263 . . 50 ARG HD2 . 26963 1 611 . 1 1 71 71 ARG HD3 H 1 3.161 0.03 . 1 . . 264 . . 50 ARG HD3 . 26963 1 612 . 1 1 71 71 ARG CA C 13 57.851 0.052 . 1 . . 269 . . 50 ARG CA . 26963 1 613 . 1 1 71 71 ARG CB C 13 30.667 0.009 . 1 . . 270 . . 50 ARG CB . 26963 1 614 . 1 1 71 71 ARG CG C 13 27.325 0.096 . 1 . . 271 . . 50 ARG CG . 26963 1 615 . 1 1 71 71 ARG CD C 13 43.465 0.3 . 1 . . 262 . . 50 ARG CD . 26963 1 616 . 1 1 71 71 ARG N N 15 126.270 0.017 . 1 . . 261 . . 50 ARG N . 26963 1 617 . 1 1 72 72 LEU H H 1 8.169 0.004 . 1 . . 753 . . 51 LEU H . 26963 1 618 . 1 1 72 72 LEU HA H 1 4.561 0.002 . 1 . . 872 . . 51 LEU HA . 26963 1 619 . 1 1 72 72 LEU HB2 H 1 1.358 0.014 . 1 . . 873 . . 51 LEU HB2 . 26963 1 620 . 1 1 72 72 LEU HB3 H 1 1.358 0.014 . 1 . . 874 . . 51 LEU HB3 . 26963 1 621 . 1 1 72 72 LEU HG H 1 1.465 0.006 . 1 . . 876 . . 51 LEU HG . 26963 1 622 . 1 1 72 72 LEU HD11 H 1 0.707 0.001 . 2 . . 878 . . 51 LEU HD11 . 26963 1 623 . 1 1 72 72 LEU HD12 H 1 0.707 0.001 . 2 . . 878 . . 51 LEU HD12 . 26963 1 624 . 1 1 72 72 LEU HD13 H 1 0.707 0.001 . 2 . . 878 . . 51 LEU HD13 . 26963 1 625 . 1 1 72 72 LEU HD21 H 1 0.763 0.001 . 2 . . 880 . . 51 LEU HD21 . 26963 1 626 . 1 1 72 72 LEU HD22 H 1 0.763 0.001 . 2 . . 880 . . 51 LEU HD22 . 26963 1 627 . 1 1 72 72 LEU HD23 H 1 0.763 0.001 . 2 . . 880 . . 51 LEU HD23 . 26963 1 628 . 1 1 72 72 LEU CA C 13 53.508 0.058 . 1 . . 756 . . 51 LEU CA . 26963 1 629 . 1 1 72 72 LEU CB C 13 41.953 0.027 . 1 . . 755 . . 51 LEU CB . 26963 1 630 . 1 1 72 72 LEU CG C 13 26.473 0.3 . 1 . . 875 . . 51 LEU CG . 26963 1 631 . 1 1 72 72 LEU CD1 C 13 25.500 0.015 . 2 . . 877 . . 51 LEU CD1 . 26963 1 632 . 1 1 72 72 LEU CD2 C 13 22.552 0.013 . 2 . . 879 . . 51 LEU CD2 . 26963 1 633 . 1 1 72 72 LEU N N 15 124.269 0.025 . 1 . . 754 . . 51 LEU N . 26963 1 634 . 1 1 73 73 GLY H H 1 7.759 0.004 . 1 . . 260 . . 52 GLY H . 26963 1 635 . 1 1 73 73 GLY HA2 H 1 4.206 0.03 . 2 . . 258 . . 52 GLY HA2 . 26963 1 636 . 1 1 73 73 GLY HA3 H 1 3.930 0.03 . 2 . . 259 . . 52 GLY HA3 . 26963 1 637 . 1 1 73 73 GLY CA C 13 44.916 0.001 . 1 . . 257 . . 52 GLY CA . 26963 1 638 . 1 1 73 73 GLY N N 15 108.830 0.107 . 1 . . 256 . . 52 GLY N . 26963 1 639 . 1 1 74 74 PRO HA H 1 4.413 0.007 . 1 . . 706 . . 53 PRO HA . 26963 1 640 . 1 1 74 74 PRO HB2 H 1 2.214 0.006 . 2 . . 923 . . 53 PRO HB2 . 26963 1 641 . 1 1 74 74 PRO HB3 H 1 1.950 0.003 . 2 . . 924 . . 53 PRO HB3 . 26963 1 642 . 1 1 74 74 PRO HG2 H 1 1.944 0.006 . 2 . . 925 . . 53 PRO HG2 . 26963 1 643 . 1 1 74 74 PRO HG3 H 1 1.767 0.004 . 2 . . 926 . . 53 PRO HG3 . 26963 1 644 . 1 1 74 74 PRO HD2 H 1 3.545 0.005 . 2 . . 921 . . 53 PRO HD2 . 26963 1 645 . 1 1 74 74 PRO HD3 H 1 3.464 0.005 . 2 . . 922 . . 53 PRO HD3 . 26963 1 646 . 1 1 74 74 PRO CA C 13 62.600 0.016 . 1 . . 705 . . 53 PRO CA . 26963 1 647 . 1 1 74 74 PRO CB C 13 32.659 0.119 . 1 . . 707 . . 53 PRO CB . 26963 1 648 . 1 1 74 74 PRO CG C 13 26.621 0.065 . 1 . . 708 . . 53 PRO CG . 26963 1 649 . 1 1 74 74 PRO CD C 13 49.601 0.01 . 1 . . 920 . . 53 PRO CD . 26963 1 650 . 1 1 76 76 VAL HA H 1 4.109 0.002 . 1 . . 361 . . 55 VAL HA . 26963 1 651 . 1 1 76 76 VAL HB H 1 1.746 0.002 . 1 . . 365 . . 55 VAL HB . 26963 1 652 . 1 1 76 76 VAL HG11 H 1 0.771 0.01 . 2 . . 366 . . 55 VAL HG11 . 26963 1 653 . 1 1 76 76 VAL HG12 H 1 0.771 0.01 . 2 . . 366 . . 55 VAL HG12 . 26963 1 654 . 1 1 76 76 VAL HG13 H 1 0.771 0.01 . 2 . . 366 . . 55 VAL HG13 . 26963 1 655 . 1 1 76 76 VAL HG21 H 1 0.741 0.007 . 2 . . 367 . . 55 VAL HG21 . 26963 1 656 . 1 1 76 76 VAL HG22 H 1 0.741 0.007 . 2 . . 367 . . 55 VAL HG22 . 26963 1 657 . 1 1 76 76 VAL HG23 H 1 0.741 0.007 . 2 . . 367 . . 55 VAL HG23 . 26963 1 658 . 1 1 76 76 VAL CA C 13 61.562 0.087 . 1 . . 364 . . 55 VAL CA . 26963 1 659 . 1 1 76 76 VAL CB C 13 34.023 0.098 . 1 . . 363 . . 55 VAL CB . 26963 1 660 . 1 1 76 76 VAL CG1 C 13 20.992 0.3 . 2 . . 943 . . 55 VAL CG1 . 26963 1 661 . 1 1 76 76 VAL CG2 C 13 20.990 0.052 . 2 . . 362 . . 55 VAL CG2 . 26963 1 662 . 1 1 77 77 TYR H H 1 8.575 0.006 . 1 . . 251 . . 56 TYR H . 26963 1 663 . 1 1 77 77 TYR HA H 1 5.140 0.008 . 1 . . 248 . . 56 TYR HA . 26963 1 664 . 1 1 77 77 TYR HB2 H 1 2.937 0.007 . 2 . . 254 . . 56 TYR HB2 . 26963 1 665 . 1 1 77 77 TYR HB3 H 1 2.789 0.005 . 2 . . 255 . . 56 TYR HB3 . 26963 1 666 . 1 1 77 77 TYR HD1 H 1 6.982 0.009 . 1 . . 249 . . 56 TYR HD1 . 26963 1 667 . 1 1 77 77 TYR HD2 H 1 6.982 0.009 . 1 . . 249 . . 56 TYR HD2 . 26963 1 668 . 1 1 77 77 TYR HE1 H 1 6.711 0.03 . 1 . . 250 . . 56 TYR HE1 . 26963 1 669 . 1 1 77 77 TYR HE2 H 1 6.711 0.03 . 1 . . 250 . . 56 TYR HE2 . 26963 1 670 . 1 1 77 77 TYR CA C 13 56.963 0.059 . 1 . . 252 . . 56 TYR CA . 26963 1 671 . 1 1 77 77 TYR CB C 13 39.707 0.084 . 1 . . 253 . . 56 TYR CB . 26963 1 672 . 1 1 77 77 TYR CD1 C 13 133.164 0.3 . 1 . . 951 . . 56 TYR CD1 . 26963 1 673 . 1 1 77 77 TYR CD2 C 13 133.164 0.3 . 1 . . 951 . . 56 TYR CD2 . 26963 1 674 . 1 1 77 77 TYR CE1 C 13 118.255 0.3 . 1 . . 957 . . 56 TYR CE1 . 26963 1 675 . 1 1 77 77 TYR CE2 C 13 118.255 0.3 . 1 . . 957 . . 56 TYR CE2 . 26963 1 676 . 1 1 77 77 TYR N N 15 127.547 0.004 . 1 . . 247 . . 56 TYR N . 26963 1 677 . 1 1 79 79 ASN HA H 1 4.695 0.011 . 1 . . 835 . . 58 ASN HA . 26963 1 678 . 1 1 79 79 ASN HB2 H 1 2.840 0.002 . 2 . . 836 . . 58 ASN HB2 . 26963 1 679 . 1 1 79 79 ASN HB3 H 1 2.712 0.001 . 2 . . 837 . . 58 ASN HB3 . 26963 1 680 . 1 1 79 79 ASN HD21 H 1 7.558 0.03 . 1 . . 1035 . . 58 ASN HD21 . 26963 1 681 . 1 1 79 79 ASN HD22 H 1 6.974 0.03 . 1 . . 1036 . . 58 ASN HD22 . 26963 1 682 . 1 1 79 79 ASN CA C 13 52.970 0.078 . 1 . . 783 . . 58 ASN CA . 26963 1 683 . 1 1 79 79 ASN CB C 13 39.343 0.045 . 1 . . 784 . . 58 ASN CB . 26963 1 684 . 1 1 79 79 ASN ND2 N 15 113.083 0.003 . 1 . . 1034 . . 58 ASN ND2 . 26963 1 685 . 1 1 80 80 SER H H 1 8.555 0.004 . 1 . . 785 . . 59 SER H . 26963 1 686 . 1 1 80 80 SER HA H 1 4.394 0.03 . 1 . . 908 . . 59 SER HA . 26963 1 687 . 1 1 80 80 SER HB2 H 1 3.848 0.03 . 1 . . 909 . . 59 SER HB2 . 26963 1 688 . 1 1 80 80 SER HB3 H 1 3.848 0.03 . 1 . . 910 . . 59 SER HB3 . 26963 1 689 . 1 1 80 80 SER CA C 13 58.973 0.155 . 1 . . 758 . . 59 SER CA . 26963 1 690 . 1 1 80 80 SER CB C 13 63.725 0.043 . 1 . . 757 . . 59 SER CB . 26963 1 691 . 1 1 80 80 SER N N 15 117.762 0.033 . 1 . . 786 . . 59 SER N . 26963 1 692 . 1 1 81 81 GLU H H 1 8.477 0.002 . 1 . . 411 . . 60 GLU H . 26963 1 693 . 1 1 81 81 GLU HA H 1 4.235 0.007 . 1 . . 408 . . 60 GLU HA . 26963 1 694 . 1 1 81 81 GLU HB2 H 1 1.911 0.003 . 2 . . 414 . . 60 GLU HB2 . 26963 1 695 . 1 1 81 81 GLU HB3 H 1 2.037 0.019 . 2 . . 415 . . 60 GLU HB3 . 26963 1 696 . 1 1 81 81 GLU HG2 H 1 2.216 0.003 . 2 . . 409 . . 60 GLU HG2 . 26963 1 697 . 1 1 81 81 GLU HG3 H 1 2.220 0.003 . 2 . . 410 . . 60 GLU HG3 . 26963 1 698 . 1 1 81 81 GLU CA C 13 57.092 0.08 . 1 . . 759 . . 60 GLU CA . 26963 1 699 . 1 1 81 81 GLU CB C 13 30.010 0.141 . 1 . . 412 . . 60 GLU CB . 26963 1 700 . 1 1 81 81 GLU CG C 13 36.294 0.056 . 1 . . 413 . . 60 GLU CG . 26963 1 701 . 1 1 81 81 GLU N N 15 122.472 0.022 . 1 . . 407 . . 60 GLU N . 26963 1 702 . 1 1 82 82 GLU H H 1 8.258 0.005 . 1 . . 670 . . 61 GLU H . 26963 1 703 . 1 1 82 82 GLU HA H 1 4.178 0.002 . 1 . . 1040 . . 61 GLU HA . 26963 1 704 . 1 1 82 82 GLU HB2 H 1 2.012 0.004 . 2 . . 1042 . . 61 GLU HB2 . 26963 1 705 . 1 1 82 82 GLU HB3 H 1 1.902 0.03 . 2 . . 1043 . . 61 GLU HB3 . 26963 1 706 . 1 1 82 82 GLU HG2 H 1 2.217 0.03 . 2 . . 1045 . . 61 GLU HG2 . 26963 1 707 . 1 1 82 82 GLU HG3 H 1 2.217 0.03 . 2 . . 1046 . . 61 GLU HG3 . 26963 1 708 . 1 1 82 82 GLU CA C 13 57.236 0.009 . 1 . . 1039 . . 61 GLU CA . 26963 1 709 . 1 1 82 82 GLU CB C 13 30.145 0.081 . 1 . . 1041 . . 61 GLU CB . 26963 1 710 . 1 1 82 82 GLU CG C 13 36.311 0.3 . 1 . . 1044 . . 61 GLU CG . 26963 1 711 . 1 1 82 82 GLU N N 15 120.726 0.007 . 1 . . 669 . . 61 GLU N . 26963 1 712 . 1 1 83 83 ASP H H 1 8.298 0.03 . 1 . . 933 . . 62 ASP H . 26963 1 713 . 1 1 83 83 ASP HA H 1 4.574 0.002 . 1 . . 838 . . 62 ASP HA . 26963 1 714 . 1 1 83 83 ASP HB2 H 1 2.729 0.001 . 2 . . 839 . . 62 ASP HB2 . 26963 1 715 . 1 1 83 83 ASP HB3 H 1 2.615 0.005 . 2 . . 840 . . 62 ASP HB3 . 26963 1 716 . 1 1 83 83 ASP CA C 13 54.717 0.053 . 1 . . 760 . . 62 ASP CA . 26963 1 717 . 1 1 83 83 ASP CB C 13 41.134 0.036 . 1 . . 761 . . 62 ASP CB . 26963 1 718 . 1 1 83 83 ASP N N 15 120.707 0.3 . 1 . . 934 . . 62 ASP N . 26963 1 719 . 1 1 84 84 SER H H 1 8.220 0.003 . 1 . . 585 . . 63 SER H . 26963 1 720 . 1 1 84 84 SER HA H 1 4.386 0.03 . 1 . . 582 . . 63 SER HA . 26963 1 721 . 1 1 84 84 SER HB2 H 1 3.875 0.03 . 1 . . 586 . . 63 SER HB2 . 26963 1 722 . 1 1 84 84 SER HB3 H 1 3.875 0.03 . 1 . . 587 . . 63 SER HB3 . 26963 1 723 . 1 1 84 84 SER CA C 13 58.973 0.081 . 1 . . 584 . . 63 SER CA . 26963 1 724 . 1 1 84 84 SER CB C 13 63.798 0.035 . 1 . . 583 . . 63 SER CB . 26963 1 725 . 1 1 84 84 SER N N 15 116.248 0.045 . 1 . . 581 . . 63 SER N . 26963 1 726 . 1 1 85 85 GLY H H 1 8.387 0.002 . 1 . . 125 . . 64 GLY H . 26963 1 727 . 1 1 85 85 GLY HA2 H 1 3.825 0.03 . 2 . . 869 . . 64 GLY HA2 . 26963 1 728 . 1 1 85 85 GLY HA3 H 1 3.825 0.03 . 2 . . 870 . . 64 GLY HA3 . 26963 1 729 . 1 1 85 85 GLY CA C 13 45.391 0.016 . 1 . . 124 . . 64 GLY CA . 26963 1 730 . 1 1 85 85 GLY N N 15 110.449 0.039 . 1 . . 123 . . 64 GLY N . 26963 1 731 . 1 1 86 86 LEU H H 1 7.923 0.004 . 1 . . 115 . . 65 LEU H . 26963 1 732 . 1 1 86 86 LEU HA H 1 4.382 0.002 . 1 . . 112 . . 65 LEU HA . 26963 1 733 . 1 1 86 86 LEU HB2 H 1 1.534 0.012 . 1 . . 121 . . 65 LEU HB2 . 26963 1 734 . 1 1 86 86 LEU HB3 H 1 1.534 0.012 . 1 . . 122 . . 65 LEU HB3 . 26963 1 735 . 1 1 86 86 LEU HG H 1 1.498 0.03 . 1 . . 114 . . 65 LEU HG . 26963 1 736 . 1 1 86 86 LEU HD11 H 1 0.851 0.006 . 2 . . 118 . . 65 LEU HD11 . 26963 1 737 . 1 1 86 86 LEU HD12 H 1 0.851 0.006 . 2 . . 118 . . 65 LEU HD12 . 26963 1 738 . 1 1 86 86 LEU HD13 H 1 0.851 0.006 . 2 . . 118 . . 65 LEU HD13 . 26963 1 739 . 1 1 86 86 LEU HD21 H 1 0.803 0.002 . 2 . . 119 . . 65 LEU HD21 . 26963 1 740 . 1 1 86 86 LEU HD22 H 1 0.803 0.002 . 2 . . 119 . . 65 LEU HD22 . 26963 1 741 . 1 1 86 86 LEU HD23 H 1 0.803 0.002 . 2 . . 119 . . 65 LEU HD23 . 26963 1 742 . 1 1 86 86 LEU CA C 13 54.935 0.055 . 1 . . 116 . . 65 LEU CA . 26963 1 743 . 1 1 86 86 LEU CB C 13 42.246 0.072 . 1 . . 117 . . 65 LEU CB . 26963 1 744 . 1 1 86 86 LEU CG C 13 26.793 0.052 . 1 . . 120 . . 65 LEU CG . 26963 1 745 . 1 1 86 86 LEU CD1 C 13 24.835 0.091 . 2 . . 113 . . 65 LEU CD1 . 26963 1 746 . 1 1 86 86 LEU CD2 C 13 23.402 0.075 . 2 . . 881 . . 65 LEU CD2 . 26963 1 747 . 1 1 86 86 LEU N N 15 121.503 0.016 . 1 . . 111 . . 65 LEU N . 26963 1 748 . 1 1 87 87 VAL H H 1 8.111 0.004 . 1 . . 642 . . 66 VAL H . 26963 1 749 . 1 1 87 87 VAL HA H 1 4.065 0.002 . 1 . . 638 . . 66 VAL HA . 26963 1 750 . 1 1 87 87 VAL HB H 1 2.024 0.002 . 1 . . 643 . . 66 VAL HB . 26963 1 751 . 1 1 87 87 VAL HG11 H 1 0.908 0.004 . 2 . . 644 . . 66 VAL HG11 . 26963 1 752 . 1 1 87 87 VAL HG12 H 1 0.908 0.004 . 2 . . 644 . . 66 VAL HG12 . 26963 1 753 . 1 1 87 87 VAL HG13 H 1 0.908 0.004 . 2 . . 644 . . 66 VAL HG13 . 26963 1 754 . 1 1 87 87 VAL HG21 H 1 0.908 0.004 . 2 . . 645 . . 66 VAL HG21 . 26963 1 755 . 1 1 87 87 VAL HG22 H 1 0.908 0.004 . 2 . . 645 . . 66 VAL HG22 . 26963 1 756 . 1 1 87 87 VAL HG23 H 1 0.908 0.004 . 2 . . 645 . . 66 VAL HG23 . 26963 1 757 . 1 1 87 87 VAL CA C 13 62.877 0.039 . 1 . . 641 . . 66 VAL CA . 26963 1 758 . 1 1 87 87 VAL CB C 13 32.385 0.042 . 1 . . 640 . . 66 VAL CB . 26963 1 759 . 1 1 87 87 VAL CG1 C 13 20.987 0.038 . 2 . . 639 . . 66 VAL CG1 . 26963 1 760 . 1 1 87 87 VAL CG2 C 13 20.991 0.032 . 2 . . 944 . . 66 VAL CG2 . 26963 1 761 . 1 1 87 87 VAL N N 15 121.384 0.005 . 1 . . 637 . . 66 VAL N . 26963 1 762 . 1 1 88 88 GLY H H 1 8.583 0.002 . 1 . . 452 . . 67 GLY H . 26963 1 763 . 1 1 88 88 GLY HA2 H 1 4.030 0.03 . 2 . . 1057 . . 67 GLY HA2 . 26963 1 764 . 1 1 88 88 GLY HA3 H 1 4.030 0.03 . 2 . . 1058 . . 67 GLY HA3 . 26963 1 765 . 1 1 88 88 GLY CA C 13 45.386 0.138 . 1 . . 451 . . 67 GLY CA . 26963 1 766 . 1 1 88 88 GLY N N 15 113.247 0.003 . 1 . . 450 . . 67 GLY N . 26963 1 767 . 1 1 89 89 SER H H 1 8.257 0.006 . 1 . . 650 . . 68 SER H . 26963 1 768 . 1 1 89 89 SER HA H 1 4.372 0.001 . 1 . . 649 . . 68 SER HA . 26963 1 769 . 1 1 89 89 SER HB2 H 1 3.787 0.001 . 2 . . 653 . . 68 SER HB2 . 26963 1 770 . 1 1 89 89 SER HB3 H 1 3.908 0.001 . 2 . . 654 . . 68 SER HB3 . 26963 1 771 . 1 1 89 89 SER CA C 13 58.765 0.049 . 1 . . 651 . . 68 SER CA . 26963 1 772 . 1 1 89 89 SER CB C 13 63.877 0.079 . 1 . . 652 . . 68 SER CB . 26963 1 773 . 1 1 89 89 SER N N 15 115.557 0.024 . 1 . . 648 . . 68 SER N . 26963 1 774 . 1 1 90 90 GLY H H 1 8.611 0.003 . 1 . . 223 . . 69 GLY H . 26963 1 775 . 1 1 90 90 GLY HA2 H 1 4.118 0.03 . 2 . . 221 . . 69 GLY HA2 . 26963 1 776 . 1 1 90 90 GLY HA3 H 1 4.117 0.03 . 2 . . 222 . . 69 GLY HA3 . 26963 1 777 . 1 1 90 90 GLY CA C 13 45.498 0.14 . 1 . . 220 . . 69 GLY CA . 26963 1 778 . 1 1 90 90 GLY N N 15 111.117 0.239 . 1 . . 219 . . 69 GLY N . 26963 1 779 . 1 1 91 91 GLY H H 1 8.360 0.005 . 1 . . 217 . . 70 GLY H . 26963 1 780 . 1 1 91 91 GLY HA2 H 1 4.244 0.03 . 2 . . 1012 . . 70 GLY HA2 . 26963 1 781 . 1 1 91 91 GLY HA3 H 1 4.082 0.03 . 2 . . 1013 . . 70 GLY HA3 . 26963 1 782 . 1 1 91 91 GLY CA C 13 45.553 0.135 . 1 . . 218 . . 70 GLY CA . 26963 1 783 . 1 1 91 91 GLY N N 15 109.696 0.015 . 1 . . 216 . . 70 GLY N . 26963 1 784 . 1 1 92 92 GLU H H 1 8.499 0.002 . 1 . . 330 . . 71 GLU H . 26963 1 785 . 1 1 92 92 GLU HA H 1 4.938 0.003 . 1 . . 327 . . 71 GLU HA . 26963 1 786 . 1 1 92 92 GLU HB2 H 1 1.808 0.002 . 2 . . 334 . . 71 GLU HB2 . 26963 1 787 . 1 1 92 92 GLU HB3 H 1 1.692 0.005 . 2 . . 335 . . 71 GLU HB3 . 26963 1 788 . 1 1 92 92 GLU HG2 H 1 2.009 0.002 . 1 . . 328 . . 71 GLU HG2 . 26963 1 789 . 1 1 92 92 GLU HG3 H 1 2.009 0.002 . 1 . . 329 . . 71 GLU HG3 . 26963 1 790 . 1 1 92 92 GLU CA C 13 55.512 0.165 . 1 . . 331 . . 71 GLU CA . 26963 1 791 . 1 1 92 92 GLU CB C 13 32.721 0.153 . 1 . . 332 . . 71 GLU CB . 26963 1 792 . 1 1 92 92 GLU CG C 13 35.700 0.07 . 1 . . 333 . . 71 GLU CG . 26963 1 793 . 1 1 92 92 GLU N N 15 121.693 0.003 . 1 . . 326 . . 71 GLU N . 26963 1 794 . 1 1 93 93 SER H H 1 9.182 0.009 . 1 . . 543 . . 72 SER H . 26963 1 795 . 1 1 93 93 SER HA H 1 4.882 0.001 . 1 . . 542 . . 72 SER HA . 26963 1 796 . 1 1 93 93 SER HB2 H 1 3.491 0.03 . 2 . . 546 . . 72 SER HB2 . 26963 1 797 . 1 1 93 93 SER HB3 H 1 3.227 0.03 . 2 . . 547 . . 72 SER HB3 . 26963 1 798 . 1 1 93 93 SER CA C 13 58.116 0.067 . 1 . . 544 . . 72 SER CA . 26963 1 799 . 1 1 93 93 SER CB C 13 66.121 0.002 . 1 . . 545 . . 72 SER CB . 26963 1 800 . 1 1 93 93 SER N N 15 120.136 0.061 . 1 . . 541 . . 72 SER N . 26963 1 801 . 1 1 94 94 THR H H 1 8.115 0.03 . 1 . . 789 . . 73 THR H . 26963 1 802 . 1 1 94 94 THR HA H 1 5.637 0.002 . 1 . . 621 . . 73 THR HA . 26963 1 803 . 1 1 94 94 THR HB H 1 3.512 0.003 . 1 . . 622 . . 73 THR HB . 26963 1 804 . 1 1 94 94 THR HG21 H 1 0.944 0.002 . 1 . . 618 . . 73 THR HG21 . 26963 1 805 . 1 1 94 94 THR HG22 H 1 0.944 0.002 . 1 . . 618 . . 73 THR HG22 . 26963 1 806 . 1 1 94 94 THR HG23 H 1 0.944 0.002 . 1 . . 618 . . 73 THR HG23 . 26963 1 807 . 1 1 94 94 THR CA C 13 60.915 0.084 . 1 . . 620 . . 73 THR CA . 26963 1 808 . 1 1 94 94 THR CB C 13 71.819 0.016 . 1 . . 619 . . 73 THR CB . 26963 1 809 . 1 1 94 94 THR CG2 C 13 21.881 0.029 . 1 . . 617 . . 73 THR CG2 . 26963 1 810 . 1 1 94 94 THR N N 15 117.595 0.3 . 1 . . 790 . . 73 THR N . 26963 1 811 . 1 1 95 95 TRP H H 1 9.466 0.003 . 1 . . 12 . . 74 TRP H . 26963 1 812 . 1 1 95 95 TRP HA H 1 4.373 0.005 . 1 . . 8 . . 74 TRP HA . 26963 1 813 . 1 1 95 95 TRP HB2 H 1 2.990 0.007 . 2 . . 13 . . 74 TRP HB2 . 26963 1 814 . 1 1 95 95 TRP HB3 H 1 2.675 0.005 . 2 . . 14 . . 74 TRP HB3 . 26963 1 815 . 1 1 95 95 TRP HD1 H 1 6.816 0.002 . 1 . . 15 . . 74 TRP HD1 . 26963 1 816 . 1 1 95 95 TRP HE1 H 1 9.861 0.03 . 1 . . 11 . . 74 TRP HE1 . 26963 1 817 . 1 1 95 95 TRP HZ2 H 1 7.182 0.03 . 1 . . 964 . . 74 TRP HZ2 . 26963 1 818 . 1 1 95 95 TRP CA C 13 57.921 0.024 . 1 . . 1060 . . 74 TRP CA . 26963 1 819 . 1 1 95 95 TRP CB C 13 34.211 0.071 . 1 . . 9 . . 74 TRP CB . 26963 1 820 . 1 1 95 95 TRP CD1 C 13 125.251 0.3 . 1 . . 7 . . 74 TRP CD1 . 26963 1 821 . 1 1 95 95 TRP CZ2 C 13 113.644 0.3 . 1 . . 963 . . 74 TRP CZ2 . 26963 1 822 . 1 1 95 95 TRP N N 15 128.481 0.057 . 1 . . 6 . . 74 TRP N . 26963 1 823 . 1 1 95 95 TRP NE1 N 15 127.338 0.3 . 1 . . 10 . . 74 TRP NE1 . 26963 1 824 . 1 1 96 96 ARG H H 1 8.116 0.002 . 1 . . 281 . . 75 ARG H . 26963 1 825 . 1 1 96 96 ARG HA H 1 5.441 0.007 . 1 . . 278 . . 75 ARG HA . 26963 1 826 . 1 1 96 96 ARG HB2 H 1 1.736 0.005 . 2 . . 285 . . 75 ARG HB2 . 26963 1 827 . 1 1 96 96 ARG HB3 H 1 1.510 0.014 . 2 . . 286 . . 75 ARG HB3 . 26963 1 828 . 1 1 96 96 ARG HG2 H 1 1.585 0.007 . 2 . . 279 . . 75 ARG HG2 . 26963 1 829 . 1 1 96 96 ARG HG3 H 1 1.474 0.01 . 2 . . 280 . . 75 ARG HG3 . 26963 1 830 . 1 1 96 96 ARG HD2 H 1 3.084 0.011 . 2 . . 276 . . 75 ARG HD2 . 26963 1 831 . 1 1 96 96 ARG HD3 H 1 3.079 0.009 . 2 . . 277 . . 75 ARG HD3 . 26963 1 832 . 1 1 96 96 ARG CA C 13 54.547 0.085 . 1 . . 282 . . 75 ARG CA . 26963 1 833 . 1 1 96 96 ARG CB C 13 33.582 0.124 . 1 . . 283 . . 75 ARG CB . 26963 1 834 . 1 1 96 96 ARG CG C 13 28.772 0.083 . 1 . . 284 . . 75 ARG CG . 26963 1 835 . 1 1 96 96 ARG CD C 13 43.096 0.133 . 1 . . 274 . . 75 ARG CD . 26963 1 836 . 1 1 96 96 ARG N N 15 119.855 0.042 . 1 . . 275 . . 75 ARG N . 26963 1 837 . 1 1 97 97 PHE H H 1 9.470 0.005 . 1 . . 768 . . 76 PHE H . 26963 1 838 . 1 1 97 97 PHE HA H 1 5.405 0.003 . 1 . . 884 . . 76 PHE HA . 26963 1 839 . 1 1 97 97 PHE HB2 H 1 2.935 0.03 . 2 . . 885 . . 76 PHE HB2 . 26963 1 840 . 1 1 97 97 PHE HB3 H 1 2.663 0.007 . 2 . . 886 . . 76 PHE HB3 . 26963 1 841 . 1 1 97 97 PHE HD1 H 1 6.941 0.012 . 1 . . 953 . . 76 PHE HD1 . 26963 1 842 . 1 1 97 97 PHE HD2 H 1 6.941 0.012 . 1 . . 953 . . 76 PHE HD2 . 26963 1 843 . 1 1 97 97 PHE HE1 H 1 6.973 0.005 . 1 . . 950 . . 76 PHE HE1 . 26963 1 844 . 1 1 97 97 PHE HE2 H 1 6.973 0.005 . 1 . . 950 . . 76 PHE HE2 . 26963 1 845 . 1 1 97 97 PHE HZ H 1 6.693 0.03 . 1 . . 955 . . 76 PHE HZ . 26963 1 846 . 1 1 97 97 PHE CA C 13 55.553 0.062 . 1 . . 762 . . 76 PHE CA . 26963 1 847 . 1 1 97 97 PHE CB C 13 44.640 0.041 . 1 . . 948 . . 76 PHE CB . 26963 1 848 . 1 1 97 97 PHE CD1 C 13 132.807 0.3 . 1 . . 952 . . 76 PHE CD1 . 26963 1 849 . 1 1 97 97 PHE CD2 C 13 132.807 0.3 . 1 . . 952 . . 76 PHE CD2 . 26963 1 850 . 1 1 97 97 PHE CE1 C 13 130.880 0.3 . 1 . . 949 . . 76 PHE CE1 . 26963 1 851 . 1 1 97 97 PHE CE2 C 13 130.880 0.3 . 1 . . 949 . . 76 PHE CE2 . 26963 1 852 . 1 1 97 97 PHE CZ C 13 128.808 0.3 . 1 . . 954 . . 76 PHE CZ . 26963 1 853 . 1 1 97 97 PHE N N 15 120.272 0.062 . 1 . . 769 . . 76 PHE N . 26963 1 854 . 1 1 98 98 ARG H H 1 9.648 0.003 . 1 . . 43 . . 77 ARG H . 26963 1 855 . 1 1 98 98 ARG HA H 1 4.982 0.003 . 1 . . 40 . . 77 ARG HA . 26963 1 856 . 1 1 98 98 ARG HB2 H 1 1.779 0.025 . 2 . . 47 . . 77 ARG HB2 . 26963 1 857 . 1 1 98 98 ARG HB3 H 1 1.745 0.009 . 2 . . 48 . . 77 ARG HB3 . 26963 1 858 . 1 1 98 98 ARG HG2 H 1 1.576 0.003 . 2 . . 41 . . 77 ARG HG2 . 26963 1 859 . 1 1 98 98 ARG HG3 H 1 1.419 0.009 . 2 . . 42 . . 77 ARG HG3 . 26963 1 860 . 1 1 98 98 ARG HD2 H 1 3.183 0.005 . 1 . . 38 . . 77 ARG HD2 . 26963 1 861 . 1 1 98 98 ARG HD3 H 1 3.183 0.005 . 1 . . 39 . . 77 ARG HD3 . 26963 1 862 . 1 1 98 98 ARG CA C 13 53.886 0.059 . 1 . . 44 . . 77 ARG CA . 26963 1 863 . 1 1 98 98 ARG CB C 13 32.583 0.099 . 1 . . 45 . . 77 ARG CB . 26963 1 864 . 1 1 98 98 ARG CG C 13 27.071 0.014 . 1 . . 46 . . 77 ARG CG . 26963 1 865 . 1 1 98 98 ARG CD C 13 42.326 0.04 . 1 . . 37 . . 77 ARG CD . 26963 1 866 . 1 1 98 98 ARG N N 15 121.435 0.053 . 1 . . 36 . . 77 ARG N . 26963 1 867 . 1 1 99 99 VAL H H 1 8.947 0.004 . 1 . . 183 . . 78 VAL H . 26963 1 868 . 1 1 99 99 VAL HA H 1 4.086 0.005 . 1 . . 180 . . 78 VAL HA . 26963 1 869 . 1 1 99 99 VAL HB H 1 2.265 0.002 . 1 . . 184 . . 78 VAL HB . 26963 1 870 . 1 1 99 99 VAL HG11 H 1 0.749 0.007 . 1 . . 829 . . 78 VAL HG11 . 26963 1 871 . 1 1 99 99 VAL HG12 H 1 0.749 0.007 . 1 . . 829 . . 78 VAL HG12 . 26963 1 872 . 1 1 99 99 VAL HG13 H 1 0.749 0.007 . 1 . . 829 . . 78 VAL HG13 . 26963 1 873 . 1 1 99 99 VAL HG21 H 1 0.766 0.003 . 1 . . 828 . . 78 VAL HG21 . 26963 1 874 . 1 1 99 99 VAL HG22 H 1 0.766 0.003 . 1 . . 828 . . 78 VAL HG22 . 26963 1 875 . 1 1 99 99 VAL HG23 H 1 0.766 0.003 . 1 . . 828 . . 78 VAL HG23 . 26963 1 876 . 1 1 99 99 VAL CA C 13 63.833 0.145 . 1 . . 182 . . 78 VAL CA . 26963 1 877 . 1 1 99 99 VAL CB C 13 30.101 0.094 . 1 . . 181 . . 78 VAL CB . 26963 1 878 . 1 1 99 99 VAL CG1 C 13 25.284 0.013 . 1 . . 831 . . 78 VAL CG1 . 26963 1 879 . 1 1 99 99 VAL CG2 C 13 22.262 0.027 . 1 . . 830 . . 78 VAL CG2 . 26963 1 880 . 1 1 99 99 VAL N N 15 127.056 0.058 . 1 . . 179 . . 78 VAL N . 26963 1 881 . 1 1 100 100 ALA H H 1 9.077 0.004 . 1 . . 766 . . 79 ALA H . 26963 1 882 . 1 1 100 100 ALA HA H 1 4.474 0.002 . 1 . . 832 . . 79 ALA HA . 26963 1 883 . 1 1 100 100 ALA HB1 H 1 1.266 0.03 . 1 . . 833 . . 79 ALA HB1 . 26963 1 884 . 1 1 100 100 ALA HB2 H 1 1.266 0.03 . 1 . . 833 . . 79 ALA HB2 . 26963 1 885 . 1 1 100 100 ALA HB3 H 1 1.266 0.03 . 1 . . 833 . . 79 ALA HB3 . 26963 1 886 . 1 1 100 100 ALA CA C 13 53.101 0.025 . 1 . . 763 . . 79 ALA CA . 26963 1 887 . 1 1 100 100 ALA CB C 13 22.201 0.046 . 1 . . 764 . . 79 ALA CB . 26963 1 888 . 1 1 100 100 ALA N N 15 135.034 0.015 . 1 . . 767 . . 79 ALA N . 26963 1 889 . 1 1 101 101 ALA H H 1 7.793 0.002 . 1 . . 290 . . 80 ALA H . 26963 1 890 . 1 1 101 101 ALA HA H 1 4.474 0.002 . 1 . . 288 . . 80 ALA HA . 26963 1 891 . 1 1 101 101 ALA HB1 H 1 1.464 0.03 . 1 . . 291 . . 80 ALA HB1 . 26963 1 892 . 1 1 101 101 ALA HB2 H 1 1.464 0.03 . 1 . . 291 . . 80 ALA HB2 . 26963 1 893 . 1 1 101 101 ALA HB3 H 1 1.464 0.03 . 1 . . 291 . . 80 ALA HB3 . 26963 1 894 . 1 1 101 101 ALA CA C 13 51.448 0.043 . 1 . . 289 . . 80 ALA CA . 26963 1 895 . 1 1 101 101 ALA CB C 13 21.992 0.072 . 1 . . 765 . . 80 ALA CB . 26963 1 896 . 1 1 101 101 ALA N N 15 120.388 0.011 . 1 . . 287 . . 80 ALA N . 26963 1 897 . 1 1 102 102 SER H H 1 7.893 0.002 . 1 . . 340 . . 81 SER H . 26963 1 898 . 1 1 102 102 SER HA H 1 4.097 0.002 . 1 . . 337 . . 81 SER HA . 26963 1 899 . 1 1 102 102 SER HB2 H 1 3.772 0.004 . 1 . . 341 . . 81 SER HB2 . 26963 1 900 . 1 1 102 102 SER HB3 H 1 3.772 0.004 . 1 . . 342 . . 81 SER HB3 . 26963 1 901 . 1 1 102 102 SER CA C 13 57.977 0.08 . 1 . . 339 . . 81 SER CA . 26963 1 902 . 1 1 102 102 SER CB C 13 64.154 0.136 . 1 . . 338 . . 81 SER CB . 26963 1 903 . 1 1 102 102 SER N N 15 110.949 0.018 . 1 . . 336 . . 81 SER N . 26963 1 904 . 1 1 103 103 GLY H H 1 8.684 0.007 . 1 . . 580 . . 82 GLY H . 26963 1 905 . 1 1 103 103 GLY HA2 H 1 3.675 0.003 . 2 . . 578 . . 82 GLY HA2 . 26963 1 906 . 1 1 103 103 GLY HA3 H 1 4.401 0.008 . 2 . . 579 . . 82 GLY HA3 . 26963 1 907 . 1 1 103 103 GLY CA C 13 44.448 0.032 . 1 . . 1064 . . 82 GLY CA . 26963 1 908 . 1 1 103 103 GLY N N 15 109.906 0.084 . 1 . . 577 . . 82 GLY N . 26963 1 909 . 1 1 104 104 ASP H H 1 8.173 0.002 . 1 . . 347 . . 83 ASP H . 26963 1 910 . 1 1 104 104 ASP HA H 1 5.579 0.002 . 1 . . 344 . . 83 ASP HA . 26963 1 911 . 1 1 104 104 ASP HB2 H 1 2.562 0.001 . 2 . . 348 . . 83 ASP HB2 . 26963 1 912 . 1 1 104 104 ASP HB3 H 1 2.399 0.001 . 2 . . 349 . . 83 ASP HB3 . 26963 1 913 . 1 1 104 104 ASP CA C 13 52.939 0.074 . 1 . . 346 . . 83 ASP CA . 26963 1 914 . 1 1 104 104 ASP CB C 13 43.764 0.105 . 1 . . 345 . . 83 ASP CB . 26963 1 915 . 1 1 104 104 ASP N N 15 119.474 0.021 . 1 . . 343 . . 83 ASP N . 26963 1 916 . 1 1 105 105 ASP H H 1 8.811 0.003 . 1 . . 2 . . 84 ASP H . 26963 1 917 . 1 1 105 105 ASP HA H 1 4.603 0.001 . 1 . . 866 . . 84 ASP HA . 26963 1 918 . 1 1 105 105 ASP HB2 H 1 2.341 0.03 . 2 . . 5 . . 84 ASP HB2 . 26963 1 919 . 1 1 105 105 ASP HB3 H 1 2.260 0.03 . 2 . . 867 . . 84 ASP HB3 . 26963 1 920 . 1 1 105 105 ASP CA C 13 52.881 0.113 . 1 . . 3 . . 84 ASP CA . 26963 1 921 . 1 1 105 105 ASP CB C 13 45.777 0.108 . 1 . . 4 . . 84 ASP CB . 26963 1 922 . 1 1 105 105 ASP N N 15 121.130 0.051 . 1 . . 1 . . 84 ASP N . 26963 1 923 . 1 1 106 106 ARG H H 1 10.051 0.002 . 1 . . 514 . . 85 ARG H . 26963 1 924 . 1 1 106 106 ARG HA H 1 4.896 0.001 . 1 . . 511 . . 85 ARG HA . 26963 1 925 . 1 1 106 106 ARG HB2 H 1 1.560 0.005 . 2 . . 518 . . 85 ARG HB2 . 26963 1 926 . 1 1 106 106 ARG HB3 H 1 1.483 0.004 . 2 . . 519 . . 85 ARG HB3 . 26963 1 927 . 1 1 106 106 ARG HG2 H 1 1.282 0.005 . 1 . . 512 . . 85 ARG HG2 . 26963 1 928 . 1 1 106 106 ARG HG3 H 1 1.282 0.005 . 1 . . 513 . . 85 ARG HG3 . 26963 1 929 . 1 1 106 106 ARG HD2 H 1 3.045 0.017 . 2 . . 509 . . 85 ARG HD2 . 26963 1 930 . 1 1 106 106 ARG HD3 H 1 3.031 0.015 . 2 . . 510 . . 85 ARG HD3 . 26963 1 931 . 1 1 106 106 ARG CA C 13 55.517 0.03 . 1 . . 515 . . 85 ARG CA . 26963 1 932 . 1 1 106 106 ARG CB C 13 33.929 0.161 . 1 . . 516 . . 85 ARG CB . 26963 1 933 . 1 1 106 106 ARG CG C 13 27.551 0.052 . 1 . . 517 . . 85 ARG CG . 26963 1 934 . 1 1 106 106 ARG CD C 13 43.385 0.3 . 1 . . 507 . . 85 ARG CD . 26963 1 935 . 1 1 106 106 ARG N N 15 122.420 0.044 . 1 . . 508 . . 85 ARG N . 26963 1 936 . 1 1 107 107 LEU H H 1 8.104 0.005 . 1 . . 595 . . 86 LEU H . 26963 1 937 . 1 1 107 107 LEU HA H 1 4.702 0.003 . 1 . . 589 . . 86 LEU HA . 26963 1 938 . 1 1 107 107 LEU HB2 H 1 1.240 0.004 . 2 . . 599 . . 86 LEU HB2 . 26963 1 939 . 1 1 107 107 LEU HB3 H 1 1.049 0.006 . 2 . . 600 . . 86 LEU HB3 . 26963 1 940 . 1 1 107 107 LEU HG H 1 1.057 0.005 . 1 . . 592 . . 86 LEU HG . 26963 1 941 . 1 1 107 107 LEU HD11 H 1 0.295 0.017 . 2 . . 596 . . 86 LEU HD11 . 26963 1 942 . 1 1 107 107 LEU HD12 H 1 0.295 0.017 . 2 . . 596 . . 86 LEU HD12 . 26963 1 943 . 1 1 107 107 LEU HD13 H 1 0.295 0.017 . 2 . . 596 . . 86 LEU HD13 . 26963 1 944 . 1 1 107 107 LEU HD21 H 1 0.266 0.018 . 2 . . 597 . . 86 LEU HD21 . 26963 1 945 . 1 1 107 107 LEU HD22 H 1 0.266 0.018 . 2 . . 597 . . 86 LEU HD22 . 26963 1 946 . 1 1 107 107 LEU HD23 H 1 0.266 0.018 . 2 . . 597 . . 86 LEU HD23 . 26963 1 947 . 1 1 107 107 LEU CA C 13 52.816 0.136 . 1 . . 594 . . 86 LEU CA . 26963 1 948 . 1 1 107 107 LEU CB C 13 45.760 0.058 . 1 . . 593 . . 86 LEU CB . 26963 1 949 . 1 1 107 107 LEU CG C 13 26.727 0.017 . 1 . . 598 . . 86 LEU CG . 26963 1 950 . 1 1 107 107 LEU CD1 C 13 24.296 0.006 . 2 . . 590 . . 86 LEU CD1 . 26963 1 951 . 1 1 107 107 LEU CD2 C 13 25.000 0.004 . 2 . . 591 . . 86 LEU CD2 . 26963 1 952 . 1 1 107 107 LEU N N 15 123.607 0.039 . 1 . . 588 . . 86 LEU N . 26963 1 953 . 1 1 108 108 GLU H H 1 8.997 0.008 . 1 . . 130 . . 87 GLU H . 26963 1 954 . 1 1 108 108 GLU HA H 1 5.619 0.008 . 1 . . 127 . . 87 GLU HA . 26963 1 955 . 1 1 108 108 GLU HB2 H 1 2.094 0.009 . 2 . . 133 . . 87 GLU HB2 . 26963 1 956 . 1 1 108 108 GLU HB3 H 1 1.807 0.01 . 2 . . 134 . . 87 GLU HB3 . 26963 1 957 . 1 1 108 108 GLU HG2 H 1 2.160 0.004 . 2 . . 128 . . 87 GLU HG2 . 26963 1 958 . 1 1 108 108 GLU HG3 H 1 2.083 0.004 . 2 . . 129 . . 87 GLU HG3 . 26963 1 959 . 1 1 108 108 GLU CA C 13 55.004 0.1 . 1 . . 1063 . . 87 GLU CA . 26963 1 960 . 1 1 108 108 GLU CB C 13 33.524 0.056 . 1 . . 131 . . 87 GLU CB . 26963 1 961 . 1 1 108 108 GLU CG C 13 36.305 0.071 . 1 . . 132 . . 87 GLU CG . 26963 1 962 . 1 1 108 108 GLU N N 15 121.351 0.02 . 1 . . 126 . . 87 GLU N . 26963 1 963 . 1 1 109 109 LEU H H 1 9.668 0.004 . 1 . . 192 . . 88 LEU H . 26963 1 964 . 1 1 109 109 LEU HA H 1 5.641 0.01 . 1 . . 186 . . 88 LEU HA . 26963 1 965 . 1 1 109 109 LEU HB2 H 1 1.947 0.004 . 2 . . 195 . . 88 LEU HB2 . 26963 1 966 . 1 1 109 109 LEU HB3 H 1 1.314 0.008 . 2 . . 196 . . 88 LEU HB3 . 26963 1 967 . 1 1 109 109 LEU HG H 1 1.491 0.003 . 1 . . 189 . . 88 LEU HG . 26963 1 968 . 1 1 109 109 LEU HD11 H 1 0.277 0.004 . 2 . . 193 . . 88 LEU HD11 . 26963 1 969 . 1 1 109 109 LEU HD12 H 1 0.277 0.004 . 2 . . 193 . . 88 LEU HD12 . 26963 1 970 . 1 1 109 109 LEU HD13 H 1 0.277 0.004 . 2 . . 193 . . 88 LEU HD13 . 26963 1 971 . 1 1 109 109 LEU HD21 H 1 -0.514 0.004 . 2 . . 194 . . 88 LEU HD21 . 26963 1 972 . 1 1 109 109 LEU HD22 H 1 -0.514 0.004 . 2 . . 194 . . 88 LEU HD22 . 26963 1 973 . 1 1 109 109 LEU HD23 H 1 -0.514 0.004 . 2 . . 194 . . 88 LEU HD23 . 26963 1 974 . 1 1 109 109 LEU CA C 13 56.207 0.091 . 1 . . 191 . . 88 LEU CA . 26963 1 975 . 1 1 109 109 LEU CB C 13 46.884 0.124 . 1 . . 190 . . 88 LEU CB . 26963 1 976 . 1 1 109 109 LEU CG C 13 29.912 0.068 . 1 . . 882 . . 88 LEU CG . 26963 1 977 . 1 1 109 109 LEU CD1 C 13 26.301 0.057 . 2 . . 187 . . 88 LEU CD1 . 26963 1 978 . 1 1 109 109 LEU CD2 C 13 26.518 0.027 . 2 . . 188 . . 88 LEU CD2 . 26963 1 979 . 1 1 109 109 LEU N N 15 124.614 0.01 . 1 . . 185 . . 88 LEU N . 26963 1 980 . 1 1 110 110 VAL H H 1 8.737 0.001 . 1 . . 1068 . . 89 VAL H . 26963 1 981 . 1 1 110 110 VAL HA H 1 5.168 0.006 . 1 . . 822 . . 89 VAL HA . 26963 1 982 . 1 1 110 110 VAL HB H 1 1.985 0.004 . 1 . . 823 . . 89 VAL HB . 26963 1 983 . 1 1 110 110 VAL HG11 H 1 0.946 0.002 . 1 . . 827 . . 89 VAL HG11 . 26963 1 984 . 1 1 110 110 VAL HG12 H 1 0.946 0.002 . 1 . . 827 . . 89 VAL HG12 . 26963 1 985 . 1 1 110 110 VAL HG13 H 1 0.946 0.002 . 1 . . 827 . . 89 VAL HG13 . 26963 1 986 . 1 1 110 110 VAL HG21 H 1 0.831 0.001 . 1 . . 825 . . 89 VAL HG21 . 26963 1 987 . 1 1 110 110 VAL HG22 H 1 0.831 0.001 . 1 . . 825 . . 89 VAL HG22 . 26963 1 988 . 1 1 110 110 VAL HG23 H 1 0.831 0.001 . 1 . . 825 . . 89 VAL HG23 . 26963 1 989 . 1 1 110 110 VAL CA C 13 59.886 0.026 . 1 . . 771 . . 89 VAL CA . 26963 1 990 . 1 1 110 110 VAL CB C 13 35.832 0.126 . 1 . . 770 . . 89 VAL CB . 26963 1 991 . 1 1 110 110 VAL CG1 C 13 22.136 0.031 . 1 . . 826 . . 89 VAL CG1 . 26963 1 992 . 1 1 110 110 VAL CG2 C 13 18.822 0.017 . 1 . . 824 . . 89 VAL CG2 . 26963 1 993 . 1 1 110 110 VAL N N 15 112.812 0.08 . 1 . . 1069 . . 89 VAL N . 26963 1 994 . 1 1 111 111 TYR H H 1 8.240 0.005 . 1 . . 379 . . 90 TYR H . 26963 1 995 . 1 1 111 111 TYR HA H 1 4.709 0.001 . 1 . . 376 . . 90 TYR HA . 26963 1 996 . 1 1 111 111 TYR HB2 H 1 2.110 0.03 . 2 . . 382 . . 90 TYR HB2 . 26963 1 997 . 1 1 111 111 TYR HB3 H 1 0.107 0.03 . 2 . . 383 . . 90 TYR HB3 . 26963 1 998 . 1 1 111 111 TYR HD1 H 1 5.591 0.002 . 1 . . 377 . . 90 TYR HD1 . 26963 1 999 . 1 1 111 111 TYR HD2 H 1 5.591 0.002 . 1 . . 377 . . 90 TYR HD2 . 26963 1 1000 . 1 1 111 111 TYR HE1 H 1 6.215 0.008 . 1 . . 378 . . 90 TYR HE1 . 26963 1 1001 . 1 1 111 111 TYR HE2 H 1 6.215 0.008 . 1 . . 378 . . 90 TYR HE2 . 26963 1 1002 . 1 1 111 111 TYR CA C 13 55.580 0.092 . 1 . . 380 . . 90 TYR CA . 26963 1 1003 . 1 1 111 111 TYR CB C 13 39.121 0.047 . 1 . . 381 . . 90 TYR CB . 26963 1 1004 . 1 1 111 111 TYR CD1 C 13 132.377 0.3 . 1 . . 947 . . 90 TYR CD1 . 26963 1 1005 . 1 1 111 111 TYR CD2 C 13 132.377 0.3 . 1 . . 947 . . 90 TYR CD2 . 26963 1 1006 . 1 1 111 111 TYR CE1 C 13 117.366 0.3 . 1 . . 384 . . 90 TYR CE1 . 26963 1 1007 . 1 1 111 111 TYR CE2 C 13 117.366 0.3 . 1 . . 384 . . 90 TYR CE2 . 26963 1 1008 . 1 1 111 111 TYR N N 15 127.793 0.049 . 1 . . 375 . . 90 TYR N . 26963 1 1009 . 1 1 112 112 ARG H H 1 8.343 0.015 . 1 . . 88 . . 91 ARG H . 26963 1 1010 . 1 1 112 112 ARG HA H 1 4.732 0.008 . 1 . . 85 . . 91 ARG HA . 26963 1 1011 . 1 1 112 112 ARG HB2 H 1 1.548 0.013 . 2 . . 92 . . 91 ARG HB2 . 26963 1 1012 . 1 1 112 112 ARG HB3 H 1 1.722 0.007 . 2 . . 93 . . 91 ARG HB3 . 26963 1 1013 . 1 1 112 112 ARG HG2 H 1 1.000 0.008 . 2 . . 86 . . 91 ARG HG2 . 26963 1 1014 . 1 1 112 112 ARG HG3 H 1 1.286 0.004 . 2 . . 87 . . 91 ARG HG3 . 26963 1 1015 . 1 1 112 112 ARG HD2 H 1 2.986 0.007 . 2 . . 83 . . 91 ARG HD2 . 26963 1 1016 . 1 1 112 112 ARG HD3 H 1 2.878 0.011 . 2 . . 84 . . 91 ARG HD3 . 26963 1 1017 . 1 1 112 112 ARG HE H 1 7.555 0.03 . 1 . . 1038 . . 91 ARG HE . 26963 1 1018 . 1 1 112 112 ARG CA C 13 54.952 0.034 . 1 . . 89 . . 91 ARG CA . 26963 1 1019 . 1 1 112 112 ARG CB C 13 33.709 0.091 . 1 . . 90 . . 91 ARG CB . 26963 1 1020 . 1 1 112 112 ARG CG C 13 25.630 0.047 . 1 . . 91 . . 91 ARG CG . 26963 1 1021 . 1 1 112 112 ARG CD C 13 43.892 0.046 . 1 . . 81 . . 91 ARG CD . 26963 1 1022 . 1 1 112 112 ARG N N 15 120.999 0.061 . 1 . . 82 . . 91 ARG N . 26963 1 1023 . 1 1 112 112 ARG NE N 15 126.102 0.3 . 1 . . 1037 . . 91 ARG NE . 26963 1 1024 . 1 1 113 113 ARG H H 1 8.644 0.005 . 1 . . 155 . . 92 ARG H . 26963 1 1025 . 1 1 113 113 ARG HA H 1 4.115 0.007 . 1 . . 152 . . 92 ARG HA . 26963 1 1026 . 1 1 113 113 ARG HB2 H 1 0.515 0.008 . 2 . . 157 . . 92 ARG HB2 . 26963 1 1027 . 1 1 113 113 ARG HB3 H 1 -0.259 0.007 . 2 . . 854 . . 92 ARG HB3 . 26963 1 1028 . 1 1 113 113 ARG HG2 H 1 0.021 0.002 . 2 . . 855 . . 92 ARG HG2 . 26963 1 1029 . 1 1 113 113 ARG HG3 H 1 -0.188 0.005 . 2 . . 856 . . 92 ARG HG3 . 26963 1 1030 . 1 1 113 113 ARG HD2 H 1 2.542 0.007 . 2 . . 150 . . 92 ARG HD2 . 26963 1 1031 . 1 1 113 113 ARG HD3 H 1 2.440 0.009 . 2 . . 151 . . 92 ARG HD3 . 26963 1 1032 . 1 1 113 113 ARG CA C 13 53.318 0.056 . 1 . . 154 . . 92 ARG CA . 26963 1 1033 . 1 1 113 113 ARG CB C 13 28.417 0.049 . 1 . . 153 . . 92 ARG CB . 26963 1 1034 . 1 1 113 113 ARG CG C 13 26.100 0.085 . 1 . . 156 . . 92 ARG CG . 26963 1 1035 . 1 1 113 113 ARG CD C 13 43.186 0.059 . 1 . . 149 . . 92 ARG CD . 26963 1 1036 . 1 1 113 113 ARG N N 15 124.049 0.043 . 1 . . 148 . . 92 ARG N . 26963 1 1037 . 1 1 114 114 PRO HA H 1 3.954 0.003 . 1 . . 887 . . 93 PRO HA . 26963 1 1038 . 1 1 114 114 PRO HB2 H 1 2.185 0.006 . 2 . . 888 . . 93 PRO HB2 . 26963 1 1039 . 1 1 114 114 PRO HB3 H 1 1.874 0.002 . 2 . . 889 . . 93 PRO HB3 . 26963 1 1040 . 1 1 114 114 PRO HG2 H 1 2.006 0.008 . 2 . . 891 . . 93 PRO HG2 . 26963 1 1041 . 1 1 114 114 PRO HG3 H 1 1.877 0.004 . 2 . . 892 . . 93 PRO HG3 . 26963 1 1042 . 1 1 114 114 PRO HD2 H 1 3.640 0.008 . 2 . . 894 . . 93 PRO HD2 . 26963 1 1043 . 1 1 114 114 PRO HD3 H 1 3.346 0.008 . 2 . . 895 . . 93 PRO HD3 . 26963 1 1044 . 1 1 114 114 PRO CA C 13 64.600 0.025 . 1 . . 772 . . 93 PRO CA . 26963 1 1045 . 1 1 114 114 PRO CB C 13 31.745 0.058 . 1 . . 773 . . 93 PRO CB . 26963 1 1046 . 1 1 114 114 PRO CG C 13 27.402 0.041 . 1 . . 890 . . 93 PRO CG . 26963 1 1047 . 1 1 114 114 PRO CD C 13 50.851 0.059 . 1 . . 893 . . 93 PRO CD . 26963 1 1048 . 1 1 115 115 TRP H H 1 6.465 0.005 . 1 . . 401 . . 94 TRP H . 26963 1 1049 . 1 1 115 115 TRP HA H 1 4.662 0.001 . 1 . . 399 . . 94 TRP HA . 26963 1 1050 . 1 1 115 115 TRP HB2 H 1 3.421 0.006 . 2 . . 405 . . 94 TRP HB2 . 26963 1 1051 . 1 1 115 115 TRP HB3 H 1 3.189 0.006 . 2 . . 406 . . 94 TRP HB3 . 26963 1 1052 . 1 1 115 115 TRP HD1 H 1 7.104 0.03 . 1 . . 946 . . 94 TRP HD1 . 26963 1 1053 . 1 1 115 115 TRP HE1 H 1 10.380 0.03 . 1 . . 404 . . 94 TRP HE1 . 26963 1 1054 . 1 1 115 115 TRP HE3 H 1 7.550 0.03 . 1 . . 972 . . 94 TRP HE3 . 26963 1 1055 . 1 1 115 115 TRP HZ2 H 1 7.342 0.03 . 1 . . 967 . . 94 TRP HZ2 . 26963 1 1056 . 1 1 115 115 TRP HZ3 H 1 7.151 0.03 . 1 . . 974 . . 94 TRP HZ3 . 26963 1 1057 . 1 1 115 115 TRP HH2 H 1 7.158 0.03 . 1 . . 975 . . 94 TRP HH2 . 26963 1 1058 . 1 1 115 115 TRP CA C 13 56.756 0.054 . 1 . . 403 . . 94 TRP CA . 26963 1 1059 . 1 1 115 115 TRP CB C 13 27.885 0.093 . 1 . . 400 . . 94 TRP CB . 26963 1 1060 . 1 1 115 115 TRP CD1 C 13 127.660 0.3 . 1 . . 945 . . 94 TRP CD1 . 26963 1 1061 . 1 1 115 115 TRP CE3 C 13 120.106 0.3 . 1 . . 971 . . 94 TRP CE3 . 26963 1 1062 . 1 1 115 115 TRP CZ2 C 13 114.773 0.3 . 1 . . 966 . . 94 TRP CZ2 . 26963 1 1063 . 1 1 115 115 TRP CZ3 C 13 122.636 0.3 . 1 . . 973 . . 94 TRP CZ3 . 26963 1 1064 . 1 1 115 115 TRP CH2 C 13 124.965 0.3 . 1 . . 970 . . 94 TRP CH2 . 26963 1 1065 . 1 1 115 115 TRP N N 15 111.599 0.017 . 1 . . 398 . . 94 TRP N . 26963 1 1066 . 1 1 115 115 TRP NE1 N 15 131.414 0.3 . 1 . . 402 . . 94 TRP NE1 . 26963 1 1067 . 1 1 116 116 GLU H H 1 7.003 0.004 . 1 . . 76 . . 95 GLU H . 26963 1 1068 . 1 1 116 116 GLU HA H 1 4.357 0.01 . 1 . . 74 . . 95 GLU HA . 26963 1 1069 . 1 1 116 116 GLU HB2 H 1 1.451 0.004 . 2 . . 79 . . 95 GLU HB2 . 26963 1 1070 . 1 1 116 116 GLU HB3 H 1 1.768 0.002 . 2 . . 80 . . 95 GLU HB3 . 26963 1 1071 . 1 1 116 116 GLU HG2 H 1 1.881 0.004 . 2 . . 75 . . 95 GLU HG2 . 26963 1 1072 . 1 1 116 116 GLU HG3 H 1 1.530 0.006 . 2 . . 868 . . 95 GLU HG3 . 26963 1 1073 . 1 1 116 116 GLU CA C 13 55.366 0.108 . 1 . . 1062 . . 95 GLU CA . 26963 1 1074 . 1 1 116 116 GLU CB C 13 29.144 0.056 . 1 . . 77 . . 95 GLU CB . 26963 1 1075 . 1 1 116 116 GLU CG C 13 36.562 0.023 . 1 . . 78 . . 95 GLU CG . 26963 1 1076 . 1 1 116 116 GLU N N 15 123.550 0.04 . 1 . . 73 . . 95 GLU N . 26963 1 1077 . 1 1 117 117 LYS H H 1 8.104 0.008 . 1 . . 684 . . 96 LYS H . 26963 1 1078 . 1 1 117 117 LYS HA H 1 3.955 0.003 . 1 . . 688 . . 96 LYS HA . 26963 1 1079 . 1 1 117 117 LYS HB2 H 1 1.738 0.004 . 2 . . 689 . . 96 LYS HB2 . 26963 1 1080 . 1 1 117 117 LYS HB3 H 1 1.740 0.004 . 2 . . 690 . . 96 LYS HB3 . 26963 1 1081 . 1 1 117 117 LYS HG2 H 1 1.631 0.002 . 1 . . 682 . . 96 LYS HG2 . 26963 1 1082 . 1 1 117 117 LYS HG3 H 1 1.631 0.002 . 1 . . 683 . . 96 LYS HG3 . 26963 1 1083 . 1 1 117 117 LYS HD2 H 1 1.361 0.022 . 2 . . 678 . . 96 LYS HD2 . 26963 1 1084 . 1 1 117 117 LYS HD3 H 1 1.383 0.021 . 2 . . 679 . . 96 LYS HD3 . 26963 1 1085 . 1 1 117 117 LYS HE2 H 1 2.977 0.005 . 2 . . 680 . . 96 LYS HE2 . 26963 1 1086 . 1 1 117 117 LYS HE3 H 1 2.977 0.005 . 2 . . 681 . . 96 LYS HE3 . 26963 1 1087 . 1 1 117 117 LYS CA C 13 58.049 0.065 . 1 . . 685 . . 96 LYS CA . 26963 1 1088 . 1 1 117 117 LYS CB C 13 32.592 0.053 . 1 . . 686 . . 96 LYS CB . 26963 1 1089 . 1 1 117 117 LYS CG C 13 29.017 0.072 . 1 . . 687 . . 96 LYS CG . 26963 1 1090 . 1 1 117 117 LYS CD C 13 24.708 0.032 . 1 . . 676 . . 96 LYS CD . 26963 1 1091 . 1 1 117 117 LYS CE C 13 42.164 0.3 . 1 . . 691 . . 96 LYS CE . 26963 1 1092 . 1 1 117 117 LYS N N 15 122.962 0.046 . 1 . . 677 . . 96 LYS N . 26963 1 1093 . 1 1 118 118 ASP H H 1 8.430 0.004 . 1 . . 498 . . 97 ASP H . 26963 1 1094 . 1 1 118 118 ASP HA H 1 4.552 0.03 . 1 . . 497 . . 97 ASP HA . 26963 1 1095 . 1 1 118 118 ASP HB2 H 1 2.569 0.03 . 2 . . 499 . . 97 ASP HB2 . 26963 1 1096 . 1 1 118 118 ASP HB3 H 1 2.694 0.03 . 2 . . 500 . . 97 ASP HB3 . 26963 1 1097 . 1 1 118 118 ASP CA C 13 54.358 0.04 . 1 . . 1061 . . 97 ASP CA . 26963 1 1098 . 1 1 118 118 ASP CB C 13 40.884 0.033 . 1 . . 774 . . 97 ASP CB . 26963 1 1099 . 1 1 118 118 ASP N N 15 117.465 0.049 . 1 . . 496 . . 97 ASP N . 26963 1 1100 . 1 1 119 119 ALA H H 1 7.286 0.006 . 1 . . 177 . . 98 ALA H . 26963 1 1101 . 1 1 119 119 ALA HA H 1 4.321 0.002 . 1 . . 174 . . 98 ALA HA . 26963 1 1102 . 1 1 119 119 ALA HB1 H 1 1.281 0.001 . 1 . . 178 . . 98 ALA HB1 . 26963 1 1103 . 1 1 119 119 ALA HB2 H 1 1.281 0.001 . 1 . . 178 . . 98 ALA HB2 . 26963 1 1104 . 1 1 119 119 ALA HB3 H 1 1.281 0.001 . 1 . . 178 . . 98 ALA HB3 . 26963 1 1105 . 1 1 119 119 ALA CA C 13 51.746 0.063 . 1 . . 176 . . 98 ALA CA . 26963 1 1106 . 1 1 119 119 ALA CB C 13 20.027 0.078 . 1 . . 175 . . 98 ALA CB . 26963 1 1107 . 1 1 119 119 ALA N N 15 122.318 0.019 . 1 . . 173 . . 98 ALA N . 26963 1 1108 . 1 1 120 120 GLU H H 1 8.588 0.002 . 1 . . 241 . . 99 GLU H . 26963 1 1109 . 1 1 120 120 GLU HA H 1 4.436 0.003 . 1 . . 238 . . 99 GLU HA . 26963 1 1110 . 1 1 120 120 GLU HB2 H 1 1.975 0.003 . 2 . . 245 . . 99 GLU HB2 . 26963 1 1111 . 1 1 120 120 GLU HB3 H 1 1.835 0.004 . 2 . . 246 . . 99 GLU HB3 . 26963 1 1112 . 1 1 120 120 GLU HG2 H 1 2.304 0.003 . 1 . . 239 . . 99 GLU HG2 . 26963 1 1113 . 1 1 120 120 GLU HG3 H 1 2.304 0.003 . 1 . . 240 . . 99 GLU HG3 . 26963 1 1114 . 1 1 120 120 GLU CA C 13 54.555 0.068 . 1 . . 242 . . 99 GLU CA . 26963 1 1115 . 1 1 120 120 GLU CB C 13 29.076 0.092 . 1 . . 243 . . 99 GLU CB . 26963 1 1116 . 1 1 120 120 GLU CG C 13 35.819 0.001 . 1 . . 244 . . 99 GLU CG . 26963 1 1117 . 1 1 120 120 GLU N N 15 123.030 0.036 . 1 . . 237 . . 99 GLU N . 26963 1 1118 . 1 1 121 121 PRO HA H 1 4.277 0.003 . 1 . . 897 . . 100 PRO HA . 26963 1 1119 . 1 1 121 121 PRO HB2 H 1 2.099 0.004 . 2 . . 898 . . 100 PRO HB2 . 26963 1 1120 . 1 1 121 121 PRO HB3 H 1 1.944 0.004 . 2 . . 899 . . 100 PRO HB3 . 26963 1 1121 . 1 1 121 121 PRO HG2 H 1 2.037 0.004 . 2 . . 901 . . 100 PRO HG2 . 26963 1 1122 . 1 1 121 121 PRO HG3 H 1 1.793 0.003 . 2 . . 902 . . 100 PRO HG3 . 26963 1 1123 . 1 1 121 121 PRO HD2 H 1 3.847 0.004 . 2 . . 903 . . 100 PRO HD2 . 26963 1 1124 . 1 1 121 121 PRO HD3 H 1 3.639 0.005 . 2 . . 904 . . 100 PRO HD3 . 26963 1 1125 . 1 1 121 121 PRO CA C 13 63.156 0.031 . 1 . . 294 . . 100 PRO CA . 26963 1 1126 . 1 1 121 121 PRO CB C 13 32.674 0.063 . 1 . . 293 . . 100 PRO CB . 26963 1 1127 . 1 1 121 121 PRO CG C 13 27.654 0.035 . 1 . . 900 . . 100 PRO CG . 26963 1 1128 . 1 1 121 121 PRO CD C 13 50.600 0.044 . 1 . . 292 . . 100 PRO CD . 26963 1 1129 . 1 1 122 122 ALA H H 1 8.276 0.004 . 1 . . 56 . . 101 ALA H . 26963 1 1130 . 1 1 122 122 ALA HA H 1 4.180 0.001 . 1 . . 55 . . 101 ALA HA . 26963 1 1131 . 1 1 122 122 ALA HB1 H 1 1.282 0.001 . 1 . . 59 . . 101 ALA HB1 . 26963 1 1132 . 1 1 122 122 ALA HB2 H 1 1.282 0.001 . 1 . . 59 . . 101 ALA HB2 . 26963 1 1133 . 1 1 122 122 ALA HB3 H 1 1.282 0.001 . 1 . . 59 . . 101 ALA HB3 . 26963 1 1134 . 1 1 122 122 ALA CA C 13 54.049 0.016 . 1 . . 57 . . 101 ALA CA . 26963 1 1135 . 1 1 122 122 ALA CB C 13 20.072 0.032 . 1 . . 58 . . 101 ALA CB . 26963 1 1136 . 1 1 122 122 ALA N N 15 126.553 0.013 . 1 . . 54 . . 101 ALA N . 26963 1 1137 . 1 1 123 123 GLU H H 1 7.572 0.003 . 1 . . 30 . . 102 GLU H . 26963 1 1138 . 1 1 123 123 GLU HA H 1 4.640 0.002 . 1 . . 27 . . 102 GLU HA . 26963 1 1139 . 1 1 123 123 GLU HB2 H 1 1.637 0.004 . 2 . . 34 . . 102 GLU HB2 . 26963 1 1140 . 1 1 123 123 GLU HB3 H 1 2.034 0.001 . 2 . . 35 . . 102 GLU HB3 . 26963 1 1141 . 1 1 123 123 GLU HG2 H 1 2.195 0.001 . 1 . . 28 . . 102 GLU HG2 . 26963 1 1142 . 1 1 123 123 GLU HG3 H 1 2.195 0.001 . 1 . . 29 . . 102 GLU HG3 . 26963 1 1143 . 1 1 123 123 GLU CA C 13 54.780 0.076 . 1 . . 31 . . 102 GLU CA . 26963 1 1144 . 1 1 123 123 GLU CB C 13 33.512 0.041 . 1 . . 32 . . 102 GLU CB . 26963 1 1145 . 1 1 123 123 GLU CG C 13 35.850 0.035 . 1 . . 33 . . 102 GLU CG . 26963 1 1146 . 1 1 123 123 GLU N N 15 112.143 0.03 . 1 . . 26 . . 102 GLU N . 26963 1 1147 . 1 1 124 124 SER H H 1 9.011 0.004 . 1 . . 777 . . 103 SER H . 26963 1 1148 . 1 1 124 124 SER HA H 1 5.306 0.005 . 1 . . 911 . . 103 SER HA . 26963 1 1149 . 1 1 124 124 SER HB2 H 1 3.883 0.004 . 1 . . 912 . . 103 SER HB2 . 26963 1 1150 . 1 1 124 124 SER HB3 H 1 3.883 0.004 . 1 . . 913 . . 103 SER HB3 . 26963 1 1151 . 1 1 124 124 SER CA C 13 57.854 0.071 . 1 . . 775 . . 103 SER CA . 26963 1 1152 . 1 1 124 124 SER CB C 13 66.015 0.121 . 1 . . 776 . . 103 SER CB . 26963 1 1153 . 1 1 124 124 SER N N 15 115.576 0.038 . 1 . . 778 . . 103 SER N . 26963 1 1154 . 1 1 125 125 PHE H H 1 9.034 0.006 . 1 . . 565 . . 104 PHE H . 26963 1 1155 . 1 1 125 125 PHE HA H 1 4.669 0.03 . 1 . . 562 . . 104 PHE HA . 26963 1 1156 . 1 1 125 125 PHE HB2 H 1 2.712 0.03 . 1 . . 569 . . 104 PHE HB2 . 26963 1 1157 . 1 1 125 125 PHE HB3 H 1 2.712 0.03 . 1 . . 570 . . 104 PHE HB3 . 26963 1 1158 . 1 1 125 125 PHE HD1 H 1 6.911 0.008 . 1 . . 563 . . 104 PHE HD1 . 26963 1 1159 . 1 1 125 125 PHE HD2 H 1 6.911 0.008 . 1 . . 563 . . 104 PHE HD2 . 26963 1 1160 . 1 1 125 125 PHE HE1 H 1 6.793 0.01 . 1 . . 564 . . 104 PHE HE1 . 26963 1 1161 . 1 1 125 125 PHE HE2 H 1 6.793 0.01 . 1 . . 564 . . 104 PHE HE2 . 26963 1 1162 . 1 1 125 125 PHE HZ H 1 6.604 0.03 . 1 . . 962 . . 104 PHE HZ . 26963 1 1163 . 1 1 125 125 PHE CA C 13 57.922 0.042 . 1 . . 566 . . 104 PHE CA . 26963 1 1164 . 1 1 125 125 PHE CB C 13 42.671 0.045 . 1 . . 567 . . 104 PHE CB . 26963 1 1165 . 1 1 125 125 PHE CD1 C 13 132.295 0.3 . 1 . . 958 . . 104 PHE CD1 . 26963 1 1166 . 1 1 125 125 PHE CD2 C 13 132.295 0.3 . 1 . . 958 . . 104 PHE CD2 . 26963 1 1167 . 1 1 125 125 PHE CE1 C 13 131.270 0.3 . 1 . . 568 . . 104 PHE CE1 . 26963 1 1168 . 1 1 125 125 PHE CE2 C 13 131.270 0.3 . 1 . . 568 . . 104 PHE CE2 . 26963 1 1169 . 1 1 125 125 PHE CZ C 13 128.176 0.3 . 1 . . 961 . . 104 PHE CZ . 26963 1 1170 . 1 1 125 125 PHE N N 15 124.658 0.024 . 1 . . 561 . . 104 PHE N . 26963 1 1171 . 1 1 126 126 SER H H 1 8.079 0.003 . 1 . . 702 . . 105 SER H . 26963 1 1172 . 1 1 126 126 SER HA H 1 5.163 0.003 . 1 . . 699 . . 105 SER HA . 26963 1 1173 . 1 1 126 126 SER HB2 H 1 3.598 0.009 . 2 . . 703 . . 105 SER HB2 . 26963 1 1174 . 1 1 126 126 SER HB3 H 1 3.546 0.03 . 2 . . 704 . . 105 SER HB3 . 26963 1 1175 . 1 1 126 126 SER CA C 13 56.650 0.056 . 1 . . 701 . . 105 SER CA . 26963 1 1176 . 1 1 126 126 SER CB C 13 64.354 0.068 . 1 . . 700 . . 105 SER CB . 26963 1 1177 . 1 1 126 126 SER N N 15 123.332 0.009 . 1 . . 698 . . 105 SER N . 26963 1 1178 . 1 1 127 127 CYS H H 1 8.941 0.003 . 1 . . 668 . . 106 CYS H . 26963 1 1179 . 1 1 127 127 CYS HA H 1 4.802 0.002 . 1 . . 841 . . 106 CYS HA . 26963 1 1180 . 1 1 127 127 CYS HB2 H 1 2.595 0.03 . 2 . . 842 . . 106 CYS HB2 . 26963 1 1181 . 1 1 127 127 CYS HB3 H 1 2.978 0.03 . 2 . . 843 . . 106 CYS HB3 . 26963 1 1182 . 1 1 127 127 CYS CA C 13 55.145 0.118 . 1 . . 667 . . 106 CYS CA . 26963 1 1183 . 1 1 127 127 CYS CB C 13 48.460 0.015 . 1 . . 666 . . 106 CYS CB . 26963 1 1184 . 1 1 127 127 CYS N N 15 124.898 0.046 . 1 . . 665 . . 106 CYS N . 26963 1 1185 . 1 1 128 128 ALA H H 1 8.943 0.001 . 1 . . 107 . . 107 ALA H . 26963 1 1186 . 1 1 128 128 ALA HA H 1 4.415 0.001 . 1 . . 106 . . 107 ALA HA . 26963 1 1187 . 1 1 128 128 ALA HB1 H 1 1.324 0.001 . 1 . . 110 . . 107 ALA HB1 . 26963 1 1188 . 1 1 128 128 ALA HB2 H 1 1.324 0.001 . 1 . . 110 . . 107 ALA HB2 . 26963 1 1189 . 1 1 128 128 ALA HB3 H 1 1.324 0.001 . 1 . . 110 . . 107 ALA HB3 . 26963 1 1190 . 1 1 128 128 ALA CA C 13 53.136 0.085 . 1 . . 108 . . 107 ALA CA . 26963 1 1191 . 1 1 128 128 ALA CB C 13 18.675 0.045 . 1 . . 109 . . 107 ALA CB . 26963 1 1192 . 1 1 128 128 ALA N N 15 133.728 0.003 . 1 . . 105 . . 107 ALA N . 26963 1 1193 . 1 1 129 129 ILE H H 1 8.739 0.002 . 1 . . 66 . . 108 ILE H . 26963 1 1194 . 1 1 129 129 ILE HA H 1 4.673 0.004 . 1 . . 63 . . 108 ILE HA . 26963 1 1195 . 1 1 129 129 ILE HB H 1 1.167 0.002 . 1 . . 72 . . 108 ILE HB . 26963 1 1196 . 1 1 129 129 ILE HG12 H 1 1.509 0.006 . 2 . . 68 . . 108 ILE HG12 . 26963 1 1197 . 1 1 129 129 ILE HG13 H 1 0.835 0.005 . 2 . . 69 . . 108 ILE HG13 . 26963 1 1198 . 1 1 129 129 ILE HG21 H 1 0.645 0.003 . 1 . . 65 . . 108 ILE HG21 . 26963 1 1199 . 1 1 129 129 ILE HG22 H 1 0.645 0.003 . 1 . . 65 . . 108 ILE HG22 . 26963 1 1200 . 1 1 129 129 ILE HG23 H 1 0.645 0.003 . 1 . . 65 . . 108 ILE HG23 . 26963 1 1201 . 1 1 129 129 ILE HD11 H 1 0.391 0.002 . 1 . . 64 . . 108 ILE HD11 . 26963 1 1202 . 1 1 129 129 ILE HD12 H 1 0.391 0.002 . 1 . . 64 . . 108 ILE HD12 . 26963 1 1203 . 1 1 129 129 ILE HD13 H 1 0.391 0.002 . 1 . . 64 . . 108 ILE HD13 . 26963 1 1204 . 1 1 129 129 ILE CA C 13 60.170 0.029 . 1 . . 67 . . 108 ILE CA . 26963 1 1205 . 1 1 129 129 ILE CB C 13 41.813 0.022 . 1 . . 70 . . 108 ILE CB . 26963 1 1206 . 1 1 129 129 ILE CG1 C 13 27.574 0.092 . 1 . . 62 . . 108 ILE CG1 . 26963 1 1207 . 1 1 129 129 ILE CG2 C 13 18.591 0.004 . 1 . . 71 . . 108 ILE CG2 . 26963 1 1208 . 1 1 129 129 ILE CD1 C 13 14.341 0.009 . 1 . . 61 . . 108 ILE CD1 . 26963 1 1209 . 1 1 129 129 ILE N N 15 122.233 0.088 . 1 . . 60 . . 108 ILE N . 26963 1 1210 . 1 1 130 130 GLN H H 1 9.034 0.001 . 1 . . 447 . . 109 GLN H . 26963 1 1211 . 1 1 130 130 GLN HA H 1 4.955 0.002 . 1 . . 443 . . 109 GLN HA . 26963 1 1212 . 1 1 130 130 GLN HB2 H 1 1.782 0.015 . 2 . . 449 . . 109 GLN HB2 . 26963 1 1213 . 1 1 130 130 GLN HB3 H 1 1.788 0.014 . 2 . . 844 . . 109 GLN HB3 . 26963 1 1214 . 1 1 130 130 GLN HG2 H 1 2.418 0.002 . 2 . . 444 . . 109 GLN HG2 . 26963 1 1215 . 1 1 130 130 GLN HG3 H 1 1.798 0.03 . 2 . . 1088 . . 109 GLN HG3 . 26963 1 1216 . 1 1 130 130 GLN CA C 13 55.089 0.094 . 1 . . 446 . . 109 GLN CA . 26963 1 1217 . 1 1 130 130 GLN CB C 13 34.024 0.023 . 1 . . 445 . . 109 GLN CB . 26963 1 1218 . 1 1 130 130 GLN CG C 13 34.996 0.059 . 1 . . 448 . . 109 GLN CG . 26963 1 1219 . 1 1 130 130 GLN N N 15 128.289 0.038 . 1 . . 442 . . 109 GLN N . 26963 1 1220 . 1 1 131 131 VAL H H 1 9.270 0.003 . 1 . . 298 . . 110 VAL H . 26963 1 1221 . 1 1 131 131 VAL HA H 1 4.785 0.002 . 1 . . 296 . . 110 VAL HA . 26963 1 1222 . 1 1 131 131 VAL HB H 1 2.226 0.004 . 1 . . 301 . . 110 VAL HB . 26963 1 1223 . 1 1 131 131 VAL HG11 H 1 0.732 0.004 . 2 . . 302 . . 110 VAL HG11 . 26963 1 1224 . 1 1 131 131 VAL HG12 H 1 0.732 0.004 . 2 . . 302 . . 110 VAL HG12 . 26963 1 1225 . 1 1 131 131 VAL HG13 H 1 0.732 0.004 . 2 . . 302 . . 110 VAL HG13 . 26963 1 1226 . 1 1 131 131 VAL HG21 H 1 0.677 0.002 . 2 . . 816 . . 110 VAL HG21 . 26963 1 1227 . 1 1 131 131 VAL HG22 H 1 0.677 0.002 . 2 . . 816 . . 110 VAL HG22 . 26963 1 1228 . 1 1 131 131 VAL HG23 H 1 0.677 0.002 . 2 . . 816 . . 110 VAL HG23 . 26963 1 1229 . 1 1 131 131 VAL CA C 13 60.833 0.041 . 1 . . 299 . . 110 VAL CA . 26963 1 1230 . 1 1 131 131 VAL CB C 13 33.353 0.071 . 1 . . 300 . . 110 VAL CB . 26963 1 1231 . 1 1 131 131 VAL CG1 C 13 21.354 0.026 . 2 . . 297 . . 110 VAL CG1 . 26963 1 1232 . 1 1 131 131 VAL CG2 C 13 22.385 0.015 . 2 . . 817 . . 110 VAL CG2 . 26963 1 1233 . 1 1 131 131 VAL N N 15 127.886 0.007 . 1 . . 295 . . 110 VAL N . 26963 1 1234 . 1 1 132 132 ARG H H 1 8.122 0.004 . 1 . . 780 . . 111 ARG H . 26963 1 1235 . 1 1 132 132 ARG HA H 1 4.353 0.007 . 1 . . 857 . . 111 ARG HA . 26963 1 1236 . 1 1 132 132 ARG HB2 H 1 1.834 0.006 . 2 . . 860 . . 111 ARG HB2 . 26963 1 1237 . 1 1 132 132 ARG HB3 H 1 1.702 0.003 . 2 . . 861 . . 111 ARG HB3 . 26963 1 1238 . 1 1 132 132 ARG HG2 H 1 1.567 0.005 . 2 . . 862 . . 111 ARG HG2 . 26963 1 1239 . 1 1 132 132 ARG HG3 H 1 1.445 0.008 . 2 . . 863 . . 111 ARG HG3 . 26963 1 1240 . 1 1 132 132 ARG HD2 H 1 3.396 0.008 . 2 . . 858 . . 111 ARG HD2 . 26963 1 1241 . 1 1 132 132 ARG HD3 H 1 3.062 0.008 . 2 . . 859 . . 111 ARG HD3 . 26963 1 1242 . 1 1 132 132 ARG CA C 13 56.148 0.163 . 1 . . 782 . . 111 ARG CA . 26963 1 1243 . 1 1 132 132 ARG CB C 13 32.631 0.038 . 1 . . 781 . . 111 ARG CB . 26963 1 1244 . 1 1 132 132 ARG CG C 13 27.324 0.072 . 1 . . 864 . . 111 ARG CG . 26963 1 1245 . 1 1 132 132 ARG CD C 13 42.912 0.055 . 1 . . 865 . . 111 ARG CD . 26963 1 1246 . 1 1 132 132 ARG N N 15 134.379 0.006 . 1 . . 779 . . 111 ARG N . 26963 1 stop_ save_