################################### # 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 17403 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $standard _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 '2D 1H-15N HSQC' . . . 17403 1 2 '3D CBCA(CO)NH' . . . 17403 1 3 '3D HBHA(CO)NH' . . . 17403 1 4 '3D HNHA' . . . 17403 1 5 '3D HNCO' . . . 17403 1 6 '3D HNCACB' . . . 17403 1 7 '3D H(CCO)NH' . . . 17403 1 8 '3D C(CO)NH' . . . 17403 1 9 '3D HCCH-COSY' . . . 17403 1 10 '2D 1H-15N HMQC' . . . 17403 1 11 '2D 1H-13C HSQC aromatic' . . . 17403 1 12 '2D 1H-13C HSQC aliphatic' . . . 17403 1 13 '3D 1H-15N NOESY' . . . 17403 1 14 '3D 1H-13C NOESY aliphatic' . . . 17403 1 15 '3D 1H-13C NOESY aromatic' . . . 17403 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.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 1 1 GLY HA2 H 1 3.842 0.003 . 1 . 1591 . . -4 GLY HA2 . 17403 1 2 . 1 1 1 1 GLY HA3 H 1 3.842 0.003 . 1 . 1592 . . -4 GLY HA3 . 17403 1 3 . 1 1 1 1 GLY C C 13 170.125 . . 1 . 511 . . -4 GLY C . 17403 1 4 . 1 1 1 1 GLY CA C 13 43.249 0.066 . 1 . 508 . . -4 GLY CA . 17403 1 5 . 1 1 2 2 ALA H H 1 8.617 0.003 . 1 . 1655 . . -3 ALA H . 17403 1 6 . 1 1 2 2 ALA HA H 1 4.336 0.003 . 1 . 727 . . -3 ALA HA . 17403 1 7 . 1 1 2 2 ALA HB1 H 1 1.380 0.004 . 1 . 816 . . -3 ALA HB1 . 17403 1 8 . 1 1 2 2 ALA HB2 H 1 1.380 0.004 . 1 . 816 . . -3 ALA HB2 . 17403 1 9 . 1 1 2 2 ALA HB3 H 1 1.380 0.004 . 1 . 816 . . -3 ALA HB3 . 17403 1 10 . 1 1 2 2 ALA C C 13 177.827 . . 1 . 615 . . -3 ALA C . 17403 1 11 . 1 1 2 2 ALA CA C 13 52.610 0.042 . 1 . 401 . . -3 ALA CA . 17403 1 12 . 1 1 2 2 ALA CB C 13 19.369 0.015 . 1 . 402 . . -3 ALA CB . 17403 1 13 . 1 1 2 2 ALA N N 15 123.877 0.014 . 1 . 165 . . -3 ALA N . 17403 1 14 . 1 1 3 3 MET H H 1 8.464 0.004 . 1 . 171 . . -2 MET H . 17403 1 15 . 1 1 3 3 MET HA H 1 4.442 0.002 . 1 . 818 . . -2 MET HA . 17403 1 16 . 1 1 3 3 MET HB2 H 1 1.999 0.002 . 2 . 817 . . -2 MET HB2 . 17403 1 17 . 1 1 3 3 MET HB3 H 1 2.070 0.003 . 2 . 819 . . -2 MET HB3 . 17403 1 18 . 1 1 3 3 MET HG2 H 1 2.596 0.016 . 2 . 1128 . . -2 MET HG2 . 17403 1 19 . 1 1 3 3 MET HG3 H 1 2.542 0.016 . 2 . 1127 . . -2 MET HG3 . 17403 1 20 . 1 1 3 3 MET HE1 H 1 2.078 0.003 . 1 . 1356 . . -2 MET HE1 . 17403 1 21 . 1 1 3 3 MET HE2 H 1 2.078 0.003 . 1 . 1356 . . -2 MET HE2 . 17403 1 22 . 1 1 3 3 MET HE3 H 1 2.078 0.003 . 1 . 1356 . . -2 MET HE3 . 17403 1 23 . 1 1 3 3 MET C C 13 176.055 . . 1 . 654 . . -2 MET C . 17403 1 24 . 1 1 3 3 MET CA C 13 55.382 0.053 . 1 . 437 . . -2 MET CA . 17403 1 25 . 1 1 3 3 MET CB C 13 32.923 0.032 . 1 . 438 . . -2 MET CB . 17403 1 26 . 1 1 3 3 MET CG C 13 32.038 0.038 . 1 . 1129 . . -2 MET CG . 17403 1 27 . 1 1 3 3 MET CE C 13 16.985 . . 1 . 1357 . . -2 MET CE . 17403 1 28 . 1 1 3 3 MET N N 15 119.746 0.02 . 1 . 172 . . -2 MET N . 17403 1 29 . 1 1 4 4 ALA H H 1 8.349 0.004 . 1 . 222 . . -1 ALA H . 17403 1 30 . 1 1 4 4 ALA HA H 1 4.298 0.002 . 1 . 756 . . -1 ALA HA . 17403 1 31 . 1 1 4 4 ALA HB1 H 1 1.375 0.003 . 1 . 820 . . -1 ALA HB1 . 17403 1 32 . 1 1 4 4 ALA HB2 H 1 1.375 0.003 . 1 . 820 . . -1 ALA HB2 . 17403 1 33 . 1 1 4 4 ALA HB3 H 1 1.375 0.003 . 1 . 820 . . -1 ALA HB3 . 17403 1 34 . 1 1 4 4 ALA C C 13 177.452 . . 1 . 618 . . -1 ALA C . 17403 1 35 . 1 1 4 4 ALA CA C 13 52.560 0.041 . 1 . 696 . . -1 ALA CA . 17403 1 36 . 1 1 4 4 ALA CB C 13 19.171 0.015 . 1 . 695 . . -1 ALA CB . 17403 1 37 . 1 1 4 4 ALA N N 15 125.454 0.02 . 1 . 223 . . -1 ALA N . 17403 1 38 . 1 1 5 5 ASN H H 1 8.414 0.005 . 1 . 108 . . 0 ASN H . 17403 1 39 . 1 1 5 5 ASN HA H 1 4.699 0.003 . 1 . 791 . . 0 ASN HA . 17403 1 40 . 1 1 5 5 ASN HB2 H 1 2.845 0.005 . 2 . 821 . . 0 ASN HB2 . 17403 1 41 . 1 1 5 5 ASN HB3 H 1 2.789 0.004 . 2 . 822 . . 0 ASN HB3 . 17403 1 42 . 1 1 5 5 ASN HD21 H 1 7.604 0.005 . 1 . 269 . . 0 ASN HD21 . 17403 1 43 . 1 1 5 5 ASN HD22 H 1 6.910 0.018 . 1 . 205 . . 0 ASN HD22 . 17403 1 44 . 1 1 5 5 ASN C C 13 175.494 . . 1 . 547 . . 0 ASN C . 17403 1 45 . 1 1 5 5 ASN CA C 13 53.299 0.049 . 1 . 362 . . 0 ASN CA . 17403 1 46 . 1 1 5 5 ASN CB C 13 38.894 0.038 . 1 . 361 . . 0 ASN CB . 17403 1 47 . 1 1 5 5 ASN N N 15 118.027 0.022 . 1 . 109 . . 0 ASN N . 17403 1 48 . 1 1 5 5 ASN ND2 N 15 113.016 0.026 . 1 . 206 . . 0 ASN ND2 . 17403 1 49 . 1 1 6 6 SER H H 1 8.273 0.004 . 1 . 116 . . 1 SER H . 17403 1 50 . 1 1 6 6 SER HA H 1 4.437 0.002 . 1 . 775 . . 1 SER HA . 17403 1 51 . 1 1 6 6 SER HB2 H 1 3.927 0.007 . 2 . 823 . . 1 SER HB2 . 17403 1 52 . 1 1 6 6 SER HB3 H 1 3.848 0.006 . 2 . 824 . . 1 SER HB3 . 17403 1 53 . 1 1 6 6 SER C C 13 174.528 . . 1 . 630 . . 1 SER C . 17403 1 54 . 1 1 6 6 SER CA C 13 58.631 0.013 . 1 . 701 . . 1 SER CA . 17403 1 55 . 1 1 6 6 SER CB C 13 63.775 0.022 . 1 . 702 . . 1 SER CB . 17403 1 56 . 1 1 6 6 SER N N 15 116.077 0.021 . 1 . 117 . . 1 SER N . 17403 1 57 . 1 1 7 7 ASP H H 1 8.377 0.003 . 1 . 173 . . 2 ASP H . 17403 1 58 . 1 1 7 7 ASP HA H 1 4.637 0.002 . 1 . 783 . . 2 ASP HA . 17403 1 59 . 1 1 7 7 ASP HB2 H 1 2.719 0.012 . 2 . 1174 . . 2 ASP HB2 . 17403 1 60 . 1 1 7 7 ASP HB3 H 1 2.686 0.006 . 2 . 825 . . 2 ASP HB3 . 17403 1 61 . 1 1 7 7 ASP C C 13 176.577 . . 1 . 590 . . 2 ASP C . 17403 1 62 . 1 1 7 7 ASP CA C 13 54.571 0.034 . 1 . 707 . . 2 ASP CA . 17403 1 63 . 1 1 7 7 ASP CB C 13 41.177 0.037 . 1 . 706 . . 2 ASP CB . 17403 1 64 . 1 1 7 7 ASP N N 15 122.270 0.025 . 1 . 174 . . 2 ASP N . 17403 1 65 . 1 1 8 8 SER H H 1 8.196 0.004 . 1 . 51 . . 3 SER H . 17403 1 66 . 1 1 8 8 SER HA H 1 4.403 0.004 . 1 . 753 . . 3 SER HA . 17403 1 67 . 1 1 8 8 SER HB2 H 1 3.855 0.009 . 2 . 1348 . . 3 SER HB2 . 17403 1 68 . 1 1 8 8 SER HB3 H 1 3.909 0.009 . 2 . 1347 . . 3 SER HB3 . 17403 1 69 . 1 1 8 8 SER C C 13 174.668 . . 1 . 553 . . 3 SER C . 17403 1 70 . 1 1 8 8 SER CA C 13 58.708 0.036 . 1 . 693 . . 3 SER CA . 17403 1 71 . 1 1 8 8 SER CB C 13 63.651 0.052 . 1 . 694 . . 3 SER CB . 17403 1 72 . 1 1 8 8 SER N N 15 115.614 0.023 . 1 . 52 . . 3 SER N . 17403 1 73 . 1 1 9 9 CYS H H 1 8.213 0.003 . 1 . 17 . . 4 CYS H . 17403 1 74 . 1 1 9 9 CYS HA H 1 4.444 0.003 . 1 . 784 . . 4 CYS HA . 17403 1 75 . 1 1 9 9 CYS HB2 H 1 2.882 0.004 . 1 . 1135 . . 4 CYS HB2 . 17403 1 76 . 1 1 9 9 CYS HB3 H 1 2.882 0.004 . 1 . 826 . . 4 CYS HB3 . 17403 1 77 . 1 1 9 9 CYS C C 13 174.338 . . 1 . 655 . . 4 CYS C . 17403 1 78 . 1 1 9 9 CYS CA C 13 58.709 0.04 . 1 . 465 . . 4 CYS CA . 17403 1 79 . 1 1 9 9 CYS CB C 13 27.697 0.05 . 1 . 464 . . 4 CYS CB . 17403 1 80 . 1 1 9 9 CYS N N 15 120.200 0.028 . 1 . 18 . . 4 CYS N . 17403 1 81 . 1 1 10 10 HIS H H 1 8.353 0.005 . 1 . 1647 . . 5 HIS H . 17403 1 82 . 1 1 10 10 HIS HA H 1 4.696 0.003 . 1 . 829 . . 5 HIS HA . 17403 1 83 . 1 1 10 10 HIS HB2 H 1 3.102 0.002 . 2 . 827 . . 5 HIS HB2 . 17403 1 84 . 1 1 10 10 HIS HB3 H 1 3.237 0.003 . 2 . 828 . . 5 HIS HB3 . 17403 1 85 . 1 1 10 10 HIS HD2 H 1 7.201 0.005 . 1 . 1092 . . 5 HIS HD2 . 17403 1 86 . 1 1 10 10 HIS HE1 H 1 8.412 0.003 . 1 . 1094 . . 5 HIS HE1 . 17403 1 87 . 1 1 10 10 HIS C C 13 174.226 . . 1 . 557 . . 5 HIS C . 17403 1 88 . 1 1 10 10 HIS CA C 13 55.403 0.046 . 1 . 366 . . 5 HIS CA . 17403 1 89 . 1 1 10 10 HIS CB C 13 29.430 0.044 . 1 . 365 . . 5 HIS CB . 17403 1 90 . 1 1 10 10 HIS CD2 C 13 119.963 0.071 . 1 . 1093 . . 5 HIS CD2 . 17403 1 91 . 1 1 10 10 HIS CE1 C 13 136.872 0.018 . 1 . 1095 . . 5 HIS CE1 . 17403 1 92 . 1 1 10 10 HIS N N 15 121.037 0.022 . 1 . 249 . . 5 HIS N . 17403 1 93 . 1 1 10 10 HIS ND1 N 15 186.119 0.016 . 1 . 1639 . . 5 HIS ND1 . 17403 1 94 . 1 1 10 10 HIS NE2 N 15 175.957 0.004 . 1 . 1638 . . 5 HIS NE2 . 17403 1 95 . 1 1 11 11 LYS H H 1 8.237 0.005 . 1 . 120 . . 6 LYS H . 17403 1 96 . 1 1 11 11 LYS HA H 1 4.275 0.003 . 1 . 749 . . 6 LYS HA . 17403 1 97 . 1 1 11 11 LYS HB2 H 1 1.699 0.013 . 2 . 831 . . 6 LYS HB2 . 17403 1 98 . 1 1 11 11 LYS HB3 H 1 1.753 0.014 . 2 . 830 . . 6 LYS HB3 . 17403 1 99 . 1 1 11 11 LYS HG2 H 1 1.336 0.007 . 2 . 1339 . . 6 LYS HG2 . 17403 1 100 . 1 1 11 11 LYS HG3 H 1 1.365 0.015 . 2 . 1338 . . 6 LYS HG3 . 17403 1 101 . 1 1 11 11 LYS HD2 H 1 1.602 0.01 . 2 . 1343 . . 6 LYS HD2 . 17403 1 102 . 1 1 11 11 LYS HD3 H 1 1.550 0.009 . 2 . 1342 . . 6 LYS HD3 . 17403 1 103 . 1 1 11 11 LYS HE2 H 1 2.953 0.011 . 2 . 1345 . . 6 LYS HE2 . 17403 1 104 . 1 1 11 11 LYS HE3 H 1 2.899 0.002 . 2 . 1344 . . 6 LYS HE3 . 17403 1 105 . 1 1 11 11 LYS C C 13 175.963 . . 1 . 571 . . 6 LYS C . 17403 1 106 . 1 1 11 11 LYS CA C 13 56.282 0.058 . 1 . 1139 . . 6 LYS CA . 17403 1 107 . 1 1 11 11 LYS CB C 13 33.086 0.033 . 1 . 407 . . 6 LYS CB . 17403 1 108 . 1 1 11 11 LYS CG C 13 24.637 0.033 . 1 . 1340 . . 6 LYS CG . 17403 1 109 . 1 1 11 11 LYS CD C 13 29.173 0.032 . 1 . 1341 . . 6 LYS CD . 17403 1 110 . 1 1 11 11 LYS CE C 13 42.002 0.046 . 1 . 1346 . . 6 LYS CE . 17403 1 111 . 1 1 11 11 LYS N N 15 123.192 0.018 . 1 . 121 . . 6 LYS N . 17403 1 112 . 1 1 12 12 ILE H H 1 8.017 0.009 . 1 . 181 . . 7 ILE H . 17403 1 113 . 1 1 12 12 ILE HA H 1 3.898 0.006 . 1 . 724 . . 7 ILE HA . 17403 1 114 . 1 1 12 12 ILE HB H 1 1.427 0.003 . 1 . 1267 . . 7 ILE HB . 17403 1 115 . 1 1 12 12 ILE HG12 H 1 1.268 0.002 . 2 . 1270 . . 7 ILE HG12 . 17403 1 116 . 1 1 12 12 ILE HG13 H 1 0.944 0.002 . 2 . 1269 . . 7 ILE HG13 . 17403 1 117 . 1 1 12 12 ILE HG21 H 1 0.394 0.002 . 1 . 1268 . . 7 ILE HG21 . 17403 1 118 . 1 1 12 12 ILE HG22 H 1 0.394 0.002 . 1 . 1268 . . 7 ILE HG22 . 17403 1 119 . 1 1 12 12 ILE HG23 H 1 0.394 0.002 . 1 . 1268 . . 7 ILE HG23 . 17403 1 120 . 1 1 12 12 ILE HD11 H 1 0.728 0.003 . 1 . 1274 . . 7 ILE HD11 . 17403 1 121 . 1 1 12 12 ILE HD12 H 1 0.728 0.003 . 1 . 1274 . . 7 ILE HD12 . 17403 1 122 . 1 1 12 12 ILE HD13 H 1 0.728 0.003 . 1 . 1274 . . 7 ILE HD13 . 17403 1 123 . 1 1 12 12 ILE C C 13 174.374 . . 1 . 555 . . 7 ILE C . 17403 1 124 . 1 1 12 12 ILE CA C 13 60.521 0.045 . 1 . 436 . . 7 ILE CA . 17403 1 125 . 1 1 12 12 ILE CB C 13 39.297 0.03 . 1 . 435 . . 7 ILE CB . 17403 1 126 . 1 1 12 12 ILE CG1 C 13 27.484 0.035 . 1 . 1272 . . 7 ILE CG1 . 17403 1 127 . 1 1 12 12 ILE CG2 C 13 17.092 0.026 . 1 . 1271 . . 7 ILE CG2 . 17403 1 128 . 1 1 12 12 ILE CD1 C 13 12.857 0.034 . 1 . 1273 . . 7 ILE CD1 . 17403 1 129 . 1 1 12 12 ILE N N 15 123.514 0.032 . 1 . 182 . . 7 ILE N . 17403 1 130 . 1 1 13 13 ASP H H 1 8.225 0.009 . 1 . 220 . . 8 ASP H . 17403 1 131 . 1 1 13 13 ASP HA H 1 4.704 0.01 . 1 . 796 . . 8 ASP HA . 17403 1 132 . 1 1 13 13 ASP HB2 H 1 2.949 0.004 . 2 . 832 . . 8 ASP HB2 . 17403 1 133 . 1 1 13 13 ASP HB3 H 1 2.621 0.004 . 2 . 1175 . . 8 ASP HB3 . 17403 1 134 . 1 1 13 13 ASP C C 13 177.212 . . 1 . 668 . . 8 ASP C . 17403 1 135 . 1 1 13 13 ASP CA C 13 52.675 0.042 . 1 . 444 . . 8 ASP CA . 17403 1 136 . 1 1 13 13 ASP CB C 13 41.477 0.025 . 1 . 443 . . 8 ASP CB . 17403 1 137 . 1 1 13 13 ASP N N 15 123.918 0.02 . 1 . 221 . . 8 ASP N . 17403 1 138 . 1 1 14 14 TYR H H 1 8.519 0.003 . 1 . 229 . . 9 TYR H . 17403 1 139 . 1 1 14 14 TYR HA H 1 4.531 0.015 . 1 . 750 . . 9 TYR HA . 17403 1 140 . 1 1 14 14 TYR HB2 H 1 3.123 0.005 . 2 . 833 . . 9 TYR HB2 . 17403 1 141 . 1 1 14 14 TYR HB3 H 1 3.272 0.006 . 2 . 834 . . 9 TYR HB3 . 17403 1 142 . 1 1 14 14 TYR HD1 H 1 7.196 0.005 . 3 . 1056 . . 9 TYR HD1 . 17403 1 143 . 1 1 14 14 TYR HD2 H 1 7.196 0.005 . 3 . 1056 . . 9 TYR HD2 . 17403 1 144 . 1 1 14 14 TYR HE1 H 1 6.816 0.002 . 3 . 1068 . . 9 TYR HE1 . 17403 1 145 . 1 1 14 14 TYR HE2 H 1 6.816 0.002 . 3 . 1068 . . 9 TYR HE2 . 17403 1 146 . 1 1 14 14 TYR HH H 1 8.021 0.003 . 1 . 1695 . . 9 TYR HH . 17403 1 147 . 1 1 14 14 TYR C C 13 178.532 . . 1 . 542 . . 9 TYR C . 17403 1 148 . 1 1 14 14 TYR CA C 13 61.104 0.054 . 1 . 475 . . 9 TYR CA . 17403 1 149 . 1 1 14 14 TYR CB C 13 36.817 0.039 . 1 . 474 . . 9 TYR CB . 17403 1 150 . 1 1 14 14 TYR CD1 C 13 132.615 0.047 . 3 . 1057 . . 9 TYR CD1 . 17403 1 151 . 1 1 14 14 TYR CD2 C 13 132.615 0.047 . 3 . 1057 . . 9 TYR CD2 . 17403 1 152 . 1 1 14 14 TYR CE1 C 13 118.535 0.027 . 3 . 1069 . . 9 TYR CE1 . 17403 1 153 . 1 1 14 14 TYR CE2 C 13 118.535 0.027 . 3 . 1069 . . 9 TYR CE2 . 17403 1 154 . 1 1 14 14 TYR N N 15 125.966 0.024 . 1 . 230 . . 9 TYR N . 17403 1 155 . 1 1 15 15 GLY H H 1 8.896 0.002 . 1 . 263 . . 10 GLY H . 17403 1 156 . 1 1 15 15 GLY HA2 H 1 3.913 0.016 . 2 . 755 . . 10 GLY HA2 . 17403 1 157 . 1 1 15 15 GLY HA3 H 1 4.597 0.011 . 2 . 527 . . 10 GLY HA3 . 17403 1 158 . 1 1 15 15 GLY C C 13 176.553 . . 1 . 545 . . 10 GLY C . 17403 1 159 . 1 1 15 15 GLY CA C 13 47.569 0.033 . 1 . 472 . . 10 GLY CA . 17403 1 160 . 1 1 15 15 GLY N N 15 107.864 0.029 . 1 . 264 . . 10 GLY N . 17403 1 161 . 1 1 16 16 LEU H H 1 8.273 0.007 . 1 . 259 . . 11 LEU H . 17403 1 162 . 1 1 16 16 LEU HA H 1 4.146 0.004 . 1 . 802 . . 11 LEU HA . 17403 1 163 . 1 1 16 16 LEU HB2 H 1 1.595 0.011 . 2 . 835 . . 11 LEU HB2 . 17403 1 164 . 1 1 16 16 LEU HB3 H 1 2.104 0.013 . 2 . 836 . . 11 LEU HB3 . 17403 1 165 . 1 1 16 16 LEU HG H 1 1.821 0.005 . 1 . 1358 . . 11 LEU HG . 17403 1 166 . 1 1 16 16 LEU HD11 H 1 1.018 0.02 . 2 . 1361 . . 11 LEU HD11 . 17403 1 167 . 1 1 16 16 LEU HD12 H 1 1.018 0.02 . 2 . 1361 . . 11 LEU HD12 . 17403 1 168 . 1 1 16 16 LEU HD13 H 1 1.018 0.02 . 2 . 1361 . . 11 LEU HD13 . 17403 1 169 . 1 1 16 16 LEU HD21 H 1 0.971 0.019 . 2 . 1360 . . 11 LEU HD21 . 17403 1 170 . 1 1 16 16 LEU HD22 H 1 0.971 0.019 . 2 . 1360 . . 11 LEU HD22 . 17403 1 171 . 1 1 16 16 LEU HD23 H 1 0.971 0.019 . 2 . 1360 . . 11 LEU HD23 . 17403 1 172 . 1 1 16 16 LEU C C 13 178.138 . . 1 . 585 . . 11 LEU C . 17403 1 173 . 1 1 16 16 LEU CA C 13 58.095 0.063 . 1 . 477 . . 11 LEU CA . 17403 1 174 . 1 1 16 16 LEU CB C 13 41.428 0.027 . 1 . 476 . . 11 LEU CB . 17403 1 175 . 1 1 16 16 LEU CG C 13 26.976 0.041 . 1 . 1359 . . 11 LEU CG . 17403 1 176 . 1 1 16 16 LEU CD1 C 13 26.168 0.035 . 2 . 1362 . . 11 LEU CD1 . 17403 1 177 . 1 1 16 16 LEU CD2 C 13 23.258 0.019 . 2 . 1363 . . 11 LEU CD2 . 17403 1 178 . 1 1 16 16 LEU N N 15 127.671 0.014 . 1 . 260 . . 11 LEU N . 17403 1 179 . 1 1 17 17 TYR H H 1 7.868 0.004 . 1 . 265 . . 12 TYR H . 17403 1 180 . 1 1 17 17 TYR HA H 1 4.915 0.006 . 1 . 730 . . 12 TYR HA . 17403 1 181 . 1 1 17 17 TYR HB2 H 1 3.136 0.006 . 2 . 837 . . 12 TYR HB2 . 17403 1 182 . 1 1 17 17 TYR HB3 H 1 3.463 0.004 . 2 . 838 . . 12 TYR HB3 . 17403 1 183 . 1 1 17 17 TYR HD1 H 1 7.311 0.008 . 3 . 1062 . . 12 TYR HD1 . 17403 1 184 . 1 1 17 17 TYR HD2 H 1 7.311 0.008 . 3 . 1062 . . 12 TYR HD2 . 17403 1 185 . 1 1 17 17 TYR HE1 H 1 6.955 0.013 . 3 . 1064 . . 12 TYR HE1 . 17403 1 186 . 1 1 17 17 TYR HE2 H 1 6.955 0.013 . 3 . 1064 . . 12 TYR HE2 . 17403 1 187 . 1 1 17 17 TYR C C 13 177.494 . . 1 . 670 . . 12 TYR C . 17403 1 188 . 1 1 17 17 TYR CA C 13 58.747 0.078 . 1 . 393 . . 12 TYR CA . 17403 1 189 . 1 1 17 17 TYR CB C 13 38.295 0.039 . 1 . 392 . . 12 TYR CB . 17403 1 190 . 1 1 17 17 TYR CD1 C 13 132.856 0.013 . 3 . 1063 . . 12 TYR CD1 . 17403 1 191 . 1 1 17 17 TYR CD2 C 13 132.856 0.013 . 3 . 1063 . . 12 TYR CD2 . 17403 1 192 . 1 1 17 17 TYR CE1 C 13 118.381 0.017 . 3 . 1065 . . 12 TYR CE1 . 17403 1 193 . 1 1 17 17 TYR CE2 C 13 118.381 0.017 . 3 . 1065 . . 12 TYR CE2 . 17403 1 194 . 1 1 17 17 TYR N N 15 119.362 0.023 . 1 . 266 . . 12 TYR N . 17403 1 195 . 1 1 18 18 ALA H H 1 8.642 0.005 . 1 . 156 . . 13 ALA H . 17403 1 196 . 1 1 18 18 ALA HA H 1 3.874 0.01 . 1 . 840 . . 13 ALA HA . 17403 1 197 . 1 1 18 18 ALA HB1 H 1 1.719 0.007 . 1 . 839 . . 13 ALA HB1 . 17403 1 198 . 1 1 18 18 ALA HB2 H 1 1.719 0.007 . 1 . 839 . . 13 ALA HB2 . 17403 1 199 . 1 1 18 18 ALA HB3 H 1 1.719 0.007 . 1 . 839 . . 13 ALA HB3 . 17403 1 200 . 1 1 18 18 ALA C C 13 179.469 . . 1 . 567 . . 13 ALA C . 17403 1 201 . 1 1 18 18 ALA CA C 13 55.310 0.032 . 1 . 468 . . 13 ALA CA . 17403 1 202 . 1 1 18 18 ALA CB C 13 19.210 0.03 . 1 . 469 . . 13 ALA CB . 17403 1 203 . 1 1 18 18 ALA N N 15 118.184 0.025 . 1 . 157 . . 13 ALA N . 17403 1 204 . 1 1 19 19 LEU H H 1 8.018 0.006 . 1 . 252 . . 14 LEU H . 17403 1 205 . 1 1 19 19 LEU HA H 1 4.064 0.003 . 1 . 799 . . 14 LEU HA . 17403 1 206 . 1 1 19 19 LEU HB2 H 1 1.458 0.011 . 2 . 841 . . 14 LEU HB2 . 17403 1 207 . 1 1 19 19 LEU HB3 H 1 1.918 0.005 . 2 . 842 . . 14 LEU HB3 . 17403 1 208 . 1 1 19 19 LEU HG H 1 1.251 0.005 . 1 . 1364 . . 14 LEU HG . 17403 1 209 . 1 1 19 19 LEU HD11 H 1 0.181 0.005 . 2 . 1366 . . 14 LEU HD11 . 17403 1 210 . 1 1 19 19 LEU HD12 H 1 0.181 0.005 . 2 . 1366 . . 14 LEU HD12 . 17403 1 211 . 1 1 19 19 LEU HD13 H 1 0.181 0.005 . 2 . 1366 . . 14 LEU HD13 . 17403 1 212 . 1 1 19 19 LEU HD21 H 1 0.104 0.004 . 2 . 1367 . . 14 LEU HD21 . 17403 1 213 . 1 1 19 19 LEU HD22 H 1 0.104 0.004 . 2 . 1367 . . 14 LEU HD22 . 17403 1 214 . 1 1 19 19 LEU HD23 H 1 0.104 0.004 . 2 . 1367 . . 14 LEU HD23 . 17403 1 215 . 1 1 19 19 LEU C C 13 177.395 . . 1 . 587 . . 14 LEU C . 17403 1 216 . 1 1 19 19 LEU CA C 13 58.292 0.041 . 1 . 710 . . 14 LEU CA . 17403 1 217 . 1 1 19 19 LEU CB C 13 41.200 0.036 . 1 . 709 . . 14 LEU CB . 17403 1 218 . 1 1 19 19 LEU CG C 13 26.625 0.031 . 1 . 1365 . . 14 LEU CG . 17403 1 219 . 1 1 19 19 LEU CD1 C 13 25.656 0.028 . 2 . 1368 . . 14 LEU CD1 . 17403 1 220 . 1 1 19 19 LEU CD2 C 13 22.601 0.013 . 2 . 1691 . . 14 LEU CD2 . 17403 1 221 . 1 1 19 19 LEU N N 15 116.932 0.021 . 1 . 253 . . 14 LEU N . 17403 1 222 . 1 1 20 20 GLU H H 1 8.061 0.014 . 1 . 60 . . 15 GLU H . 17403 1 223 . 1 1 20 20 GLU HA H 1 3.813 0.005 . 1 . 1516 . . 15 GLU HA . 17403 1 224 . 1 1 20 20 GLU HB2 H 1 2.372 0.018 . 2 . 1518 . . 15 GLU HB2 . 17403 1 225 . 1 1 20 20 GLU HB3 H 1 2.315 0.015 . 2 . 1517 . . 15 GLU HB3 . 17403 1 226 . 1 1 20 20 GLU HG2 H 1 2.480 0.005 . 2 . 1520 . . 15 GLU HG2 . 17403 1 227 . 1 1 20 20 GLU HG3 H 1 2.062 0.004 . 2 . 1576 . . 15 GLU HG3 . 17403 1 228 . 1 1 20 20 GLU C C 13 179.135 . . 1 . 589 . . 15 GLU C . 17403 1 229 . 1 1 20 20 GLU CA C 13 60.545 0.044 . 1 . 685 . . 15 GLU CA . 17403 1 230 . 1 1 20 20 GLU CB C 13 29.978 0.039 . 1 . 1519 . . 15 GLU CB . 17403 1 231 . 1 1 20 20 GLU CG C 13 36.420 0.038 . 1 . 1577 . . 15 GLU CG . 17403 1 232 . 1 1 20 20 GLU N N 15 118.195 0.031 . 1 . 61 . . 15 GLU N . 17403 1 233 . 1 1 21 21 ILE H H 1 8.051 0.014 . 1 . 114 . . 16 ILE H . 17403 1 234 . 1 1 21 21 ILE HA H 1 3.709 0.015 . 1 . 844 . . 16 ILE HA . 17403 1 235 . 1 1 21 21 ILE HB H 1 1.625 0.003 . 1 . 843 . . 16 ILE HB . 17403 1 236 . 1 1 21 21 ILE HG12 H 1 0.908 0.008 . 2 . 1276 . . 16 ILE HG12 . 17403 1 237 . 1 1 21 21 ILE HG13 H 1 1.022 0.014 . 2 . 1277 . . 16 ILE HG13 . 17403 1 238 . 1 1 21 21 ILE HG21 H 1 0.468 0.009 . 1 . 1275 . . 16 ILE HG21 . 17403 1 239 . 1 1 21 21 ILE HG22 H 1 0.468 0.009 . 1 . 1275 . . 16 ILE HG22 . 17403 1 240 . 1 1 21 21 ILE HG23 H 1 0.468 0.009 . 1 . 1275 . . 16 ILE HG23 . 17403 1 241 . 1 1 21 21 ILE HD11 H 1 0.198 0.006 . 1 . 1280 . . 16 ILE HD11 . 17403 1 242 . 1 1 21 21 ILE HD12 H 1 0.198 0.006 . 1 . 1280 . . 16 ILE HD12 . 17403 1 243 . 1 1 21 21 ILE HD13 H 1 0.198 0.006 . 1 . 1280 . . 16 ILE HD13 . 17403 1 244 . 1 1 21 21 ILE C C 13 179.276 . . 1 . 666 . . 16 ILE C . 17403 1 245 . 1 1 21 21 ILE CA C 13 63.706 0.073 . 1 . 681 . . 16 ILE CA . 17403 1 246 . 1 1 21 21 ILE CB C 13 37.481 0.052 . 1 . 682 . . 16 ILE CB . 17403 1 247 . 1 1 21 21 ILE CG1 C 13 27.254 0.027 . 1 . 1279 . . 16 ILE CG1 . 17403 1 248 . 1 1 21 21 ILE CG2 C 13 17.530 0.052 . 1 . 1278 . . 16 ILE CG2 . 17403 1 249 . 1 1 21 21 ILE CD1 C 13 12.069 0.013 . 1 . 1281 . . 16 ILE CD1 . 17403 1 250 . 1 1 21 21 ILE N N 15 118.474 0.101 . 1 . 115 . . 16 ILE N . 17403 1 251 . 1 1 22 22 LEU H H 1 8.669 0.011 . 1 . 29 . . 17 LEU H . 17403 1 252 . 1 1 22 22 LEU HA H 1 4.067 0.016 . 1 . 812 . . 17 LEU HA . 17403 1 253 . 1 1 22 22 LEU HB2 H 1 1.309 0.005 . 2 . 845 . . 17 LEU HB2 . 17403 1 254 . 1 1 22 22 LEU HB3 H 1 2.059 0.013 . 2 . 846 . . 17 LEU HB3 . 17403 1 255 . 1 1 22 22 LEU HG H 1 1.878 0.017 . 1 . 1369 . . 17 LEU HG . 17403 1 256 . 1 1 22 22 LEU HD11 H 1 0.775 0.014 . 2 . 1372 . . 17 LEU HD11 . 17403 1 257 . 1 1 22 22 LEU HD12 H 1 0.775 0.014 . 2 . 1372 . . 17 LEU HD12 . 17403 1 258 . 1 1 22 22 LEU HD13 H 1 0.775 0.014 . 2 . 1372 . . 17 LEU HD13 . 17403 1 259 . 1 1 22 22 LEU HD21 H 1 1.007 0.012 . 2 . 1371 . . 17 LEU HD21 . 17403 1 260 . 1 1 22 22 LEU HD22 H 1 1.007 0.012 . 2 . 1371 . . 17 LEU HD22 . 17403 1 261 . 1 1 22 22 LEU HD23 H 1 1.007 0.012 . 2 . 1371 . . 17 LEU HD23 . 17403 1 262 . 1 1 22 22 LEU C C 13 178.730 . . 1 . 597 . . 17 LEU C . 17403 1 263 . 1 1 22 22 LEU CA C 13 58.050 0.089 . 1 . 536 . . 17 LEU CA . 17403 1 264 . 1 1 22 22 LEU CB C 13 41.859 0.045 . 1 . 339 . . 17 LEU CB . 17403 1 265 . 1 1 22 22 LEU CG C 13 27.561 0.05 . 1 . 1370 . . 17 LEU CG . 17403 1 266 . 1 1 22 22 LEU CD1 C 13 22.551 0.035 . 2 . 1374 . . 17 LEU CD1 . 17403 1 267 . 1 1 22 22 LEU CD2 C 13 26.166 0.023 . 2 . 1373 . . 17 LEU CD2 . 17403 1 268 . 1 1 22 22 LEU N N 15 120.991 0.04 . 1 . 30 . . 17 LEU N . 17403 1 269 . 1 1 23 23 ALA H H 1 8.829 0.007 . 1 . 75 . . 18 ALA H . 17403 1 270 . 1 1 23 23 ALA HA H 1 3.967 0.013 . 1 . 738 . . 18 ALA HA . 17403 1 271 . 1 1 23 23 ALA HB1 H 1 1.386 0.003 . 1 . 847 . . 18 ALA HB1 . 17403 1 272 . 1 1 23 23 ALA HB2 H 1 1.386 0.003 . 1 . 847 . . 18 ALA HB2 . 17403 1 273 . 1 1 23 23 ALA HB3 H 1 1.386 0.003 . 1 . 847 . . 18 ALA HB3 . 17403 1 274 . 1 1 23 23 ALA C C 13 179.770 . . 1 . 549 . . 18 ALA C . 17403 1 275 . 1 1 23 23 ALA CA C 13 55.890 0.054 . 1 . 305 . . 18 ALA CA . 17403 1 276 . 1 1 23 23 ALA CB C 13 17.834 0.026 . 1 . 304 . . 18 ALA CB . 17403 1 277 . 1 1 23 23 ALA N N 15 121.341 0.027 . 1 . 76 . . 18 ALA N . 17403 1 278 . 1 1 24 24 GLN H H 1 7.746 0.004 . 1 . 9 . . 19 GLN H . 17403 1 279 . 1 1 24 24 GLN HA H 1 4.120 0.011 . 1 . 808 . . 19 GLN HA . 17403 1 280 . 1 1 24 24 GLN HB2 H 1 2.292 0.008 . 2 . 849 . . 19 GLN HB2 . 17403 1 281 . 1 1 24 24 GLN HB3 H 1 2.164 0.003 . 2 . 848 . . 19 GLN HB3 . 17403 1 282 . 1 1 24 24 GLN HG2 H 1 2.399 0.003 . 2 . 1146 . . 19 GLN HG2 . 17403 1 283 . 1 1 24 24 GLN HG3 H 1 2.576 0.002 . 2 . 1147 . . 19 GLN HG3 . 17403 1 284 . 1 1 24 24 GLN HE21 H 1 7.360 0.003 . 1 . 169 . . 19 GLN HE21 . 17403 1 285 . 1 1 24 24 GLN HE22 H 1 6.779 0.004 . 1 . 212 . . 19 GLN HE22 . 17403 1 286 . 1 1 24 24 GLN C C 13 180.281 . . 1 . 593 . . 19 GLN C . 17403 1 287 . 1 1 24 24 GLN CA C 13 59.077 0.045 . 1 . 713 . . 19 GLN CA . 17403 1 288 . 1 1 24 24 GLN CB C 13 28.117 0.051 . 1 . 379 . . 19 GLN CB . 17403 1 289 . 1 1 24 24 GLN CG C 13 34.165 0.029 . 1 . 1148 . . 19 GLN CG . 17403 1 290 . 1 1 24 24 GLN N N 15 117.098 0.049 . 1 . 10 . . 19 GLN N . 17403 1 291 . 1 1 24 24 GLN NE2 N 15 110.961 0.035 . 1 . 170 . . 19 GLN NE2 . 17403 1 292 . 1 1 25 25 TYR H H 1 8.073 0.005 . 1 . 138 . . 20 TYR H . 17403 1 293 . 1 1 25 25 TYR HA H 1 3.994 0.003 . 1 . 852 . . 20 TYR HA . 17403 1 294 . 1 1 25 25 TYR HB2 H 1 3.063 0.016 . 2 . 851 . . 20 TYR HB2 . 17403 1 295 . 1 1 25 25 TYR HB3 H 1 3.028 0.018 . 2 . 850 . . 20 TYR HB3 . 17403 1 296 . 1 1 25 25 TYR HD1 H 1 6.504 0.005 . 3 . 1058 . . 20 TYR HD1 . 17403 1 297 . 1 1 25 25 TYR HD2 H 1 6.504 0.005 . 3 . 1058 . . 20 TYR HD2 . 17403 1 298 . 1 1 25 25 TYR HE1 H 1 6.603 0.003 . 3 . 1071 . . 20 TYR HE1 . 17403 1 299 . 1 1 25 25 TYR HE2 H 1 6.603 0.003 . 3 . 1071 . . 20 TYR HE2 . 17403 1 300 . 1 1 25 25 TYR HH H 1 6.977 . . 1 . 1678 . . 20 TYR HH . 17403 1 301 . 1 1 25 25 TYR C C 13 176.433 . . 1 . 596 . . 20 TYR C . 17403 1 302 . 1 1 25 25 TYR CA C 13 61.312 0.064 . 1 . 487 . . 20 TYR CA . 17403 1 303 . 1 1 25 25 TYR CB C 13 38.076 0.057 . 1 . 486 . . 20 TYR CB . 17403 1 304 . 1 1 25 25 TYR CD1 C 13 132.613 0.013 . 3 . 1059 . . 20 TYR CD1 . 17403 1 305 . 1 1 25 25 TYR CD2 C 13 132.613 0.013 . 3 . 1059 . . 20 TYR CD2 . 17403 1 306 . 1 1 25 25 TYR CE1 C 13 118.043 0.018 . 3 . 1070 . . 20 TYR CE1 . 17403 1 307 . 1 1 25 25 TYR CE2 C 13 118.043 0.018 . 3 . 1070 . . 20 TYR CE2 . 17403 1 308 . 1 1 25 25 TYR N N 15 121.600 0.049 . 1 . 139 . . 20 TYR N . 17403 1 309 . 1 1 26 26 HIS H H 1 7.546 0.002 . 1 . 1618 . . 21 HIS H . 17403 1 310 . 1 1 26 26 HIS HA H 1 4.366 0.015 . 1 . 794 . . 21 HIS HA . 17403 1 311 . 1 1 26 26 HIS HB2 H 1 2.767 0.006 . 2 . 853 . . 21 HIS HB2 . 17403 1 312 . 1 1 26 26 HIS HB3 H 1 3.419 0.004 . 2 . 854 . . 21 HIS HB3 . 17403 1 313 . 1 1 26 26 HIS HD2 H 1 7.185 0.011 . 1 . 1617 . . 21 HIS HD2 . 17403 1 314 . 1 1 26 26 HIS HE1 H 1 7.965 0.004 . 1 . 1629 . . 21 HIS HE1 . 17403 1 315 . 1 1 26 26 HIS C C 13 173.351 0.0 . 1 . 581 . . 21 HIS C . 17403 1 316 . 1 1 26 26 HIS CA C 13 56.987 0.06 . 1 . 1620 . . 21 HIS CA . 17403 1 317 . 1 1 26 26 HIS CB C 13 31.020 0.034 . 1 . 333 . . 21 HIS CB . 17403 1 318 . 1 1 26 26 HIS CD2 C 13 118.261 0.021 . 1 . 1616 . . 21 HIS CD2 . 17403 1 319 . 1 1 26 26 HIS CE1 C 13 138.830 0.001 . 1 . 1628 . . 21 HIS CE1 . 17403 1 320 . 1 1 26 26 HIS N N 15 115.282 0.022 . 1 . 1619 . . 21 HIS N . 17403 1 321 . 1 1 26 26 HIS ND1 N 15 234.471 . . 1 . 1643 . . 21 HIS ND1 . 17403 1 322 . 1 1 26 26 HIS NE2 N 15 170.453 0.0 . 1 . 1642 . . 21 HIS NE2 . 17403 1 323 . 1 1 27 27 ASN H H 1 7.959 0.002 . 1 . 66 . . 22 ASN H . 17403 1 324 . 1 1 27 27 ASN HA H 1 4.329 0.021 . 1 . 813 . . 22 ASN HA . 17403 1 325 . 1 1 27 27 ASN HB2 H 1 3.105 0.004 . 2 . 855 . . 22 ASN HB2 . 17403 1 326 . 1 1 27 27 ASN HB3 H 1 2.784 0.002 . 2 . 870 . . 22 ASN HB3 . 17403 1 327 . 1 1 27 27 ASN HD21 H 1 6.759 0.005 . 1 . 102 . . 22 ASN HD21 . 17403 1 328 . 1 1 27 27 ASN HD22 H 1 7.439 0.001 . 1 . 168 . . 22 ASN HD22 . 17403 1 329 . 1 1 27 27 ASN C C 13 174.040 . . 1 . 631 . . 22 ASN C . 17403 1 330 . 1 1 27 27 ASN CA C 13 54.577 0.043 . 1 . 430 . . 22 ASN CA . 17403 1 331 . 1 1 27 27 ASN CB C 13 37.274 0.042 . 1 . 429 . . 22 ASN CB . 17403 1 332 . 1 1 27 27 ASN N N 15 115.161 0.032 . 1 . 67 . . 22 ASN N . 17403 1 333 . 1 1 27 27 ASN ND2 N 15 112.566 0.03 . 1 . 103 . . 22 ASN ND2 . 17403 1 334 . 1 1 28 28 VAL H H 1 8.260 0.006 . 1 . 213 . . 23 VAL H . 17403 1 335 . 1 1 28 28 VAL HA H 1 4.379 0.004 . 1 . 740 . . 23 VAL HA . 17403 1 336 . 1 1 28 28 VAL HB H 1 1.999 0.002 . 1 . 856 . . 23 VAL HB . 17403 1 337 . 1 1 28 28 VAL HG11 H 1 0.954 0.012 . 2 . 1221 . . 23 VAL HG11 . 17403 1 338 . 1 1 28 28 VAL HG12 H 1 0.954 0.012 . 2 . 1221 . . 23 VAL HG12 . 17403 1 339 . 1 1 28 28 VAL HG13 H 1 0.954 0.012 . 2 . 1221 . . 23 VAL HG13 . 17403 1 340 . 1 1 28 28 VAL HG21 H 1 0.906 0.012 . 2 . 1220 . . 23 VAL HG21 . 17403 1 341 . 1 1 28 28 VAL HG22 H 1 0.906 0.012 . 2 . 1220 . . 23 VAL HG22 . 17403 1 342 . 1 1 28 28 VAL HG23 H 1 0.906 0.012 . 2 . 1220 . . 23 VAL HG23 . 17403 1 343 . 1 1 28 28 VAL C C 13 175.227 . . 1 . 636 . . 23 VAL C . 17403 1 344 . 1 1 28 28 VAL CA C 13 60.963 0.045 . 1 . 502 . . 23 VAL CA . 17403 1 345 . 1 1 28 28 VAL CB C 13 34.029 0.039 . 1 . 501 . . 23 VAL CB . 17403 1 346 . 1 1 28 28 VAL CG1 C 13 21.841 0.025 . 2 . 1223 . . 23 VAL CG1 . 17403 1 347 . 1 1 28 28 VAL CG2 C 13 20.754 0.028 . 2 . 1222 . . 23 VAL CG2 . 17403 1 348 . 1 1 28 28 VAL N N 15 117.517 0.026 . 1 . 214 . . 23 VAL N . 17403 1 349 . 1 1 29 29 SER H H 1 8.366 0.005 . 1 . 291 . . 24 SER H . 17403 1 350 . 1 1 29 29 SER HA H 1 4.436 0.014 . 1 . 770 . . 24 SER HA . 17403 1 351 . 1 1 29 29 SER HB2 H 1 3.784 0.017 . 2 . 1443 . . 24 SER HB2 . 17403 1 352 . 1 1 29 29 SER HB3 H 1 3.755 0.02 . 2 . 857 . . 24 SER HB3 . 17403 1 353 . 1 1 29 29 SER C C 13 173.452 . . 1 . 599 . . 24 SER C . 17403 1 354 . 1 1 29 29 SER CA C 13 58.148 0.067 . 1 . 418 . . 24 SER CA . 17403 1 355 . 1 1 29 29 SER CB C 13 63.625 0.059 . 1 . 419 . . 24 SER CB . 17403 1 356 . 1 1 29 29 SER N N 15 120.413 0.024 . 1 . 290 . . 24 SER N . 17403 1 357 . 1 1 30 30 VAL H H 1 8.258 0.005 . 1 . 195 . . 25 VAL H . 17403 1 358 . 1 1 30 30 VAL HA H 1 4.252 0.003 . 1 . 764 . . 25 VAL HA . 17403 1 359 . 1 1 30 30 VAL HB H 1 1.913 0.005 . 1 . 858 . . 25 VAL HB . 17403 1 360 . 1 1 30 30 VAL HG11 H 1 0.741 0.012 . 2 . 1107 . . 25 VAL HG11 . 17403 1 361 . 1 1 30 30 VAL HG12 H 1 0.741 0.012 . 2 . 1107 . . 25 VAL HG12 . 17403 1 362 . 1 1 30 30 VAL HG13 H 1 0.741 0.012 . 2 . 1107 . . 25 VAL HG13 . 17403 1 363 . 1 1 30 30 VAL HG21 H 1 0.824 0.01 . 2 . 1106 . . 25 VAL HG21 . 17403 1 364 . 1 1 30 30 VAL HG22 H 1 0.824 0.01 . 2 . 1106 . . 25 VAL HG22 . 17403 1 365 . 1 1 30 30 VAL HG23 H 1 0.824 0.01 . 2 . 1106 . . 25 VAL HG23 . 17403 1 366 . 1 1 30 30 VAL C C 13 172.922 . . 1 . 611 . . 25 VAL C . 17403 1 367 . 1 1 30 30 VAL CA C 13 60.290 0.05 . 1 . 352 . . 25 VAL CA . 17403 1 368 . 1 1 30 30 VAL CB C 13 34.258 0.025 . 1 . 351 . . 25 VAL CB . 17403 1 369 . 1 1 30 30 VAL CG1 C 13 22.775 0.024 . 2 . 1350 . . 25 VAL CG1 . 17403 1 370 . 1 1 30 30 VAL CG2 C 13 20.326 0.019 . 2 . 1105 . . 25 VAL CG2 . 17403 1 371 . 1 1 30 30 VAL N N 15 121.723 0.051 . 1 . 196 . . 25 VAL N . 17403 1 372 . 1 1 31 31 ASN H H 1 8.661 0.002 . 1 . 100 . . 26 ASN H . 17403 1 373 . 1 1 31 31 ASN HA H 1 5.298 0.002 . 1 . 810 . . 26 ASN HA . 17403 1 374 . 1 1 31 31 ASN HB2 H 1 2.755 0.003 . 2 . 1130 . . 26 ASN HB2 . 17403 1 375 . 1 1 31 31 ASN HB3 H 1 3.117 0.004 . 2 . 1131 . . 26 ASN HB3 . 17403 1 376 . 1 1 31 31 ASN HD21 H 1 7.741 0.002 . 1 . 74 . . 26 ASN HD21 . 17403 1 377 . 1 1 31 31 ASN HD22 H 1 7.126 0.002 . 1 . 15 . . 26 ASN HD22 . 17403 1 378 . 1 1 31 31 ASN CA C 13 49.226 0.024 . 1 . 714 . . 26 ASN CA . 17403 1 379 . 1 1 31 31 ASN CB C 13 38.663 0.039 . 1 . 715 . . 26 ASN CB . 17403 1 380 . 1 1 31 31 ASN N N 15 125.397 0.024 . 1 . 101 . . 26 ASN N . 17403 1 381 . 1 1 31 31 ASN ND2 N 15 112.864 0.038 . 1 . 16 . . 26 ASN ND2 . 17403 1 382 . 1 1 32 32 PRO HA H 1 3.962 0.006 . 1 . 859 . . 27 PRO HA . 17403 1 383 . 1 1 32 32 PRO HB2 H 1 2.282 0.007 . 2 . 861 . . 27 PRO HB2 . 17403 1 384 . 1 1 32 32 PRO HB3 H 1 2.128 0.012 . 2 . 860 . . 27 PRO HB3 . 17403 1 385 . 1 1 32 32 PRO HG2 H 1 2.244 0.011 . 2 . 1110 . . 27 PRO HG2 . 17403 1 386 . 1 1 32 32 PRO HG3 H 1 1.934 0.005 . 2 . 1108 . . 27 PRO HG3 . 17403 1 387 . 1 1 32 32 PRO HD2 H 1 4.069 0.009 . 2 . 1113 . . 27 PRO HD2 . 17403 1 388 . 1 1 32 32 PRO HD3 H 1 3.936 0.011 . 2 . 1112 . . 27 PRO HD3 . 17403 1 389 . 1 1 32 32 PRO C C 13 177.599 . . 1 . 626 . . 27 PRO C . 17403 1 390 . 1 1 32 32 PRO CA C 13 65.476 0.044 . 1 . 506 . . 27 PRO CA . 17403 1 391 . 1 1 32 32 PRO CB C 13 32.411 0.041 . 1 . 1109 . . 27 PRO CB . 17403 1 392 . 1 1 32 32 PRO CG C 13 27.869 0.035 . 1 . 1111 . . 27 PRO CG . 17403 1 393 . 1 1 32 32 PRO CD C 13 51.334 0.049 . 1 . 1114 . . 27 PRO CD . 17403 1 394 . 1 1 33 33 GLU H H 1 7.880 0.004 . 1 . 160 . . 28 GLU H . 17403 1 395 . 1 1 33 33 GLU HA H 1 3.963 0.006 . 1 . 781 . . 28 GLU HA . 17403 1 396 . 1 1 33 33 GLU HB2 H 1 2.069 0.005 . 2 . 863 . . 28 GLU HB2 . 17403 1 397 . 1 1 33 33 GLU HB3 H 1 2.002 0.006 . 2 . 862 . . 28 GLU HB3 . 17403 1 398 . 1 1 33 33 GLU HG2 H 1 2.261 0.018 . 2 . 1243 . . 28 GLU HG2 . 17403 1 399 . 1 1 33 33 GLU HG3 H 1 2.296 0.009 . 2 . 1242 . . 28 GLU HG3 . 17403 1 400 . 1 1 33 33 GLU C C 13 178.949 . . 1 . 607 . . 28 GLU C . 17403 1 401 . 1 1 33 33 GLU CA C 13 59.425 0.047 . 1 . 448 . . 28 GLU CA . 17403 1 402 . 1 1 33 33 GLU CB C 13 29.161 0.028 . 1 . 447 . . 28 GLU CB . 17403 1 403 . 1 1 33 33 GLU CG C 13 36.461 0.046 . 1 . 1244 . . 28 GLU CG . 17403 1 404 . 1 1 33 33 GLU N N 15 116.186 0.019 . 1 . 161 . . 28 GLU N . 17403 1 405 . 1 1 34 34 GLU H H 1 7.294 0.002 . 1 . 233 . . 29 GLU H . 17403 1 406 . 1 1 34 34 GLU HA H 1 4.100 0.008 . 1 . 512 . . 29 GLU HA . 17403 1 407 . 1 1 34 34 GLU HB2 H 1 2.068 0.007 . 2 . 1630 . . 29 GLU HB2 . 17403 1 408 . 1 1 34 34 GLU HB3 H 1 2.149 0.007 . 2 . 1632 . . 29 GLU HB3 . 17403 1 409 . 1 1 34 34 GLU HG2 H 1 2.204 0.02 . 2 . 1578 . . 29 GLU HG2 . 17403 1 410 . 1 1 34 34 GLU HG3 H 1 2.288 0.007 . 2 . 1580 . . 29 GLU HG3 . 17403 1 411 . 1 1 34 34 GLU C C 13 179.130 0.003 . 1 . 598 . . 29 GLU C . 17403 1 412 . 1 1 34 34 GLU CA C 13 58.667 0.057 . 1 . 311 . . 29 GLU CA . 17403 1 413 . 1 1 34 34 GLU CB C 13 29.712 0.033 . 1 . 1631 . . 29 GLU CB . 17403 1 414 . 1 1 34 34 GLU CG C 13 36.255 0.036 . 1 . 1579 . . 29 GLU CG . 17403 1 415 . 1 1 34 34 GLU N N 15 120.108 0.012 . 1 . 234 . . 29 GLU N . 17403 1 416 . 1 1 35 35 ILE H H 1 7.603 0.01 . 1 . 1649 . . 30 ILE H . 17403 1 417 . 1 1 35 35 ILE HA H 1 3.947 0.014 . 1 . 718 . . 30 ILE HA . 17403 1 418 . 1 1 35 35 ILE HB H 1 2.157 0.009 . 1 . 864 . . 30 ILE HB . 17403 1 419 . 1 1 35 35 ILE HG12 H 1 1.637 0.017 . 2 . 1282 . . 30 ILE HG12 . 17403 1 420 . 1 1 35 35 ILE HG13 H 1 1.247 0.004 . 2 . 1283 . . 30 ILE HG13 . 17403 1 421 . 1 1 35 35 ILE HG21 H 1 0.804 0.014 . 1 . 1284 . . 30 ILE HG21 . 17403 1 422 . 1 1 35 35 ILE HG22 H 1 0.804 0.014 . 1 . 1284 . . 30 ILE HG22 . 17403 1 423 . 1 1 35 35 ILE HG23 H 1 0.804 0.014 . 1 . 1284 . . 30 ILE HG23 . 17403 1 424 . 1 1 35 35 ILE HD11 H 1 0.738 0.016 . 1 . 1287 . . 30 ILE HD11 . 17403 1 425 . 1 1 35 35 ILE HD12 H 1 0.738 0.016 . 1 . 1287 . . 30 ILE HD12 . 17403 1 426 . 1 1 35 35 ILE HD13 H 1 0.738 0.016 . 1 . 1287 . . 30 ILE HD13 . 17403 1 427 . 1 1 35 35 ILE C C 13 178.351 . . 1 . 637 . . 30 ILE C . 17403 1 428 . 1 1 35 35 ILE CA C 13 62.418 0.038 . 1 . 369 . . 30 ILE CA . 17403 1 429 . 1 1 35 35 ILE CB C 13 35.854 0.032 . 1 . 368 . . 30 ILE CB . 17403 1 430 . 1 1 35 35 ILE CG1 C 13 27.491 0.035 . 1 . 1286 . . 30 ILE CG1 . 17403 1 431 . 1 1 35 35 ILE CG2 C 13 18.553 0.029 . 1 . 1285 . . 30 ILE CG2 . 17403 1 432 . 1 1 35 35 ILE CD1 C 13 9.904 0.027 . 1 . 1288 . . 30 ILE CD1 . 17403 1 433 . 1 1 35 35 ILE N N 15 118.593 0.054 . 1 . 162 . . 30 ILE N . 17403 1 434 . 1 1 36 36 LYS H H 1 8.369 0.012 . 1 . 126 . . 31 LYS H . 17403 1 435 . 1 1 36 36 LYS HA H 1 3.872 0.009 . 1 . 771 . . 31 LYS HA . 17403 1 436 . 1 1 36 36 LYS HB2 H 1 1.917 0.007 . 2 . 865 . . 31 LYS HB2 . 17403 1 437 . 1 1 36 36 LYS HB3 H 1 1.915 0.004 . 2 . 866 . . 31 LYS HB3 . 17403 1 438 . 1 1 36 36 LYS HG2 H 1 1.691 0.011 . 2 . 1140 . . 31 LYS HG2 . 17403 1 439 . 1 1 36 36 LYS HG3 H 1 1.527 0.004 . 2 . 1141 . . 31 LYS HG3 . 17403 1 440 . 1 1 36 36 LYS HD2 H 1 1.699 0.008 . 2 . 1446 . . 31 LYS HD2 . 17403 1 441 . 1 1 36 36 LYS HD3 H 1 1.699 0.004 . 2 . 1447 . . 31 LYS HD3 . 17403 1 442 . 1 1 36 36 LYS HE2 H 1 2.949 0.002 . 2 . 1667 . . 31 LYS HE2 . 17403 1 443 . 1 1 36 36 LYS HE3 H 1 2.948 0.002 . 2 . 1449 . . 31 LYS HE3 . 17403 1 444 . 1 1 36 36 LYS C C 13 178.314 . . 1 . 641 . . 31 LYS C . 17403 1 445 . 1 1 36 36 LYS CA C 13 60.196 0.051 . 1 . 384 . . 31 LYS CA . 17403 1 446 . 1 1 36 36 LYS CB C 13 32.347 0.03 . 1 . 383 . . 31 LYS CB . 17403 1 447 . 1 1 36 36 LYS CG C 13 25.058 0.028 . 1 . 1142 . . 31 LYS CG . 17403 1 448 . 1 1 36 36 LYS CD C 13 29.580 0.042 . 1 . 1448 . . 31 LYS CD . 17403 1 449 . 1 1 36 36 LYS CE C 13 41.588 . . 1 . 1668 . . 31 LYS CE . 17403 1 450 . 1 1 36 36 LYS N N 15 120.420 0.015 . 1 . 127 . . 31 LYS N . 17403 1 451 . 1 1 37 37 HIS H H 1 7.875 0.005 . 1 . 146 . . 32 HIS H . 17403 1 452 . 1 1 37 37 HIS HA H 1 4.339 0.003 . 1 . 803 . . 32 HIS HA . 17403 1 453 . 1 1 37 37 HIS HB2 H 1 3.236 0.009 . 2 . 867 . . 32 HIS HB2 . 17403 1 454 . 1 1 37 37 HIS HB3 H 1 3.258 0.01 . 2 . 868 . . 32 HIS HB3 . 17403 1 455 . 1 1 37 37 HIS HD2 H 1 7.216 0.012 . 1 . 1090 . . 32 HIS HD2 . 17403 1 456 . 1 1 37 37 HIS HE1 H 1 8.375 0.002 . 1 . 1096 . . 32 HIS HE1 . 17403 1 457 . 1 1 37 37 HIS C C 13 176.240 . . 1 . 591 . . 32 HIS C . 17403 1 458 . 1 1 37 37 HIS CA C 13 58.049 0.053 . 1 . 325 . . 32 HIS CA . 17403 1 459 . 1 1 37 37 HIS CB C 13 28.922 0.023 . 1 . 324 . . 32 HIS CB . 17403 1 460 . 1 1 37 37 HIS CD2 C 13 119.649 0.062 . 1 . 1091 . . 32 HIS CD2 . 17403 1 461 . 1 1 37 37 HIS CE1 C 13 137.027 . . 1 . 1097 . . 32 HIS CE1 . 17403 1 462 . 1 1 37 37 HIS N N 15 114.524 0.019 . 1 . 1645 . . 32 HIS N . 17403 1 463 . 1 1 37 37 HIS ND1 N 15 188.816 0.026 . 1 . 1636 . . 32 HIS ND1 . 17403 1 464 . 1 1 37 37 HIS NE2 N 15 175.661 0.002 . 1 . 1637 . . 32 HIS NE2 . 17403 1 465 . 1 1 38 38 ARG H H 1 7.774 0.003 . 1 . 43 . . 33 ARG H . 17403 1 466 . 1 1 38 38 ARG HA H 1 3.886 0.003 . 1 . 533 . . 33 ARG HA . 17403 1 467 . 1 1 38 38 ARG HB2 H 1 1.053 0.003 . 2 . 869 . . 33 ARG HB2 . 17403 1 468 . 1 1 38 38 ARG HB3 H 1 1.448 0.006 . 2 . 1180 . . 33 ARG HB3 . 17403 1 469 . 1 1 38 38 ARG HG2 H 1 1.314 0.002 . 2 . 1182 . . 33 ARG HG2 . 17403 1 470 . 1 1 38 38 ARG HG3 H 1 0.774 0.003 . 2 . 1181 . . 33 ARG HG3 . 17403 1 471 . 1 1 38 38 ARG HD2 H 1 2.849 0.002 . 2 . 1184 . . 33 ARG HD2 . 17403 1 472 . 1 1 38 38 ARG HD3 H 1 2.948 0.002 . 2 . 1185 . . 33 ARG HD3 . 17403 1 473 . 1 1 38 38 ARG HE H 1 7.131 0.002 . 1 . 1605 . . 33 ARG HE . 17403 1 474 . 1 1 38 38 ARG C C 13 177.517 . . 1 . 653 . . 33 ARG C . 17403 1 475 . 1 1 38 38 ARG CA C 13 57.999 0.061 . 1 . 1179 . . 33 ARG CA . 17403 1 476 . 1 1 38 38 ARG CB C 13 31.641 0.036 . 1 . 387 . . 33 ARG CB . 17403 1 477 . 1 1 38 38 ARG CG C 13 26.994 0.03 . 1 . 1183 . . 33 ARG CG . 17403 1 478 . 1 1 38 38 ARG CD C 13 43.487 0.029 . 1 . 1186 . . 33 ARG CD . 17403 1 479 . 1 1 38 38 ARG N N 15 115.500 0.035 . 1 . 44 . . 33 ARG N . 17403 1 480 . 1 1 38 38 ARG NE N 15 85.236 . . 1 . 1606 . . 33 ARG NE . 17403 1 481 . 1 1 39 39 PHE H H 1 8.335 0.009 . 1 . 149 . . 34 PHE H . 17403 1 482 . 1 1 39 39 PHE HA H 1 4.793 0.003 . 1 . 758 . . 34 PHE HA . 17403 1 483 . 1 1 39 39 PHE HB2 H 1 2.658 0.004 . 2 . 871 . . 34 PHE HB2 . 17403 1 484 . 1 1 39 39 PHE HB3 H 1 3.219 0.018 . 2 . 872 . . 34 PHE HB3 . 17403 1 485 . 1 1 39 39 PHE HD1 H 1 7.433 0.004 . 3 . 1079 . . 34 PHE HD1 . 17403 1 486 . 1 1 39 39 PHE HD2 H 1 7.433 0.004 . 3 . 1079 . . 34 PHE HD2 . 17403 1 487 . 1 1 39 39 PHE HE1 H 1 7.244 0.008 . 3 . 1082 . . 34 PHE HE1 . 17403 1 488 . 1 1 39 39 PHE HE2 H 1 7.244 0.008 . 3 . 1082 . . 34 PHE HE2 . 17403 1 489 . 1 1 39 39 PHE C C 13 175.041 . . 1 . 600 . . 34 PHE C . 17403 1 490 . 1 1 39 39 PHE CA C 13 58.960 0.046 . 1 . 504 . . 34 PHE CA . 17403 1 491 . 1 1 39 39 PHE CB C 13 40.726 0.041 . 1 . 503 . . 34 PHE CB . 17403 1 492 . 1 1 39 39 PHE CD1 C 13 132.243 0.065 . 3 . 1078 . . 34 PHE CD1 . 17403 1 493 . 1 1 39 39 PHE CD2 C 13 132.243 0.065 . 3 . 1078 . . 34 PHE CD2 . 17403 1 494 . 1 1 39 39 PHE CE1 C 13 131.265 0.035 . 3 . 1083 . . 34 PHE CE1 . 17403 1 495 . 1 1 39 39 PHE CE2 C 13 131.265 0.035 . 3 . 1083 . . 34 PHE CE2 . 17403 1 496 . 1 1 39 39 PHE N N 15 112.990 0.031 . 1 . 150 . . 34 PHE N . 17403 1 497 . 1 1 40 40 ASP H H 1 8.252 0.003 . 1 . 292 . . 35 ASP H . 17403 1 498 . 1 1 40 40 ASP HA H 1 5.134 0.002 . 1 . 765 . . 35 ASP HA . 17403 1 499 . 1 1 40 40 ASP HB2 H 1 2.287 0.003 . 2 . 873 . . 35 ASP HB2 . 17403 1 500 . 1 1 40 40 ASP HB3 H 1 3.119 0.005 . 2 . 874 . . 35 ASP HB3 . 17403 1 501 . 1 1 40 40 ASP C C 13 177.113 . . 1 . 577 . . 35 ASP C . 17403 1 502 . 1 1 40 40 ASP CA C 13 52.750 0.043 . 1 . 346 . . 35 ASP CA . 17403 1 503 . 1 1 40 40 ASP CB C 13 40.569 0.036 . 1 . 345 . . 35 ASP CB . 17403 1 504 . 1 1 40 40 ASP N N 15 121.856 0.021 . 1 . 293 . . 35 ASP N . 17403 1 505 . 1 1 41 41 THR H H 1 7.997 0.003 . 1 . 86 . . 36 THR H . 17403 1 506 . 1 1 41 41 THR HA H 1 3.976 0.005 . 1 . 532 . . 36 THR HA . 17403 1 507 . 1 1 41 41 THR HB H 1 4.173 0.013 . 1 . 531 . . 36 THR HB . 17403 1 508 . 1 1 41 41 THR HG21 H 1 1.176 0.003 . 1 . 1164 . . 36 THR HG21 . 17403 1 509 . 1 1 41 41 THR HG22 H 1 1.176 0.003 . 1 . 1164 . . 36 THR HG22 . 17403 1 510 . 1 1 41 41 THR HG23 H 1 1.176 0.003 . 1 . 1164 . . 36 THR HG23 . 17403 1 511 . 1 1 41 41 THR C C 13 176.060 . . 1 . 578 . . 36 THR C . 17403 1 512 . 1 1 41 41 THR CA C 13 64.859 0.063 . 1 . 308 . . 36 THR CA . 17403 1 513 . 1 1 41 41 THR CB C 13 68.924 0.053 . 1 . 309 . . 36 THR CB . 17403 1 514 . 1 1 41 41 THR CG2 C 13 22.019 0.031 . 1 . 1163 . . 36 THR CG2 . 17403 1 515 . 1 1 41 41 THR N N 15 114.636 0.026 . 1 . 87 . . 36 THR N . 17403 1 516 . 1 1 42 42 ASP H H 1 8.419 0.002 . 1 . 13 . . 37 ASP H . 17403 1 517 . 1 1 42 42 ASP HA H 1 4.784 0.003 . 1 . 789 . . 37 ASP HA . 17403 1 518 . 1 1 42 42 ASP HB2 H 1 2.862 0.002 . 2 . 876 . . 37 ASP HB2 . 17403 1 519 . 1 1 42 42 ASP HB3 H 1 2.734 0.002 . 2 . 875 . . 37 ASP HB3 . 17403 1 520 . 1 1 42 42 ASP C C 13 177.097 . . 1 . 548 . . 37 ASP C . 17403 1 521 . 1 1 42 42 ASP CA C 13 53.865 0.042 . 1 . 446 . . 37 ASP CA . 17403 1 522 . 1 1 42 42 ASP CB C 13 41.432 0.028 . 1 . 445 . . 37 ASP CB . 17403 1 523 . 1 1 42 42 ASP N N 15 118.582 0.031 . 1 . 14 . . 37 ASP N . 17403 1 524 . 1 1 43 43 GLY H H 1 7.857 0.005 . 1 . 231 . . 38 GLY H . 17403 1 525 . 1 1 43 43 GLY HA2 H 1 3.999 0.012 . 2 . 878 . . 38 GLY HA2 . 17403 1 526 . 1 1 43 43 GLY HA3 H 1 3.844 0.002 . 2 . 877 . . 38 GLY HA3 . 17403 1 527 . 1 1 43 43 GLY C C 13 175.620 . . 1 . 669 . . 38 GLY C . 17403 1 528 . 1 1 43 43 GLY CA C 13 46.922 0.043 . 1 . 413 . . 38 GLY CA . 17403 1 529 . 1 1 43 43 GLY N N 15 109.390 0.016 . 1 . 232 . . 38 GLY N . 17403 1 530 . 1 1 44 44 THR H H 1 8.321 0.006 . 1 . 189 . . 39 THR H . 17403 1 531 . 1 1 44 44 THR HA H 1 4.365 0.002 . 1 . 797 . . 39 THR HA . 17403 1 532 . 1 1 44 44 THR HB H 1 4.492 0.016 . 1 . 879 . . 39 THR HB . 17403 1 533 . 1 1 44 44 THR HG21 H 1 1.144 0.011 . 1 . 1165 . . 39 THR HG21 . 17403 1 534 . 1 1 44 44 THR HG22 H 1 1.144 0.011 . 1 . 1165 . . 39 THR HG22 . 17403 1 535 . 1 1 44 44 THR HG23 H 1 1.144 0.011 . 1 . 1165 . . 39 THR HG23 . 17403 1 536 . 1 1 44 44 THR C C 13 175.406 . . 1 . 604 . . 39 THR C . 17403 1 537 . 1 1 44 44 THR CA C 13 61.910 0.017 . 1 . 481 . . 39 THR CA . 17403 1 538 . 1 1 44 44 THR CB C 13 69.772 0.052 . 1 . 480 . . 39 THR CB . 17403 1 539 . 1 1 44 44 THR CG2 C 13 21.595 0.036 . 1 . 1166 . . 39 THR CG2 . 17403 1 540 . 1 1 44 44 THR N N 15 110.959 0.023 . 1 . 190 . . 39 THR N . 17403 1 541 . 1 1 45 45 GLY H H 1 9.508 0.005 . 1 . 270 . . 40 GLY H . 17403 1 542 . 1 1 45 45 GLY HA2 H 1 3.719 0.006 . 2 . 880 . . 40 GLY HA2 . 17403 1 543 . 1 1 45 45 GLY HA3 H 1 4.437 0.005 . 2 . 881 . . 40 GLY HA3 . 17403 1 544 . 1 1 45 45 GLY C C 13 174.066 . . 1 . 667 . . 40 GLY C . 17403 1 545 . 1 1 45 45 GLY CA C 13 43.703 0.031 . 1 . 507 . . 40 GLY CA . 17403 1 546 . 1 1 45 45 GLY N N 15 116.362 0.018 . 1 . 271 . . 40 GLY N . 17403 1 547 . 1 1 46 46 LEU H H 1 9.287 0.009 . 1 . 64 . . 41 LEU H . 17403 1 548 . 1 1 46 46 LEU HA H 1 4.478 0.008 . 1 . 720 . . 41 LEU HA . 17403 1 549 . 1 1 46 46 LEU HB2 H 1 1.620 0.003 . 2 . 882 . . 41 LEU HB2 . 17403 1 550 . 1 1 46 46 LEU HB3 H 1 2.128 0.009 . 2 . 883 . . 41 LEU HB3 . 17403 1 551 . 1 1 46 46 LEU HG H 1 1.933 0.006 . 1 . 1375 . . 41 LEU HG . 17403 1 552 . 1 1 46 46 LEU HD11 H 1 0.714 0.008 . 2 . 1377 . . 41 LEU HD11 . 17403 1 553 . 1 1 46 46 LEU HD12 H 1 0.714 0.008 . 2 . 1377 . . 41 LEU HD12 . 17403 1 554 . 1 1 46 46 LEU HD13 H 1 0.714 0.008 . 2 . 1377 . . 41 LEU HD13 . 17403 1 555 . 1 1 46 46 LEU HD21 H 1 0.786 0.013 . 2 . 1378 . . 41 LEU HD21 . 17403 1 556 . 1 1 46 46 LEU HD22 H 1 0.786 0.013 . 2 . 1378 . . 41 LEU HD22 . 17403 1 557 . 1 1 46 46 LEU HD23 H 1 0.786 0.013 . 2 . 1378 . . 41 LEU HD23 . 17403 1 558 . 1 1 46 46 LEU C C 13 177.877 . . 1 . 608 . . 41 LEU C . 17403 1 559 . 1 1 46 46 LEU CA C 13 55.832 0.048 . 1 . 494 . . 41 LEU CA . 17403 1 560 . 1 1 46 46 LEU CB C 13 42.418 0.04 . 1 . 495 . . 41 LEU CB . 17403 1 561 . 1 1 46 46 LEU CG C 13 27.053 0.037 . 1 . 1376 . . 41 LEU CG . 17403 1 562 . 1 1 46 46 LEU CD1 C 13 25.053 0.022 . 2 . 1386 . . 41 LEU CD1 . 17403 1 563 . 1 1 46 46 LEU CD2 C 13 26.426 0.027 . 2 . 1385 . . 41 LEU CD2 . 17403 1 564 . 1 1 46 46 LEU N N 15 123.058 0.017 . 1 . 65 . . 41 LEU N . 17403 1 565 . 1 1 47 47 GLY H H 1 8.289 0.006 . 1 . 282 . . 42 GLY H . 17403 1 566 . 1 1 47 47 GLY HA2 H 1 4.087 0.003 . 2 . 884 . . 42 GLY HA2 . 17403 1 567 . 1 1 47 47 GLY HA3 H 1 4.633 0.004 . 2 . 885 . . 42 GLY HA3 . 17403 1 568 . 1 1 47 47 GLY C C 13 173.263 . . 1 . 657 . . 42 GLY C . 17403 1 569 . 1 1 47 47 GLY CA C 13 44.264 0.04 . 1 . 410 . . 42 GLY CA . 17403 1 570 . 1 1 47 47 GLY N N 15 112.430 0.019 . 1 . 283 . . 42 GLY N . 17403 1 571 . 1 1 48 48 LEU H H 1 8.584 0.003 . 1 . 185 . . 43 LEU H . 17403 1 572 . 1 1 48 48 LEU HA H 1 3.131 0.01 . 1 . 735 . . 43 LEU HA . 17403 1 573 . 1 1 48 48 LEU HB2 H 1 0.730 0.018 . 2 . 886 . . 43 LEU HB2 . 17403 1 574 . 1 1 48 48 LEU HB3 H 1 1.425 0.013 . 2 . 887 . . 43 LEU HB3 . 17403 1 575 . 1 1 48 48 LEU HG H 1 0.869 0.006 . 1 . 1379 . . 43 LEU HG . 17403 1 576 . 1 1 48 48 LEU HD11 H 1 0.236 0.002 . 2 . 1381 . . 43 LEU HD11 . 17403 1 577 . 1 1 48 48 LEU HD12 H 1 0.236 0.002 . 2 . 1381 . . 43 LEU HD12 . 17403 1 578 . 1 1 48 48 LEU HD13 H 1 0.236 0.002 . 2 . 1381 . . 43 LEU HD13 . 17403 1 579 . 1 1 48 48 LEU HD21 H 1 -0.510 0.002 . 2 . 1382 . . 43 LEU HD21 . 17403 1 580 . 1 1 48 48 LEU HD22 H 1 -0.510 0.002 . 2 . 1382 . . 43 LEU HD22 . 17403 1 581 . 1 1 48 48 LEU HD23 H 1 -0.510 0.002 . 2 . 1382 . . 43 LEU HD23 . 17403 1 582 . 1 1 48 48 LEU C C 13 178.006 . . 1 . 595 . . 43 LEU C . 17403 1 583 . 1 1 48 48 LEU CA C 13 59.198 0.045 . 1 . 412 . . 43 LEU CA . 17403 1 584 . 1 1 48 48 LEU CB C 13 40.823 0.027 . 1 . 411 . . 43 LEU CB . 17403 1 585 . 1 1 48 48 LEU CG C 13 26.314 0.033 . 1 . 1380 . . 43 LEU CG . 17403 1 586 . 1 1 48 48 LEU CD1 C 13 25.307 0.034 . 2 . 1384 . . 43 LEU CD1 . 17403 1 587 . 1 1 48 48 LEU CD2 C 13 21.518 0.025 . 2 . 1383 . . 43 LEU CD2 . 17403 1 588 . 1 1 48 48 LEU N N 15 121.558 0.016 . 1 . 186 . . 43 LEU N . 17403 1 589 . 1 1 49 49 THR H H 1 8.163 0.008 . 1 . 187 . . 44 THR H . 17403 1 590 . 1 1 49 49 THR HA H 1 3.754 0.006 . 1 . 795 . . 44 THR HA . 17403 1 591 . 1 1 49 49 THR HB H 1 4.188 0.012 . 1 . 888 . . 44 THR HB . 17403 1 592 . 1 1 49 49 THR HG21 H 1 1.233 0.004 . 1 . 1167 . . 44 THR HG21 . 17403 1 593 . 1 1 49 49 THR HG22 H 1 1.233 0.004 . 1 . 1167 . . 44 THR HG22 . 17403 1 594 . 1 1 49 49 THR HG23 H 1 1.233 0.004 . 1 . 1167 . . 44 THR HG23 . 17403 1 595 . 1 1 49 49 THR C C 13 177.397 . . 1 . 606 . . 44 THR C . 17403 1 596 . 1 1 49 49 THR CA C 13 66.864 0.059 . 1 . 376 . . 44 THR CA . 17403 1 597 . 1 1 49 49 THR CB C 13 68.213 0.049 . 1 . 375 . . 44 THR CB . 17403 1 598 . 1 1 49 49 THR CG2 C 13 22.053 0.033 . 1 . 1168 . . 44 THR CG2 . 17403 1 599 . 1 1 49 49 THR N N 15 111.624 0.02 . 1 . 188 . . 44 THR N . 17403 1 600 . 1 1 50 50 SER H H 1 7.957 0.007 . 1 . 1651 . . 45 SER H . 17403 1 601 . 1 1 50 50 SER HA H 1 4.215 0.006 . 1 . 805 . . 45 SER HA . 17403 1 602 . 1 1 50 50 SER HB2 H 1 4.090 0.006 . 2 . 890 . . 45 SER HB2 . 17403 1 603 . 1 1 50 50 SER HB3 H 1 4.029 0.016 . 2 . 889 . . 45 SER HB3 . 17403 1 604 . 1 1 50 50 SER C C 13 174.513 . . 1 . 560 . . 45 SER C . 17403 1 605 . 1 1 50 50 SER CA C 13 62.130 0.051 . 1 . 524 . . 45 SER CA . 17403 1 606 . 1 1 50 50 SER CB C 13 63.312 0.065 . 1 . 525 . . 45 SER CB . 17403 1 607 . 1 1 50 50 SER N N 15 117.372 0.013 . 1 . 136 . . 45 SER N . 17403 1 608 . 1 1 51 51 TRP H H 1 9.235 0.011 . 1 . 254 . . 46 TRP H . 17403 1 609 . 1 1 51 51 TRP HA H 1 3.559 0.003 . 1 . 672 . . 46 TRP HA . 17403 1 610 . 1 1 51 51 TRP HB2 H 1 3.279 0.009 . 2 . 1138 . . 46 TRP HB2 . 17403 1 611 . 1 1 51 51 TRP HB3 H 1 3.180 0.019 . 2 . 1137 . . 46 TRP HB3 . 17403 1 612 . 1 1 51 51 TRP HD1 H 1 6.895 0.016 . 1 . 1036 . . 46 TRP HD1 . 17403 1 613 . 1 1 51 51 TRP HE1 H 1 9.914 0.005 . 1 . 175 . . 46 TRP HE1 . 17403 1 614 . 1 1 51 51 TRP HE3 H 1 6.963 0.003 . 1 . 1052 . . 46 TRP HE3 . 17403 1 615 . 1 1 51 51 TRP HZ2 H 1 6.797 0.008 . 1 . 1038 . . 46 TRP HZ2 . 17403 1 616 . 1 1 51 51 TRP HZ3 H 1 6.576 0.012 . 1 . 1050 . . 46 TRP HZ3 . 17403 1 617 . 1 1 51 51 TRP HH2 H 1 6.620 0.019 . 1 . 1048 . . 46 TRP HH2 . 17403 1 618 . 1 1 51 51 TRP C C 13 178.274 . . 1 . 644 . . 46 TRP C . 17403 1 619 . 1 1 51 51 TRP CA C 13 63.279 0.043 . 1 . 374 . . 46 TRP CA . 17403 1 620 . 1 1 51 51 TRP CB C 13 30.354 0.045 . 1 . 373 . . 46 TRP CB . 17403 1 621 . 1 1 51 51 TRP CD1 C 13 125.472 0.044 . 1 . 1037 . . 46 TRP CD1 . 17403 1 622 . 1 1 51 51 TRP CE3 C 13 121.876 0.004 . 1 . 1053 . . 46 TRP CE3 . 17403 1 623 . 1 1 51 51 TRP CZ2 C 13 113.627 0.031 . 1 . 1039 . . 46 TRP CZ2 . 17403 1 624 . 1 1 51 51 TRP CZ3 C 13 120.522 0.025 . 1 . 1051 . . 46 TRP CZ3 . 17403 1 625 . 1 1 51 51 TRP CH2 C 13 122.238 0.018 . 1 . 1049 . . 46 TRP CH2 . 17403 1 626 . 1 1 51 51 TRP N N 15 125.149 0.028 . 1 . 255 . . 46 TRP N . 17403 1 627 . 1 1 51 51 TRP NE1 N 15 127.044 0.033 . 1 . 176 . . 46 TRP NE1 . 17403 1 628 . 1 1 52 52 LEU H H 1 8.288 0.005 . 1 . 134 . . 47 LEU H . 17403 1 629 . 1 1 52 52 LEU HA H 1 3.909 0.016 . 1 . 725 . . 47 LEU HA . 17403 1 630 . 1 1 52 52 LEU HB2 H 1 2.003 0.011 . 2 . 1430 . . 47 LEU HB2 . 17403 1 631 . 1 1 52 52 LEU HB3 H 1 1.356 0.018 . 2 . 1429 . . 47 LEU HB3 . 17403 1 632 . 1 1 52 52 LEU HG H 1 1.983 0.004 . 1 . 1561 . . 47 LEU HG . 17403 1 633 . 1 1 52 52 LEU HD11 H 1 0.895 0.01 . 2 . 1527 . . 47 LEU HD11 . 17403 1 634 . 1 1 52 52 LEU HD12 H 1 0.895 0.01 . 2 . 1527 . . 47 LEU HD12 . 17403 1 635 . 1 1 52 52 LEU HD13 H 1 0.895 0.01 . 2 . 1527 . . 47 LEU HD13 . 17403 1 636 . 1 1 52 52 LEU HD21 H 1 0.782 0.015 . 2 . 1563 . . 47 LEU HD21 . 17403 1 637 . 1 1 52 52 LEU HD22 H 1 0.782 0.015 . 2 . 1563 . . 47 LEU HD22 . 17403 1 638 . 1 1 52 52 LEU HD23 H 1 0.782 0.015 . 2 . 1563 . . 47 LEU HD23 . 17403 1 639 . 1 1 52 52 LEU C C 13 179.697 0.006 . 1 . 1559 . . 47 LEU C . 17403 1 640 . 1 1 52 52 LEU CA C 13 58.608 0.042 . 1 . 526 . . 47 LEU CA . 17403 1 641 . 1 1 52 52 LEU CB C 13 41.323 0.044 . 1 . 310 . . 47 LEU CB . 17403 1 642 . 1 1 52 52 LEU CG C 13 26.657 0.039 . 1 . 1560 . . 47 LEU CG . 17403 1 643 . 1 1 52 52 LEU CD1 C 13 23.885 0.028 . 2 . 1528 . . 47 LEU CD1 . 17403 1 644 . 1 1 52 52 LEU CD2 C 13 23.296 0.046 . 2 . 1562 . . 47 LEU CD2 . 17403 1 645 . 1 1 52 52 LEU N N 15 116.683 0.035 . 1 . 135 . . 47 LEU N . 17403 1 646 . 1 1 53 53 LEU H H 1 7.613 0.003 . 1 . 528 . . 48 LEU H . 17403 1 647 . 1 1 53 53 LEU HA H 1 3.849 0.01 . 1 . 717 . . 48 LEU HA . 17403 1 648 . 1 1 53 53 LEU HB2 H 1 1.768 0.002 . 2 . 892 . . 48 LEU HB2 . 17403 1 649 . 1 1 53 53 LEU HB3 H 1 1.397 0.008 . 2 . 891 . . 48 LEU HB3 . 17403 1 650 . 1 1 53 53 LEU HG H 1 1.845 0.002 . 1 . 1537 . . 48 LEU HG . 17403 1 651 . 1 1 53 53 LEU HD11 H 1 0.982 0.003 . 2 . 1535 . . 48 LEU HD11 . 17403 1 652 . 1 1 53 53 LEU HD12 H 1 0.982 0.003 . 2 . 1535 . . 48 LEU HD12 . 17403 1 653 . 1 1 53 53 LEU HD13 H 1 0.982 0.003 . 2 . 1535 . . 48 LEU HD13 . 17403 1 654 . 1 1 53 53 LEU HD21 H 1 0.893 0.002 . 2 . 1539 . . 48 LEU HD21 . 17403 1 655 . 1 1 53 53 LEU HD22 H 1 0.893 0.002 . 2 . 1539 . . 48 LEU HD22 . 17403 1 656 . 1 1 53 53 LEU HD23 H 1 0.893 0.002 . 2 . 1539 . . 48 LEU HD23 . 17403 1 657 . 1 1 53 53 LEU C C 13 179.532 . . 1 . 658 . . 48 LEU C . 17403 1 658 . 1 1 53 53 LEU CA C 13 57.678 0.044 . 1 . 367 . . 48 LEU CA . 17403 1 659 . 1 1 53 53 LEU CB C 13 41.963 0.035 . 1 . 534 . . 48 LEU CB . 17403 1 660 . 1 1 53 53 LEU CG C 13 26.481 0.034 . 1 . 1538 . . 48 LEU CG . 17403 1 661 . 1 1 53 53 LEU CD1 C 13 25.222 0.028 . 2 . 1536 . . 48 LEU CD1 . 17403 1 662 . 1 1 53 53 LEU CD2 C 13 22.829 0.043 . 2 . 1540 . . 48 LEU CD2 . 17403 1 663 . 1 1 53 53 LEU N N 15 118.581 0.027 . 1 . 529 . . 48 LEU N . 17403 1 664 . 1 1 54 54 ALA H H 1 8.187 0.004 . 1 . 124 . . 49 ALA H . 17403 1 665 . 1 1 54 54 ALA HA H 1 2.940 0.004 . 1 . 757 . . 49 ALA HA . 17403 1 666 . 1 1 54 54 ALA HB1 H 1 0.633 0.012 . 1 . 893 . . 49 ALA HB1 . 17403 1 667 . 1 1 54 54 ALA HB2 H 1 0.633 0.012 . 1 . 893 . . 49 ALA HB2 . 17403 1 668 . 1 1 54 54 ALA HB3 H 1 0.633 0.012 . 1 . 893 . . 49 ALA HB3 . 17403 1 669 . 1 1 54 54 ALA C C 13 180.513 . . 1 . 640 . . 49 ALA C . 17403 1 670 . 1 1 54 54 ALA CA C 13 54.024 0.044 . 1 . 434 . . 49 ALA CA . 17403 1 671 . 1 1 54 54 ALA CB C 13 17.766 0.045 . 1 . 433 . . 49 ALA CB . 17403 1 672 . 1 1 54 54 ALA N N 15 124.890 0.02 . 1 . 125 . . 49 ALA N . 17403 1 673 . 1 1 55 55 ALA H H 1 8.264 0.006 . 1 . 218 . . 50 ALA H . 17403 1 674 . 1 1 55 55 ALA HA H 1 3.415 0.002 . 1 . 769 . . 50 ALA HA . 17403 1 675 . 1 1 55 55 ALA HB1 H 1 0.781 0.017 . 1 . 894 . . 50 ALA HB1 . 17403 1 676 . 1 1 55 55 ALA HB2 H 1 0.781 0.017 . 1 . 894 . . 50 ALA HB2 . 17403 1 677 . 1 1 55 55 ALA HB3 H 1 0.781 0.017 . 1 . 894 . . 50 ALA HB3 . 17403 1 678 . 1 1 55 55 ALA C C 13 179.769 . . 1 . 610 . . 50 ALA C . 17403 1 679 . 1 1 55 55 ALA CA C 13 55.453 0.047 . 1 . 335 . . 50 ALA CA . 17403 1 680 . 1 1 55 55 ALA CB C 13 18.280 0.06 . 1 . 334 . . 50 ALA CB . 17403 1 681 . 1 1 55 55 ALA N N 15 121.322 0.045 . 1 . 219 . . 50 ALA N . 17403 1 682 . 1 1 56 56 LYS H H 1 7.996 0.006 . 1 . 1650 . . 51 LYS H . 17403 1 683 . 1 1 56 56 LYS HA H 1 4.273 0.003 . 1 . 801 . . 51 LYS HA . 17403 1 684 . 1 1 56 56 LYS HB2 H 1 1.903 0.006 . 2 . 896 . . 51 LYS HB2 . 17403 1 685 . 1 1 56 56 LYS HB3 H 1 1.864 0.018 . 2 . 895 . . 51 LYS HB3 . 17403 1 686 . 1 1 56 56 LYS HG2 H 1 1.488 0.011 . 2 . 1454 . . 51 LYS HG2 . 17403 1 687 . 1 1 56 56 LYS HG3 H 1 1.655 0.008 . 2 . 1453 . . 51 LYS HG3 . 17403 1 688 . 1 1 56 56 LYS HD2 H 1 1.656 0.016 . 2 . 1673 . . 51 LYS HD2 . 17403 1 689 . 1 1 56 56 LYS HD3 H 1 1.640 0.01 . 2 . 1674 . . 51 LYS HD3 . 17403 1 690 . 1 1 56 56 LYS HE2 H 1 2.946 0.018 . 2 . 1669 . . 51 LYS HE2 . 17403 1 691 . 1 1 56 56 LYS HE3 H 1 2.930 0.005 . 2 . 1671 . . 51 LYS HE3 . 17403 1 692 . 1 1 56 56 LYS C C 13 181.214 . . 1 . 570 . . 51 LYS C . 17403 1 693 . 1 1 56 56 LYS CA C 13 59.480 0.05 . 1 . 432 . . 51 LYS CA . 17403 1 694 . 1 1 56 56 LYS CB C 13 32.162 0.033 . 1 . 431 . . 51 LYS CB . 17403 1 695 . 1 1 56 56 LYS CG C 13 25.866 0.042 . 1 . 1455 . . 51 LYS CG . 17403 1 696 . 1 1 56 56 LYS CD C 13 29.604 0.0 . 1 . 1672 . . 51 LYS CD . 17403 1 697 . 1 1 56 56 LYS CE C 13 42.031 0.002 . 1 . 1670 . . 51 LYS CE . 17403 1 698 . 1 1 56 56 LYS N N 15 117.946 0.051 . 1 . 68 . . 51 LYS N . 17403 1 699 . 1 1 57 57 SER H H 1 7.981 0.012 . 1 . 215 . . 52 SER H . 17403 1 700 . 1 1 57 57 SER HA H 1 4.368 0.009 . 1 . 731 . . 52 SER HA . 17403 1 701 . 1 1 57 57 SER HB2 H 1 4.123 0.01 . 2 . 898 . . 52 SER HB2 . 17403 1 702 . 1 1 57 57 SER HB3 H 1 4.100 0.014 . 2 . 897 . . 52 SER HB3 . 17403 1 703 . 1 1 57 57 SER C C 13 174.678 . . 1 . 629 . . 52 SER C . 17403 1 704 . 1 1 57 57 SER CA C 13 61.462 0.05 . 1 . 344 . . 52 SER CA . 17403 1 705 . 1 1 57 57 SER CB C 13 62.560 0.052 . 1 . 343 . . 52 SER CB . 17403 1 706 . 1 1 57 57 SER N N 15 118.822 0.025 . 1 . 216 . . 52 SER N . 17403 1 707 . 1 1 58 58 LEU H H 1 7.166 0.014 . 1 . 84 . . 53 LEU H . 17403 1 708 . 1 1 58 58 LEU HA H 1 4.392 0.01 . 1 . 806 . . 53 LEU HA . 17403 1 709 . 1 1 58 58 LEU HB2 H 1 1.763 0.004 . 2 . 900 . . 53 LEU HB2 . 17403 1 710 . 1 1 58 58 LEU HB3 H 1 1.619 0.012 . 2 . 899 . . 53 LEU HB3 . 17403 1 711 . 1 1 58 58 LEU HG H 1 1.763 0.005 . 1 . 1523 . . 53 LEU HG . 17403 1 712 . 1 1 58 58 LEU HD11 H 1 0.846 0.021 . 2 . 1524 . . 53 LEU HD11 . 17403 1 713 . 1 1 58 58 LEU HD12 H 1 0.846 0.021 . 2 . 1524 . . 53 LEU HD12 . 17403 1 714 . 1 1 58 58 LEU HD13 H 1 0.846 0.021 . 2 . 1524 . . 53 LEU HD13 . 17403 1 715 . 1 1 58 58 LEU HD21 H 1 0.599 0.016 . 2 . 1521 . . 53 LEU HD21 . 17403 1 716 . 1 1 58 58 LEU HD22 H 1 0.599 0.016 . 2 . 1521 . . 53 LEU HD22 . 17403 1 717 . 1 1 58 58 LEU HD23 H 1 0.599 0.016 . 2 . 1521 . . 53 LEU HD23 . 17403 1 718 . 1 1 58 58 LEU C C 13 175.719 . . 1 . 539 . . 53 LEU C . 17403 1 719 . 1 1 58 58 LEU CA C 13 54.182 0.041 . 1 . 471 . . 53 LEU CA . 17403 1 720 . 1 1 58 58 LEU CB C 13 41.636 0.046 . 1 . 470 . . 53 LEU CB . 17403 1 721 . 1 1 58 58 LEU CG C 13 25.812 0.028 . 1 . 1526 . . 53 LEU CG . 17403 1 722 . 1 1 58 58 LEU CD1 C 13 22.166 0.021 . 2 . 1525 . . 53 LEU CD1 . 17403 1 723 . 1 1 58 58 LEU CD2 C 13 26.410 0.026 . 2 . 1522 . . 53 LEU CD2 . 17403 1 724 . 1 1 58 58 LEU N N 15 122.531 0.03 . 1 . 85 . . 53 LEU N . 17403 1 725 . 1 1 59 59 GLU H H 1 7.947 0.006 . 1 . 256 . . 54 GLU H . 17403 1 726 . 1 1 59 59 GLU HA H 1 3.823 0.004 . 1 . 777 . . 54 GLU HA . 17403 1 727 . 1 1 59 59 GLU HB2 H 1 2.407 0.001 . 2 . 902 . . 54 GLU HB2 . 17403 1 728 . 1 1 59 59 GLU HB3 H 1 2.265 0.014 . 2 . 901 . . 54 GLU HB3 . 17403 1 729 . 1 1 59 59 GLU HG2 H 1 2.199 0.006 . 2 . 1264 . . 54 GLU HG2 . 17403 1 730 . 1 1 59 59 GLU HG3 H 1 2.140 0.005 . 2 . 1265 . . 54 GLU HG3 . 17403 1 731 . 1 1 59 59 GLU C C 13 175.907 . . 1 . 620 . . 54 GLU C . 17403 1 732 . 1 1 59 59 GLU CA C 13 57.582 0.034 . 1 . 350 . . 54 GLU CA . 17403 1 733 . 1 1 59 59 GLU CB C 13 26.378 0.035 . 1 . 349 . . 54 GLU CB . 17403 1 734 . 1 1 59 59 GLU CG C 13 36.625 0.017 . 1 . 1266 . . 54 GLU CG . 17403 1 735 . 1 1 59 59 GLU N N 15 110.245 0.031 . 1 . 257 . . 54 GLU N . 17403 1 736 . 1 1 60 60 LEU H H 1 7.206 0.016 . 1 . 96 . . 55 LEU H . 17403 1 737 . 1 1 60 60 LEU HA H 1 4.465 0.005 . 1 . 737 . . 55 LEU HA . 17403 1 738 . 1 1 60 60 LEU HB2 H 1 1.404 0.008 . 2 . 904 . . 55 LEU HB2 . 17403 1 739 . 1 1 60 60 LEU HB3 H 1 0.933 0.017 . 2 . 903 . . 55 LEU HB3 . 17403 1 740 . 1 1 60 60 LEU HG H 1 1.497 0.011 . 1 . 1387 . . 55 LEU HG . 17403 1 741 . 1 1 60 60 LEU HD11 H 1 0.542 0.008 . 2 . 1690 . . 55 LEU HD11 . 17403 1 742 . 1 1 60 60 LEU HD12 H 1 0.542 0.008 . 2 . 1690 . . 55 LEU HD12 . 17403 1 743 . 1 1 60 60 LEU HD13 H 1 0.542 0.008 . 2 . 1690 . . 55 LEU HD13 . 17403 1 744 . 1 1 60 60 LEU HD21 H 1 0.541 0.002 . 2 . 1389 . . 55 LEU HD21 . 17403 1 745 . 1 1 60 60 LEU HD22 H 1 0.541 0.002 . 2 . 1389 . . 55 LEU HD22 . 17403 1 746 . 1 1 60 60 LEU HD23 H 1 0.541 0.002 . 2 . 1389 . . 55 LEU HD23 . 17403 1 747 . 1 1 60 60 LEU C C 13 176.084 . . 1 . 573 . . 55 LEU C . 17403 1 748 . 1 1 60 60 LEU CA C 13 53.783 0.053 . 1 . 319 . . 55 LEU CA . 17403 1 749 . 1 1 60 60 LEU CB C 13 42.251 0.041 . 1 . 318 . . 55 LEU CB . 17403 1 750 . 1 1 60 60 LEU CG C 13 26.167 0.041 . 1 . 1388 . . 55 LEU CG . 17403 1 751 . 1 1 60 60 LEU CD1 C 13 24.742 0.03 . 2 . 1689 . . 55 LEU CD1 . 17403 1 752 . 1 1 60 60 LEU CD2 C 13 22.531 0.03 . 2 . 1390 . . 55 LEU CD2 . 17403 1 753 . 1 1 60 60 LEU N N 15 117.505 0.017 . 1 . 97 . . 55 LEU N . 17403 1 754 . 1 1 61 61 LYS H H 1 8.658 0.005 . 1 . 31 . . 56 LYS H . 17403 1 755 . 1 1 61 61 LYS HA H 1 4.476 0.005 . 1 . 732 . . 56 LYS HA . 17403 1 756 . 1 1 61 61 LYS HB2 H 1 1.686 0.018 . 2 . 906 . . 56 LYS HB2 . 17403 1 757 . 1 1 61 61 LYS HB3 H 1 1.541 0.014 . 2 . 905 . . 56 LYS HB3 . 17403 1 758 . 1 1 61 61 LYS HG2 H 1 1.256 0.011 . 2 . 1144 . . 56 LYS HG2 . 17403 1 759 . 1 1 61 61 LYS HG3 H 1 1.340 0.009 . 2 . 1143 . . 56 LYS HG3 . 17403 1 760 . 1 1 61 61 LYS HD2 H 1 1.604 0.006 . 2 . 1458 . . 56 LYS HD2 . 17403 1 761 . 1 1 61 61 LYS HD3 H 1 1.586 0.001 . 2 . 1457 . . 56 LYS HD3 . 17403 1 762 . 1 1 61 61 LYS HE2 H 1 2.960 0.0 . 2 . 1460 . . 56 LYS HE2 . 17403 1 763 . 1 1 61 61 LYS HE3 H 1 2.934 0.017 . 2 . 1459 . . 56 LYS HE3 . 17403 1 764 . 1 1 61 61 LYS C C 13 175.941 . . 1 . 588 . . 56 LYS C . 17403 1 765 . 1 1 61 61 LYS CA C 13 55.150 0.041 . 1 . 484 . . 56 LYS CA . 17403 1 766 . 1 1 61 61 LYS CB C 13 32.302 0.043 . 1 . 485 . . 56 LYS CB . 17403 1 767 . 1 1 61 61 LYS CG C 13 24.451 0.038 . 1 . 1145 . . 56 LYS CG . 17403 1 768 . 1 1 61 61 LYS CD C 13 29.048 0.002 . 1 . 1456 . . 56 LYS CD . 17403 1 769 . 1 1 61 61 LYS CE C 13 41.941 . . 1 . 1461 . . 56 LYS CE . 17403 1 770 . 1 1 61 61 LYS N N 15 123.658 0.022 . 1 . 32 . . 56 LYS N . 17403 1 771 . 1 1 62 62 VAL H H 1 8.058 0.006 . 1 . 274 . . 57 VAL H . 17403 1 772 . 1 1 62 62 VAL HA H 1 5.582 0.005 . 1 . 739 . . 57 VAL HA . 17403 1 773 . 1 1 62 62 VAL HB H 1 1.945 0.004 . 1 . 673 . . 57 VAL HB . 17403 1 774 . 1 1 62 62 VAL HG11 H 1 0.885 0.011 . 2 . 1224 . . 57 VAL HG11 . 17403 1 775 . 1 1 62 62 VAL HG12 H 1 0.885 0.011 . 2 . 1224 . . 57 VAL HG12 . 17403 1 776 . 1 1 62 62 VAL HG13 H 1 0.885 0.011 . 2 . 1224 . . 57 VAL HG13 . 17403 1 777 . 1 1 62 62 VAL HG21 H 1 0.898 0.005 . 2 . 1225 . . 57 VAL HG21 . 17403 1 778 . 1 1 62 62 VAL HG22 H 1 0.898 0.005 . 2 . 1225 . . 57 VAL HG22 . 17403 1 779 . 1 1 62 62 VAL HG23 H 1 0.898 0.005 . 2 . 1225 . . 57 VAL HG23 . 17403 1 780 . 1 1 62 62 VAL C C 13 175.405 . . 1 . 583 . . 57 VAL C . 17403 1 781 . 1 1 62 62 VAL CA C 13 58.259 0.052 . 1 . 684 . . 57 VAL CA . 17403 1 782 . 1 1 62 62 VAL CB C 13 35.738 0.057 . 1 . 683 . . 57 VAL CB . 17403 1 783 . 1 1 62 62 VAL CG1 C 13 23.201 0.035 . 2 . 1564 . . 57 VAL CG1 . 17403 1 784 . 1 1 62 62 VAL CG2 C 13 20.246 0.024 . 2 . 1565 . . 57 VAL CG2 . 17403 1 785 . 1 1 62 62 VAL N N 15 118.315 0.049 . 1 . 275 . . 57 VAL N . 17403 1 786 . 1 1 63 63 LYS H H 1 8.240 0.008 . 1 . 69 . . 58 LYS H . 17403 1 787 . 1 1 63 63 LYS HA H 1 4.462 0.004 . 1 . 721 . . 58 LYS HA . 17403 1 788 . 1 1 63 63 LYS HB2 H 1 1.749 0.015 . 2 . 908 . . 58 LYS HB2 . 17403 1 789 . 1 1 63 63 LYS HB3 H 1 1.681 0.003 . 2 . 907 . . 58 LYS HB3 . 17403 1 790 . 1 1 63 63 LYS HG2 H 1 1.296 0.003 . 2 . 1462 . . 58 LYS HG2 . 17403 1 791 . 1 1 63 63 LYS HG3 H 1 1.296 0.003 . 2 . 1463 . . 58 LYS HG3 . 17403 1 792 . 1 1 63 63 LYS HD2 H 1 1.589 0.008 . 2 . 1465 . . 58 LYS HD2 . 17403 1 793 . 1 1 63 63 LYS HD3 H 1 1.587 0.008 . 2 . 1466 . . 58 LYS HD3 . 17403 1 794 . 1 1 63 63 LYS HE2 H 1 2.809 0.002 . 2 . 1469 . . 58 LYS HE2 . 17403 1 795 . 1 1 63 63 LYS HE3 H 1 2.889 0.006 . 2 . 1468 . . 58 LYS HE3 . 17403 1 796 . 1 1 63 63 LYS C C 13 173.797 . . 1 . 572 . . 58 LYS C . 17403 1 797 . 1 1 63 63 LYS CA C 13 55.787 0.041 . 1 . 322 . . 58 LYS CA . 17403 1 798 . 1 1 63 63 LYS CB C 13 36.154 0.053 . 1 . 323 . . 58 LYS CB . 17403 1 799 . 1 1 63 63 LYS CG C 13 24.254 0.017 . 1 . 1464 . . 58 LYS CG . 17403 1 800 . 1 1 63 63 LYS CD C 13 29.230 0.018 . 1 . 1467 . . 58 LYS CD . 17403 1 801 . 1 1 63 63 LYS CE C 13 41.859 0.041 . 1 . 1470 . . 58 LYS CE . 17403 1 802 . 1 1 63 63 LYS N N 15 120.881 0.051 . 1 . 70 . . 58 LYS N . 17403 1 803 . 1 1 64 64 GLN H H 1 9.010 0.004 . 1 . 37 . . 59 GLN H . 17403 1 804 . 1 1 64 64 GLN HA H 1 5.028 0.004 . 1 . 793 . . 59 GLN HA . 17403 1 805 . 1 1 64 64 GLN HB2 H 1 1.975 0.003 . 2 . 910 . . 59 GLN HB2 . 17403 1 806 . 1 1 64 64 GLN HB3 H 1 1.720 0.004 . 2 . 909 . . 59 GLN HB3 . 17403 1 807 . 1 1 64 64 GLN HG2 H 1 2.141 0.014 . 2 . 1150 . . 59 GLN HG2 . 17403 1 808 . 1 1 64 64 GLN HG3 H 1 2.119 0.012 . 2 . 1149 . . 59 GLN HG3 . 17403 1 809 . 1 1 64 64 GLN HE21 H 1 7.134 0.003 . 1 . 122 . . 59 GLN HE21 . 17403 1 810 . 1 1 64 64 GLN HE22 H 1 6.605 0.003 . 1 . 207 . . 59 GLN HE22 . 17403 1 811 . 1 1 64 64 GLN C C 13 174.702 . . 1 . 552 . . 59 GLN C . 17403 1 812 . 1 1 64 64 GLN CA C 13 54.809 0.039 . 1 . 492 . . 59 GLN CA . 17403 1 813 . 1 1 64 64 GLN CB C 13 29.772 0.021 . 1 . 493 . . 59 GLN CB . 17403 1 814 . 1 1 64 64 GLN CG C 13 33.960 0.025 . 1 . 1151 . . 59 GLN CG . 17403 1 815 . 1 1 64 64 GLN N N 15 125.735 0.02 . 1 . 38 . . 59 GLN N . 17403 1 816 . 1 1 64 64 GLN NE2 N 15 110.366 0.029 . 1 . 123 . . 59 GLN NE2 . 17403 1 817 . 1 1 65 65 VAL H H 1 9.213 0.008 . 1 . 280 . . 60 VAL H . 17403 1 818 . 1 1 65 65 VAL HA H 1 4.704 0.003 . 1 . 734 . . 60 VAL HA . 17403 1 819 . 1 1 65 65 VAL HB H 1 2.108 0.002 . 1 . 911 . . 60 VAL HB . 17403 1 820 . 1 1 65 65 VAL HG11 H 1 0.798 0.018 . 2 . 1227 . . 60 VAL HG11 . 17403 1 821 . 1 1 65 65 VAL HG12 H 1 0.798 0.018 . 2 . 1227 . . 60 VAL HG12 . 17403 1 822 . 1 1 65 65 VAL HG13 H 1 0.798 0.018 . 2 . 1227 . . 60 VAL HG13 . 17403 1 823 . 1 1 65 65 VAL HG21 H 1 0.884 0.004 . 2 . 1228 . . 60 VAL HG21 . 17403 1 824 . 1 1 65 65 VAL HG22 H 1 0.884 0.004 . 2 . 1228 . . 60 VAL HG22 . 17403 1 825 . 1 1 65 65 VAL HG23 H 1 0.884 0.004 . 2 . 1228 . . 60 VAL HG23 . 17403 1 826 . 1 1 65 65 VAL C C 13 174.104 . . 1 . 616 . . 60 VAL C . 17403 1 827 . 1 1 65 65 VAL CA C 13 59.633 0.045 . 1 . 338 . . 60 VAL CA . 17403 1 828 . 1 1 65 65 VAL CB C 13 35.858 0.035 . 1 . 1226 . . 60 VAL CB . 17403 1 829 . 1 1 65 65 VAL CG1 C 13 19.980 0.03 . 2 . 1229 . . 60 VAL CG1 . 17403 1 830 . 1 1 65 65 VAL CG2 C 13 22.263 0.041 . 2 . 1230 . . 60 VAL CG2 . 17403 1 831 . 1 1 65 65 VAL N N 15 120.546 0.032 . 1 . 281 . . 60 VAL N . 17403 1 832 . 1 1 66 66 LYS H H 1 8.441 0.004 . 1 . 1646 . . 61 LYS H . 17403 1 833 . 1 1 66 66 LYS HA H 1 5.031 0.006 . 1 . 723 . . 61 LYS HA . 17403 1 834 . 1 1 66 66 LYS HB2 H 1 1.597 0.012 . 2 . 912 . . 61 LYS HB2 . 17403 1 835 . 1 1 66 66 LYS HB3 H 1 1.706 0.005 . 2 . 913 . . 61 LYS HB3 . 17403 1 836 . 1 1 66 66 LYS HG2 H 1 1.038 0.003 . 2 . 1586 . . 61 LYS HG2 . 17403 1 837 . 1 1 66 66 LYS HG3 H 1 1.241 0.009 . 2 . 1471 . . 61 LYS HG3 . 17403 1 838 . 1 1 66 66 LYS HD2 H 1 1.569 0.005 . 2 . 1472 . . 61 LYS HD2 . 17403 1 839 . 1 1 66 66 LYS HD3 H 1 1.567 0.003 . 2 . 1473 . . 61 LYS HD3 . 17403 1 840 . 1 1 66 66 LYS HE2 H 1 2.805 0.009 . 2 . 1476 . . 61 LYS HE2 . 17403 1 841 . 1 1 66 66 LYS HE3 H 1 2.805 0.008 . 2 . 1475 . . 61 LYS HE3 . 17403 1 842 . 1 1 66 66 LYS C C 13 176.706 . . 1 . 614 . . 61 LYS C . 17403 1 843 . 1 1 66 66 LYS CA C 13 54.924 0.039 . 1 . 355 . . 61 LYS CA . 17403 1 844 . 1 1 66 66 LYS CB C 13 32.965 0.042 . 1 . 356 . . 61 LYS CB . 17403 1 845 . 1 1 66 66 LYS CG C 13 24.776 0.042 . 1 . 1587 . . 61 LYS CG . 17403 1 846 . 1 1 66 66 LYS CD C 13 29.149 0.045 . 1 . 1474 . . 61 LYS CD . 17403 1 847 . 1 1 66 66 LYS CE C 13 41.652 . . 1 . 1477 . . 61 LYS CE . 17403 1 848 . 1 1 66 66 LYS N N 15 124.039 0.035 . 1 . 73 . . 61 LYS N . 17403 1 849 . 1 1 67 67 LYS H H 1 7.705 0.002 . 1 . 106 . . 62 LYS H . 17403 1 850 . 1 1 67 67 LYS HA H 1 4.943 0.003 . 1 . 811 . . 62 LYS HA . 17403 1 851 . 1 1 67 67 LYS HB2 H 1 1.554 0.004 . 2 . 914 . . 62 LYS HB2 . 17403 1 852 . 1 1 67 67 LYS HB3 H 1 1.625 0.018 . 2 . 915 . . 62 LYS HB3 . 17403 1 853 . 1 1 67 67 LYS HG2 H 1 1.279 0.019 . 2 . 1479 . . 62 LYS HG2 . 17403 1 854 . 1 1 67 67 LYS HG3 H 1 1.220 0.021 . 2 . 1478 . . 62 LYS HG3 . 17403 1 855 . 1 1 67 67 LYS HD2 H 1 1.897 0.019 . 2 . 1665 . . 62 LYS HD2 . 17403 1 856 . 1 1 67 67 LYS HD3 H 1 1.475 0.006 . 2 . 1481 . . 62 LYS HD3 . 17403 1 857 . 1 1 67 67 LYS HE2 H 1 2.811 0.005 . 2 . 1662 . . 62 LYS HE2 . 17403 1 858 . 1 1 67 67 LYS HE3 H 1 2.811 0.005 . 2 . 1663 . . 62 LYS HE3 . 17403 1 859 . 1 1 67 67 LYS C C 13 176.977 . . 1 . 645 . . 62 LYS C . 17403 1 860 . 1 1 67 67 LYS CA C 13 53.047 0.051 . 1 . 423 . . 62 LYS CA . 17403 1 861 . 1 1 67 67 LYS CB C 13 36.680 0.044 . 1 . 422 . . 62 LYS CB . 17403 1 862 . 1 1 67 67 LYS CG C 13 24.765 0.059 . 1 . 1480 . . 62 LYS CG . 17403 1 863 . 1 1 67 67 LYS CD C 13 28.798 0.027 . 1 . 1664 . . 62 LYS CD . 17403 1 864 . 1 1 67 67 LYS CE C 13 41.932 0.011 . 1 . 1666 . . 62 LYS CE . 17403 1 865 . 1 1 67 67 LYS N N 15 122.232 0.015 . 1 . 107 . . 62 LYS N . 17403 1 866 . 1 1 68 68 THR H H 1 8.315 0.008 . 1 . 199 . . 63 THR H . 17403 1 867 . 1 1 68 68 THR HA H 1 4.601 0.006 . 1 . 726 . . 63 THR HA . 17403 1 868 . 1 1 68 68 THR HB H 1 4.613 0.006 . 1 . 1169 . . 63 THR HB . 17403 1 869 . 1 1 68 68 THR HG1 H 1 8.120 . . 1 . 1677 . . 63 THR HG1 . 17403 1 870 . 1 1 68 68 THR HG21 H 1 1.357 0.002 . 1 . 1170 . . 63 THR HG21 . 17403 1 871 . 1 1 68 68 THR HG22 H 1 1.357 0.002 . 1 . 1170 . . 63 THR HG22 . 17403 1 872 . 1 1 68 68 THR HG23 H 1 1.357 0.002 . 1 . 1170 . . 63 THR HG23 . 17403 1 873 . 1 1 68 68 THR C C 13 176.340 . . 1 . 665 . . 63 THR C . 17403 1 874 . 1 1 68 68 THR CA C 13 61.698 0.048 . 1 . 342 . . 63 THR CA . 17403 1 875 . 1 1 68 68 THR CB C 13 69.668 0.058 . 1 . 341 . . 63 THR CB . 17403 1 876 . 1 1 68 68 THR CG2 C 13 22.918 0.03 . 1 . 1171 . . 63 THR CG2 . 17403 1 877 . 1 1 68 68 THR N N 15 116.829 0.044 . 1 . 200 . . 63 THR N . 17403 1 878 . 1 1 69 69 ILE H H 1 8.891 0.004 . 1 . 82 . . 64 ILE H . 17403 1 879 . 1 1 69 69 ILE HA H 1 3.594 0.002 . 1 . 671 . . 64 ILE HA . 17403 1 880 . 1 1 69 69 ILE HB H 1 1.951 0.004 . 1 . 916 . . 64 ILE HB . 17403 1 881 . 1 1 69 69 ILE HG12 H 1 1.102 0.012 . 2 . 1290 . . 64 ILE HG12 . 17403 1 882 . 1 1 69 69 ILE HG13 H 1 1.634 0.003 . 2 . 1291 . . 64 ILE HG13 . 17403 1 883 . 1 1 69 69 ILE HG21 H 1 0.980 0.017 . 1 . 1289 . . 64 ILE HG21 . 17403 1 884 . 1 1 69 69 ILE HG22 H 1 0.980 0.017 . 1 . 1289 . . 64 ILE HG22 . 17403 1 885 . 1 1 69 69 ILE HG23 H 1 0.980 0.017 . 1 . 1289 . . 64 ILE HG23 . 17403 1 886 . 1 1 69 69 ILE HD11 H 1 0.952 0.013 . 1 . 1293 . . 64 ILE HD11 . 17403 1 887 . 1 1 69 69 ILE HD12 H 1 0.952 0.013 . 1 . 1293 . . 64 ILE HD12 . 17403 1 888 . 1 1 69 69 ILE HD13 H 1 0.952 0.013 . 1 . 1293 . . 64 ILE HD13 . 17403 1 889 . 1 1 69 69 ILE C C 13 177.481 . . 1 . 651 . . 64 ILE C . 17403 1 890 . 1 1 69 69 ILE CA C 13 64.753 0.047 . 1 . 491 . . 64 ILE CA . 17403 1 891 . 1 1 69 69 ILE CB C 13 38.034 0.034 . 1 . 490 . . 64 ILE CB . 17403 1 892 . 1 1 69 69 ILE CG1 C 13 29.950 0.034 . 1 . 1294 . . 64 ILE CG1 . 17403 1 893 . 1 1 69 69 ILE CG2 C 13 16.878 0.039 . 1 . 1292 . . 64 ILE CG2 . 17403 1 894 . 1 1 69 69 ILE CD1 C 13 14.359 0.028 . 1 . 1295 . . 64 ILE CD1 . 17403 1 895 . 1 1 69 69 ILE N N 15 120.309 0.034 . 1 . 83 . . 64 ILE N . 17403 1 896 . 1 1 70 70 ASP H H 1 8.700 0.003 . 1 . 278 . . 65 ASP H . 17403 1 897 . 1 1 70 70 ASP HA H 1 4.398 0.003 . 1 . 752 . . 65 ASP HA . 17403 1 898 . 1 1 70 70 ASP HB2 H 1 2.709 0.005 . 2 . 918 . . 65 ASP HB2 . 17403 1 899 . 1 1 70 70 ASP HB3 H 1 2.709 0.003 . 2 . 917 . . 65 ASP HB3 . 17403 1 900 . 1 1 70 70 ASP C C 13 177.322 . . 1 . 638 . . 65 ASP C . 17403 1 901 . 1 1 70 70 ASP CA C 13 55.758 0.053 . 1 . 317 . . 65 ASP CA . 17403 1 902 . 1 1 70 70 ASP CB C 13 40.014 0.028 . 1 . 316 . . 65 ASP CB . 17403 1 903 . 1 1 70 70 ASP N N 15 118.224 0.017 . 1 . 279 . . 65 ASP N . 17403 1 904 . 1 1 71 71 ARG H H 1 7.606 0.005 . 1 . 25 . . 66 ARG H . 17403 1 905 . 1 1 71 71 ARG HA H 1 4.537 0.002 . 1 . 763 . . 66 ARG HA . 17403 1 906 . 1 1 71 71 ARG HB2 H 1 1.826 0.016 . 2 . 919 . . 66 ARG HB2 . 17403 1 907 . 1 1 71 71 ARG HB3 H 1 2.235 0.004 . 2 . 1187 . . 66 ARG HB3 . 17403 1 908 . 1 1 71 71 ARG HG2 H 1 1.680 0.016 . 2 . 1188 . . 66 ARG HG2 . 17403 1 909 . 1 1 71 71 ARG HG3 H 1 1.852 0.014 . 2 . 1190 . . 66 ARG HG3 . 17403 1 910 . 1 1 71 71 ARG HD2 H 1 3.152 0.003 . 2 . 1191 . . 66 ARG HD2 . 17403 1 911 . 1 1 71 71 ARG HD3 H 1 3.152 0.003 . 2 . 1192 . . 66 ARG HD3 . 17403 1 912 . 1 1 71 71 ARG HE H 1 7.239 . . 1 . 1652 . . 66 ARG HE . 17403 1 913 . 1 1 71 71 ARG C C 13 178.337 . . 1 . 661 . . 66 ARG C . 17403 1 914 . 1 1 71 71 ARG CA C 13 55.089 0.046 . 1 . 337 . . 66 ARG CA . 17403 1 915 . 1 1 71 71 ARG CB C 13 29.675 0.023 . 1 . 336 . . 66 ARG CB . 17403 1 916 . 1 1 71 71 ARG CG C 13 26.202 0.037 . 1 . 1189 . . 66 ARG CG . 17403 1 917 . 1 1 71 71 ARG CD C 13 42.165 0.042 . 1 . 1193 . . 66 ARG CD . 17403 1 918 . 1 1 71 71 ARG N N 15 116.055 0.025 . 1 . 26 . . 66 ARG N . 17403 1 919 . 1 1 71 71 ARG NE N 15 85.562 . . 1 . 1653 . . 66 ARG NE . 17403 1 920 . 1 1 72 72 LEU H H 1 7.669 0.012 . 1 . 71 . . 67 LEU H . 17403 1 921 . 1 1 72 72 LEU HA H 1 4.017 0.006 . 1 . 767 . . 67 LEU HA . 17403 1 922 . 1 1 72 72 LEU HB2 H 1 1.235 0.006 . 2 . 920 . . 67 LEU HB2 . 17403 1 923 . 1 1 72 72 LEU HB3 H 1 1.920 0.014 . 2 . 921 . . 67 LEU HB3 . 17403 1 924 . 1 1 72 72 LEU HG H 1 1.808 0.01 . 1 . 1417 . . 67 LEU HG . 17403 1 925 . 1 1 72 72 LEU HD11 H 1 0.625 0.009 . 2 . 1419 . . 67 LEU HD11 . 17403 1 926 . 1 1 72 72 LEU HD12 H 1 0.625 0.009 . 2 . 1419 . . 67 LEU HD12 . 17403 1 927 . 1 1 72 72 LEU HD13 H 1 0.625 0.009 . 2 . 1419 . . 67 LEU HD13 . 17403 1 928 . 1 1 72 72 LEU HD21 H 1 0.503 0.002 . 2 . 1420 . . 67 LEU HD21 . 17403 1 929 . 1 1 72 72 LEU HD22 H 1 0.503 0.002 . 2 . 1420 . . 67 LEU HD22 . 17403 1 930 . 1 1 72 72 LEU HD23 H 1 0.503 0.002 . 2 . 1420 . . 67 LEU HD23 . 17403 1 931 . 1 1 72 72 LEU C C 13 176.363 . . 1 . 551 . . 67 LEU C . 17403 1 932 . 1 1 72 72 LEU CA C 13 56.596 0.048 . 1 . 357 . . 67 LEU CA . 17403 1 933 . 1 1 72 72 LEU CB C 13 40.832 0.041 . 1 . 358 . . 67 LEU CB . 17403 1 934 . 1 1 72 72 LEU CG C 13 25.952 0.032 . 1 . 1418 . . 67 LEU CG . 17403 1 935 . 1 1 72 72 LEU CD1 C 13 22.591 0.043 . 2 . 1422 . . 67 LEU CD1 . 17403 1 936 . 1 1 72 72 LEU CD2 C 13 26.553 0.044 . 2 . 1421 . . 67 LEU CD2 . 17403 1 937 . 1 1 72 72 LEU N N 15 119.208 0.042 . 1 . 72 . . 67 LEU N . 17403 1 938 . 1 1 73 73 ASN H H 1 7.554 0.005 . 1 . 110 . . 68 ASN H . 17403 1 939 . 1 1 73 73 ASN HA H 1 4.196 0.006 . 1 . 680 . . 68 ASN HA . 17403 1 940 . 1 1 73 73 ASN HB2 H 1 2.129 0.009 . 2 . 922 . . 68 ASN HB2 . 17403 1 941 . 1 1 73 73 ASN HB3 H 1 2.130 0.008 . 2 . 1132 . . 68 ASN HB3 . 17403 1 942 . 1 1 73 73 ASN HD21 H 1 6.593 0.003 . 1 . 217 . . 68 ASN HD21 . 17403 1 943 . 1 1 73 73 ASN HD22 H 1 7.123 0.017 . 1 . 144 . . 68 ASN HD22 . 17403 1 944 . 1 1 73 73 ASN C C 13 174.638 . . 1 . 649 . . 68 ASN C . 17403 1 945 . 1 1 73 73 ASN CA C 13 54.618 0.051 . 1 . 371 . . 68 ASN CA . 17403 1 946 . 1 1 73 73 ASN CB C 13 38.027 0.037 . 1 . 372 . . 68 ASN CB . 17403 1 947 . 1 1 73 73 ASN N N 15 113.203 0.045 . 1 . 111 . . 68 ASN N . 17403 1 948 . 1 1 73 73 ASN ND2 N 15 112.308 0.039 . 1 . 145 . . 68 ASN ND2 . 17403 1 949 . 1 1 74 74 PHE H H 1 7.459 0.003 . 1 . 132 . . 69 PHE H . 17403 1 950 . 1 1 74 74 PHE HA H 1 4.762 0.003 . 1 . 923 . . 69 PHE HA . 17403 1 951 . 1 1 74 74 PHE HB2 H 1 2.748 0.017 . 2 . 924 . . 69 PHE HB2 . 17403 1 952 . 1 1 74 74 PHE HB3 H 1 3.505 0.002 . 2 . 925 . . 69 PHE HB3 . 17403 1 953 . 1 1 74 74 PHE HD1 H 1 7.193 0.004 . 3 . 1098 . . 69 PHE HD1 . 17403 1 954 . 1 1 74 74 PHE HD2 H 1 7.193 0.004 . 3 . 1098 . . 69 PHE HD2 . 17403 1 955 . 1 1 74 74 PHE HE1 H 1 7.363 0.003 . 3 . 1100 . . 69 PHE HE1 . 17403 1 956 . 1 1 74 74 PHE HE2 H 1 7.363 0.003 . 3 . 1100 . . 69 PHE HE2 . 17403 1 957 . 1 1 74 74 PHE HZ H 1 7.294 0.003 . 1 . 1102 . . 69 PHE HZ . 17403 1 958 . 1 1 74 74 PHE C C 13 175.816 . . 1 . 563 . . 69 PHE C . 17403 1 959 . 1 1 74 74 PHE CA C 13 57.109 0.043 . 1 . 440 . . 69 PHE CA . 17403 1 960 . 1 1 74 74 PHE CB C 13 39.792 0.037 . 1 . 439 . . 69 PHE CB . 17403 1 961 . 1 1 74 74 PHE CD1 C 13 131.802 0.068 . 3 . 1099 . . 69 PHE CD1 . 17403 1 962 . 1 1 74 74 PHE CD2 C 13 131.802 0.068 . 3 . 1099 . . 69 PHE CD2 . 17403 1 963 . 1 1 74 74 PHE CE1 C 13 131.607 0.045 . 3 . 1101 . . 69 PHE CE1 . 17403 1 964 . 1 1 74 74 PHE CE2 C 13 131.607 0.045 . 3 . 1101 . . 69 PHE CE2 . 17403 1 965 . 1 1 74 74 PHE CZ C 13 129.736 0.001 . 1 . 1103 . . 69 PHE CZ . 17403 1 966 . 1 1 74 74 PHE N N 15 115.251 0.034 . 1 . 133 . . 69 PHE N . 17403 1 967 . 1 1 75 75 ILE H H 1 6.855 0.004 . 1 . 224 . . 70 ILE H . 17403 1 968 . 1 1 75 75 ILE HA H 1 4.611 0.006 . 1 . 773 . . 70 ILE HA . 17403 1 969 . 1 1 75 75 ILE HB H 1 1.976 0.004 . 1 . 926 . . 70 ILE HB . 17403 1 970 . 1 1 75 75 ILE HG12 H 1 1.316 0.014 . 2 . 1298 . . 70 ILE HG12 . 17403 1 971 . 1 1 75 75 ILE HG13 H 1 1.240 0.003 . 2 . 1297 . . 70 ILE HG13 . 17403 1 972 . 1 1 75 75 ILE HG21 H 1 0.931 0.015 . 1 . 1296 . . 70 ILE HG21 . 17403 1 973 . 1 1 75 75 ILE HG22 H 1 0.931 0.015 . 1 . 1296 . . 70 ILE HG22 . 17403 1 974 . 1 1 75 75 ILE HG23 H 1 0.931 0.015 . 1 . 1296 . . 70 ILE HG23 . 17403 1 975 . 1 1 75 75 ILE HD11 H 1 0.724 0.021 . 1 . 1300 . . 70 ILE HD11 . 17403 1 976 . 1 1 75 75 ILE HD12 H 1 0.724 0.021 . 1 . 1300 . . 70 ILE HD12 . 17403 1 977 . 1 1 75 75 ILE HD13 H 1 0.724 0.021 . 1 . 1300 . . 70 ILE HD13 . 17403 1 978 . 1 1 75 75 ILE C C 13 175.458 . . 1 . 663 . . 70 ILE C . 17403 1 979 . 1 1 75 75 ILE CA C 13 60.104 0.038 . 1 . 462 . . 70 ILE CA . 17403 1 980 . 1 1 75 75 ILE CB C 13 40.083 0.044 . 1 . 461 . . 70 ILE CB . 17403 1 981 . 1 1 75 75 ILE CG1 C 13 25.261 0.04 . 1 . 1301 . . 70 ILE CG1 . 17403 1 982 . 1 1 75 75 ILE CG2 C 13 17.833 0.027 . 1 . 1299 . . 70 ILE CG2 . 17403 1 983 . 1 1 75 75 ILE CD1 C 13 15.349 0.034 . 1 . 1302 . . 70 ILE CD1 . 17403 1 984 . 1 1 75 75 ILE N N 15 112.876 0.039 . 1 . 225 . . 70 ILE N . 17403 1 985 . 1 1 76 76 SER H H 1 8.279 0.01 . 1 . 247 . . 71 SER H . 17403 1 986 . 1 1 76 76 SER HA H 1 4.431 0.022 . 1 . 809 . . 71 SER HA . 17403 1 987 . 1 1 76 76 SER HB2 H 1 3.934 0.016 . 2 . 679 . . 71 SER HB2 . 17403 1 988 . 1 1 76 76 SER HB3 H 1 3.886 0.005 . 2 . 927 . . 71 SER HB3 . 17403 1 989 . 1 1 76 76 SER C C 13 172.567 . . 1 . 546 . . 71 SER C . 17403 1 990 . 1 1 76 76 SER CA C 13 58.528 0.014 . 1 . 505 . . 71 SER CA . 17403 1 991 . 1 1 76 76 SER CB C 13 63.491 0.1 . 1 . 463 . . 71 SER CB . 17403 1 992 . 1 1 76 76 SER N N 15 118.417 0.037 . 1 . 248 . . 71 SER N . 17403 1 993 . 1 1 77 77 LEU H H 1 8.117 0.006 . 1 . 58 . . 72 LEU H . 17403 1 994 . 1 1 77 77 LEU HA H 1 4.393 0.004 . 1 . 741 . . 72 LEU HA . 17403 1 995 . 1 1 77 77 LEU HB2 H 1 1.335 0.015 . 2 . 1679 . . 72 LEU HB2 . 17403 1 996 . 1 1 77 77 LEU HB3 H 1 1.524 0.009 . 2 . 1541 . . 72 LEU HB3 . 17403 1 997 . 1 1 77 77 LEU HG H 1 1.690 0.013 . 1 . 1529 . . 72 LEU HG . 17403 1 998 . 1 1 77 77 LEU HD11 H 1 0.720 0.021 . 2 . 1530 . . 72 LEU HD11 . 17403 1 999 . 1 1 77 77 LEU HD12 H 1 0.720 0.021 . 2 . 1530 . . 72 LEU HD12 . 17403 1 1000 . 1 1 77 77 LEU HD13 H 1 0.720 0.021 . 2 . 1530 . . 72 LEU HD13 . 17403 1 1001 . 1 1 77 77 LEU HD21 H 1 0.777 0.007 . 2 . 1532 . . 72 LEU HD21 . 17403 1 1002 . 1 1 77 77 LEU HD22 H 1 0.777 0.007 . 2 . 1532 . . 72 LEU HD22 . 17403 1 1003 . 1 1 77 77 LEU HD23 H 1 0.777 0.007 . 2 . 1532 . . 72 LEU HD23 . 17403 1 1004 . 1 1 77 77 LEU CA C 13 52.205 0.048 . 1 . 691 . . 72 LEU CA . 17403 1 1005 . 1 1 77 77 LEU CB C 13 42.561 0.037 . 1 . 690 . . 72 LEU CB . 17403 1 1006 . 1 1 77 77 LEU CG C 13 26.383 0.066 . 1 . 1533 . . 72 LEU CG . 17403 1 1007 . 1 1 77 77 LEU CD1 C 13 23.607 0.02 . 2 . 1531 . . 72 LEU CD1 . 17403 1 1008 . 1 1 77 77 LEU CD2 C 13 26.373 0.05 . 2 . 1534 . . 72 LEU CD2 . 17403 1 1009 . 1 1 77 77 LEU N N 15 124.505 0.014 . 1 . 59 . . 72 LEU N . 17403 1 1010 . 1 1 78 78 PRO HA H 1 5.033 0.003 . 1 . 928 . . 73 PRO HA . 17403 1 1011 . 1 1 78 78 PRO HB2 H 1 2.058 0.003 . 2 . 930 . . 73 PRO HB2 . 17403 1 1012 . 1 1 78 78 PRO HB3 H 1 1.561 0.004 . 2 . 929 . . 73 PRO HB3 . 17403 1 1013 . 1 1 78 78 PRO HG2 H 1 0.947 0.011 . 2 . 1115 . . 73 PRO HG2 . 17403 1 1014 . 1 1 78 78 PRO HG3 H 1 1.139 0.012 . 2 . 1116 . . 73 PRO HG3 . 17403 1 1015 . 1 1 78 78 PRO HD2 H 1 3.409 0.011 . 2 . 1119 . . 73 PRO HD2 . 17403 1 1016 . 1 1 78 78 PRO HD3 H 1 3.148 0.008 . 2 . 1118 . . 73 PRO HD3 . 17403 1 1017 . 1 1 78 78 PRO C C 13 175.740 . . 1 . 647 . . 73 PRO C . 17403 1 1018 . 1 1 78 78 PRO CA C 13 61.593 0.052 . 1 . 467 . . 73 PRO CA . 17403 1 1019 . 1 1 78 78 PRO CB C 13 35.839 0.048 . 1 . 466 . . 73 PRO CB . 17403 1 1020 . 1 1 78 78 PRO CG C 13 24.227 0.065 . 1 . 1117 . . 73 PRO CG . 17403 1 1021 . 1 1 78 78 PRO CD C 13 51.138 0.062 . 1 . 1120 . . 73 PRO CD . 17403 1 1022 . 1 1 79 79 ALA H H 1 8.576 0.004 . 1 . 250 . . 74 ALA H . 17403 1 1023 . 1 1 79 79 ALA HA H 1 5.001 0.01 . 1 . 733 . . 74 ALA HA . 17403 1 1024 . 1 1 79 79 ALA HB1 H 1 1.494 0.014 . 1 . 931 . . 74 ALA HB1 . 17403 1 1025 . 1 1 79 79 ALA HB2 H 1 1.494 0.014 . 1 . 931 . . 74 ALA HB2 . 17403 1 1026 . 1 1 79 79 ALA HB3 H 1 1.494 0.014 . 1 . 931 . . 74 ALA HB3 . 17403 1 1027 . 1 1 79 79 ALA C C 13 174.778 . . 1 . 568 . . 74 ALA C . 17403 1 1028 . 1 1 79 79 ALA CA C 13 51.003 0.045 . 1 . 489 . . 74 ALA CA . 17403 1 1029 . 1 1 79 79 ALA CB C 13 23.787 0.034 . 1 . 488 . . 74 ALA CB . 17403 1 1030 . 1 1 79 79 ALA N N 15 123.592 0.025 . 1 . 251 . . 74 ALA N . 17403 1 1031 . 1 1 80 80 LEU H H 1 8.637 0.008 . 1 . 276 . . 75 LEU H . 17403 1 1032 . 1 1 80 80 LEU HA H 1 4.605 0.007 . 1 . 759 . . 75 LEU HA . 17403 1 1033 . 1 1 80 80 LEU HB2 H 1 0.912 0.009 . 2 . 932 . . 75 LEU HB2 . 17403 1 1034 . 1 1 80 80 LEU HB3 H 1 1.768 0.004 . 2 . 933 . . 75 LEU HB3 . 17403 1 1035 . 1 1 80 80 LEU HG H 1 1.019 0.011 . 1 . 1411 . . 75 LEU HG . 17403 1 1036 . 1 1 80 80 LEU HD11 H 1 0.016 0.003 . 2 . 1414 . . 75 LEU HD11 . 17403 1 1037 . 1 1 80 80 LEU HD12 H 1 0.016 0.003 . 2 . 1414 . . 75 LEU HD12 . 17403 1 1038 . 1 1 80 80 LEU HD13 H 1 0.016 0.003 . 2 . 1414 . . 75 LEU HD13 . 17403 1 1039 . 1 1 80 80 LEU HD21 H 1 0.606 0.015 . 2 . 1413 . . 75 LEU HD21 . 17403 1 1040 . 1 1 80 80 LEU HD22 H 1 0.606 0.015 . 2 . 1413 . . 75 LEU HD22 . 17403 1 1041 . 1 1 80 80 LEU HD23 H 1 0.606 0.015 . 2 . 1413 . . 75 LEU HD23 . 17403 1 1042 . 1 1 80 80 LEU C C 13 173.929 . . 1 . 660 . . 75 LEU C . 17403 1 1043 . 1 1 80 80 LEU CA C 13 54.270 0.069 . 1 . 678 . . 75 LEU CA . 17403 1 1044 . 1 1 80 80 LEU CB C 13 45.037 0.037 . 1 . 689 . . 75 LEU CB . 17403 1 1045 . 1 1 80 80 LEU CG C 13 26.817 0.045 . 1 . 1412 . . 75 LEU CG . 17403 1 1046 . 1 1 80 80 LEU CD1 C 13 26.488 0.029 . 2 . 1416 . . 75 LEU CD1 . 17403 1 1047 . 1 1 80 80 LEU CD2 C 13 24.596 0.029 . 2 . 1415 . . 75 LEU CD2 . 17403 1 1048 . 1 1 80 80 LEU N N 15 122.752 0.03 . 1 . 277 . . 75 LEU N . 17403 1 1049 . 1 1 81 81 VAL H H 1 8.962 0.005 . 1 . 39 . . 76 VAL H . 17403 1 1050 . 1 1 81 81 VAL HA H 1 4.011 0.004 . 1 . 934 . . 76 VAL HA . 17403 1 1051 . 1 1 81 81 VAL HB H 1 0.747 0.013 . 1 . 935 . . 76 VAL HB . 17403 1 1052 . 1 1 81 81 VAL HG11 H 1 0.777 0.006 . 2 . 1231 . . 76 VAL HG11 . 17403 1 1053 . 1 1 81 81 VAL HG12 H 1 0.777 0.006 . 2 . 1231 . . 76 VAL HG12 . 17403 1 1054 . 1 1 81 81 VAL HG13 H 1 0.777 0.006 . 2 . 1231 . . 76 VAL HG13 . 17403 1 1055 . 1 1 81 81 VAL HG21 H 1 0.776 0.004 . 2 . 1232 . . 76 VAL HG21 . 17403 1 1056 . 1 1 81 81 VAL HG22 H 1 0.776 0.004 . 2 . 1232 . . 76 VAL HG22 . 17403 1 1057 . 1 1 81 81 VAL HG23 H 1 0.776 0.004 . 2 . 1232 . . 76 VAL HG23 . 17403 1 1058 . 1 1 81 81 VAL C C 13 173.042 . . 1 . 623 . . 76 VAL C . 17403 1 1059 . 1 1 81 81 VAL CA C 13 63.179 0.047 . 1 . 692 . . 76 VAL CA . 17403 1 1060 . 1 1 81 81 VAL CB C 13 30.122 0.047 . 1 . 540 . . 76 VAL CB . 17403 1 1061 . 1 1 81 81 VAL CG1 C 13 21.663 0.011 . 2 . 1351 . . 76 VAL CG1 . 17403 1 1062 . 1 1 81 81 VAL CG2 C 13 23.644 0.053 . 2 . 1352 . . 76 VAL CG2 . 17403 1 1063 . 1 1 81 81 VAL N N 15 128.717 0.036 . 1 . 40 . . 76 VAL N . 17403 1 1064 . 1 1 82 82 TRP H H 1 7.036 0.006 . 1 . 128 . . 77 TRP H . 17403 1 1065 . 1 1 82 82 TRP HA H 1 4.450 0.012 . 1 . 936 . . 77 TRP HA . 17403 1 1066 . 1 1 82 82 TRP HB2 H 1 2.295 0.004 . 2 . 937 . . 77 TRP HB2 . 17403 1 1067 . 1 1 82 82 TRP HB3 H 1 2.723 0.003 . 2 . 938 . . 77 TRP HB3 . 17403 1 1068 . 1 1 82 82 TRP HD1 H 1 6.709 0.003 . 1 . 1031 . . 77 TRP HD1 . 17403 1 1069 . 1 1 82 82 TRP HE1 H 1 9.989 0.001 . 1 . 88 . . 77 TRP HE1 . 17403 1 1070 . 1 1 82 82 TRP HE3 H 1 5.998 0.017 . 1 . 1046 . . 77 TRP HE3 . 17403 1 1071 . 1 1 82 82 TRP HZ2 H 1 7.357 0.006 . 1 . 1040 . . 77 TRP HZ2 . 17403 1 1072 . 1 1 82 82 TRP HZ3 H 1 5.294 0.003 . 1 . 1044 . . 77 TRP HZ3 . 17403 1 1073 . 1 1 82 82 TRP HH2 H 1 6.823 0.008 . 1 . 1042 . . 77 TRP HH2 . 17403 1 1074 . 1 1 82 82 TRP C C 13 176.806 . . 1 . 643 . . 77 TRP C . 17403 1 1075 . 1 1 82 82 TRP CA C 13 55.315 0.047 . 1 . 315 . . 77 TRP CA . 17403 1 1076 . 1 1 82 82 TRP CB C 13 30.109 0.042 . 1 . 314 . . 77 TRP CB . 17403 1 1077 . 1 1 82 82 TRP CD1 C 13 125.383 0.062 . 1 . 1030 . . 77 TRP CD1 . 17403 1 1078 . 1 1 82 82 TRP CE3 C 13 118.866 0.016 . 1 . 1047 . . 77 TRP CE3 . 17403 1 1079 . 1 1 82 82 TRP CZ2 C 13 113.443 0.023 . 1 . 1041 . . 77 TRP CZ2 . 17403 1 1080 . 1 1 82 82 TRP CZ3 C 13 120.452 0.057 . 1 . 1045 . . 77 TRP CZ3 . 17403 1 1081 . 1 1 82 82 TRP CH2 C 13 124.217 0.016 . 1 . 1043 . . 77 TRP CH2 . 17403 1 1082 . 1 1 82 82 TRP N N 15 128.424 0.036 . 1 . 129 . . 77 TRP N . 17403 1 1083 . 1 1 82 82 TRP NE1 N 15 127.927 0.02 . 1 . 89 . . 77 TRP NE1 . 17403 1 1084 . 1 1 83 83 ARG H H 1 10.817 0.003 . 1 . 23 . . 78 ARG H . 17403 1 1085 . 1 1 83 83 ARG HA H 1 4.816 0.004 . 1 . 782 . . 78 ARG HA . 17403 1 1086 . 1 1 83 83 ARG HB2 H 1 1.001 0.005 . 2 . 939 . . 78 ARG HB2 . 17403 1 1087 . 1 1 83 83 ARG HB3 H 1 1.844 0.004 . 2 . 1194 . . 78 ARG HB3 . 17403 1 1088 . 1 1 83 83 ARG HG2 H 1 1.484 0.012 . 2 . 1197 . . 78 ARG HG2 . 17403 1 1089 . 1 1 83 83 ARG HG3 H 1 1.482 0.003 . 2 . 1196 . . 78 ARG HG3 . 17403 1 1090 . 1 1 83 83 ARG HD2 H 1 3.478 0.004 . 2 . 1199 . . 78 ARG HD2 . 17403 1 1091 . 1 1 83 83 ARG HD3 H 1 3.559 0.002 . 2 . 1198 . . 78 ARG HD3 . 17403 1 1092 . 1 1 83 83 ARG HE H 1 7.664 0.013 . 1 . 1597 . . 78 ARG HE . 17403 1 1093 . 1 1 83 83 ARG C C 13 178.070 . . 1 . 579 . . 78 ARG C . 17403 1 1094 . 1 1 83 83 ARG CA C 13 54.744 0.043 . 1 . 478 . . 78 ARG CA . 17403 1 1095 . 1 1 83 83 ARG CB C 13 34.549 0.043 . 1 . 479 . . 78 ARG CB . 17403 1 1096 . 1 1 83 83 ARG CG C 13 28.836 0.031 . 1 . 1195 . . 78 ARG CG . 17403 1 1097 . 1 1 83 83 ARG CD C 13 42.208 0.033 . 1 . 1200 . . 78 ARG CD . 17403 1 1098 . 1 1 83 83 ARG N N 15 133.869 0.03 . 1 . 24 . . 78 ARG N . 17403 1 1099 . 1 1 83 83 ARG NE N 15 83.012 0.052 . 1 . 1598 . . 78 ARG NE . 17403 1 1100 . 1 1 84 84 GLU H H 1 9.195 0.003 . 1 . 267 . . 79 GLU H . 17403 1 1101 . 1 1 84 84 GLU HA H 1 4.093 0.014 . 1 . 719 . . 79 GLU HA . 17403 1 1102 . 1 1 84 84 GLU HB2 H 1 2.155 0.002 . 2 . 940 . . 79 GLU HB2 . 17403 1 1103 . 1 1 84 84 GLU HB3 H 1 2.077 0.005 . 2 . 537 . . 79 GLU HB3 . 17403 1 1104 . 1 1 84 84 GLU HG2 H 1 2.443 0.004 . 2 . 1262 . . 79 GLU HG2 . 17403 1 1105 . 1 1 84 84 GLU HG3 H 1 2.382 0.003 . 2 . 1261 . . 79 GLU HG3 . 17403 1 1106 . 1 1 84 84 GLU C C 13 176.983 . . 1 . 510 . . 79 GLU C . 17403 1 1107 . 1 1 84 84 GLU CA C 13 58.528 0.038 . 1 . 297 . . 79 GLU CA . 17403 1 1108 . 1 1 84 84 GLU CB C 13 29.489 0.044 . 1 . 296 . . 79 GLU CB . 17403 1 1109 . 1 1 84 84 GLU CG C 13 36.320 0.023 . 1 . 1263 . . 79 GLU CG . 17403 1 1110 . 1 1 84 84 GLU N N 15 121.899 0.026 . 1 . 268 . . 79 GLU N . 17403 1 1111 . 1 1 85 85 ASP H H 1 7.715 0.006 . 1 . 1 . . 80 ASP H . 17403 1 1112 . 1 1 85 85 ASP HA H 1 4.464 0.007 . 1 . 745 . . 80 ASP HA . 17403 1 1113 . 1 1 85 85 ASP HB2 H 1 2.628 0.003 . 2 . 941 . . 80 ASP HB2 . 17403 1 1114 . 1 1 85 85 ASP HB3 H 1 3.066 0.003 . 2 . 942 . . 80 ASP HB3 . 17403 1 1115 . 1 1 85 85 ASP C C 13 176.840 . . 1 . 632 . . 80 ASP C . 17403 1 1116 . 1 1 85 85 ASP CA C 13 52.767 0.044 . 1 . 415 . . 80 ASP CA . 17403 1 1117 . 1 1 85 85 ASP CB C 13 39.788 0.03 . 1 . 414 . . 80 ASP CB . 17403 1 1118 . 1 1 85 85 ASP N N 15 114.993 0.019 . 1 . 2 . . 80 ASP N . 17403 1 1119 . 1 1 86 86 GLY H H 1 7.562 0.002 . 1 . 191 . . 81 GLY H . 17403 1 1120 . 1 1 86 86 GLY HA2 H 1 3.019 0.006 . 2 . 943 . . 81 GLY HA2 . 17403 1 1121 . 1 1 86 86 GLY HA3 H 1 4.033 0.008 . 2 . 944 . . 81 GLY HA3 . 17403 1 1122 . 1 1 86 86 GLY C C 13 174.043 . . 1 . 575 . . 81 GLY C . 17403 1 1123 . 1 1 86 86 GLY CA C 13 44.350 0.04 . 1 . 370 . . 81 GLY CA . 17403 1 1124 . 1 1 86 86 GLY N N 15 106.512 0.019 . 1 . 192 . . 81 GLY N . 17403 1 1125 . 1 1 87 87 ARG H H 1 7.493 0.004 . 1 . 130 . . 82 ARG H . 17403 1 1126 . 1 1 87 87 ARG HA H 1 3.987 0.008 . 1 . 945 . . 82 ARG HA . 17403 1 1127 . 1 1 87 87 ARG HB2 H 1 1.547 0.004 . 2 . 1201 . . 82 ARG HB2 . 17403 1 1128 . 1 1 87 87 ARG HB3 H 1 1.551 0.006 . 2 . 946 . . 82 ARG HB3 . 17403 1 1129 . 1 1 87 87 ARG HG2 H 1 1.210 0.015 . 2 . 1583 . . 82 ARG HG2 . 17403 1 1130 . 1 1 87 87 ARG HG3 H 1 1.177 0.013 . 2 . 1585 . . 82 ARG HG3 . 17403 1 1131 . 1 1 87 87 ARG HD2 H 1 3.015 0.017 . 2 . 1588 . . 82 ARG HD2 . 17403 1 1132 . 1 1 87 87 ARG HD3 H 1 3.073 0.003 . 2 . 1590 . . 82 ARG HD3 . 17403 1 1133 . 1 1 87 87 ARG HE H 1 7.281 0.005 . 1 . 1599 . . 82 ARG HE . 17403 1 1134 . 1 1 87 87 ARG C C 13 174.811 . . 1 . 625 . . 82 ARG C . 17403 1 1135 . 1 1 87 87 ARG CA C 13 54.129 0.046 . 1 . 306 . . 82 ARG CA . 17403 1 1136 . 1 1 87 87 ARG CB C 13 26.737 0.031 . 1 . 307 . . 82 ARG CB . 17403 1 1137 . 1 1 87 87 ARG CG C 13 27.257 0.029 . 1 . 1584 . . 82 ARG CG . 17403 1 1138 . 1 1 87 87 ARG CD C 13 43.412 0.039 . 1 . 1589 . . 82 ARG CD . 17403 1 1139 . 1 1 87 87 ARG N N 15 123.190 0.016 . 1 . 131 . . 82 ARG N . 17403 1 1140 . 1 1 87 87 ARG NE N 15 85.623 0.045 . 1 . 1600 . . 82 ARG NE . 17403 1 1141 . 1 1 88 88 HIS H H 1 6.248 0.002 . 1 . 11 . . 83 HIS H . 17403 1 1142 . 1 1 88 88 HIS HA H 1 4.483 0.005 . 1 . 728 . . 83 HIS HA . 17403 1 1143 . 1 1 88 88 HIS HB2 H 1 2.089 0.01 . 2 . 947 . . 83 HIS HB2 . 17403 1 1144 . 1 1 88 88 HIS HB3 H 1 3.250 0.005 . 2 . 948 . . 83 HIS HB3 . 17403 1 1145 . 1 1 88 88 HIS HD2 H 1 5.948 0.012 . 1 . 1032 . . 83 HIS HD2 . 17403 1 1146 . 1 1 88 88 HIS HE1 H 1 5.889 0.002 . 1 . 1034 . . 83 HIS HE1 . 17403 1 1147 . 1 1 88 88 HIS HE2 H 1 10.139 0.0 . 1 . 1607 . . 83 HIS HE2 . 17403 1 1148 . 1 1 88 88 HIS C C 13 174.018 . . 1 . 659 . . 83 HIS C . 17403 1 1149 . 1 1 88 88 HIS CA C 13 54.633 0.053 . 1 . 455 . . 83 HIS CA . 17403 1 1150 . 1 1 88 88 HIS CB C 13 31.742 0.029 . 1 . 456 . . 83 HIS CB . 17403 1 1151 . 1 1 88 88 HIS CD2 C 13 116.099 0.077 . 1 . 1033 . . 83 HIS CD2 . 17403 1 1152 . 1 1 88 88 HIS CE1 C 13 140.548 0.013 . 1 . 1035 . . 83 HIS CE1 . 17403 1 1153 . 1 1 88 88 HIS N N 15 117.767 0.024 . 1 . 12 . . 83 HIS N . 17403 1 1154 . 1 1 88 88 HIS ND1 N 15 248.062 . . 1 . 1640 . . 83 HIS ND1 . 17403 1 1155 . 1 1 88 88 HIS NE2 N 15 161.262 0.041 . 1 . 1641 . . 83 HIS NE2 . 17403 1 1156 . 1 1 89 89 PHE H H 1 7.767 0.007 . 1 . 243 . . 84 PHE H . 17403 1 1157 . 1 1 89 89 PHE HA H 1 5.038 0.013 . 1 . 807 . . 84 PHE HA . 17403 1 1158 . 1 1 89 89 PHE HB2 H 1 3.129 0.012 . 2 . 949 . . 84 PHE HB2 . 17403 1 1159 . 1 1 89 89 PHE HB3 H 1 3.553 0.004 . 2 . 1104 . . 84 PHE HB3 . 17403 1 1160 . 1 1 89 89 PHE HD1 H 1 7.070 0.015 . 3 . 1608 . . 84 PHE HD1 . 17403 1 1161 . 1 1 89 89 PHE HD2 H 1 7.070 0.015 . 3 . 1608 . . 84 PHE HD2 . 17403 1 1162 . 1 1 89 89 PHE HE1 H 1 7.177 0.008 . 3 . 1612 . . 84 PHE HE1 . 17403 1 1163 . 1 1 89 89 PHE HE2 H 1 7.177 0.008 . 3 . 1612 . . 84 PHE HE2 . 17403 1 1164 . 1 1 89 89 PHE HZ H 1 6.763 0.016 . 1 . 1610 . . 84 PHE HZ . 17403 1 1165 . 1 1 89 89 PHE C C 13 172.738 . . 1 . 586 . . 84 PHE C . 17403 1 1166 . 1 1 89 89 PHE CA C 13 56.475 0.044 . 1 . 417 . . 84 PHE CA . 17403 1 1167 . 1 1 89 89 PHE CB C 13 40.939 0.038 . 1 . 416 . . 84 PHE CB . 17403 1 1168 . 1 1 89 89 PHE CD1 C 13 132.976 0.02 . 3 . 1609 . . 84 PHE CD1 . 17403 1 1169 . 1 1 89 89 PHE CD2 C 13 132.976 0.02 . 3 . 1609 . . 84 PHE CD2 . 17403 1 1170 . 1 1 89 89 PHE CE1 C 13 130.872 0.017 . 3 . 1613 . . 84 PHE CE1 . 17403 1 1171 . 1 1 89 89 PHE CE2 C 13 130.872 0.017 . 3 . 1613 . . 84 PHE CE2 . 17403 1 1172 . 1 1 89 89 PHE CZ C 13 128.781 0.027 . 1 . 1611 . . 84 PHE CZ . 17403 1 1173 . 1 1 89 89 PHE N N 15 110.140 0.023 . 1 . 244 . . 84 PHE N . 17403 1 1174 . 1 1 90 90 ILE H H 1 8.171 0.006 . 1 . 193 . . 85 ILE H . 17403 1 1175 . 1 1 90 90 ILE HA H 1 4.786 0.01 . 1 . 768 . . 85 ILE HA . 17403 1 1176 . 1 1 90 90 ILE HB H 1 2.058 0.009 . 1 . 950 . . 85 ILE HB . 17403 1 1177 . 1 1 90 90 ILE HG12 H 1 1.020 0.014 . 2 . 1304 . . 85 ILE HG12 . 17403 1 1178 . 1 1 90 90 ILE HG13 H 1 1.757 0.018 . 2 . 1305 . . 85 ILE HG13 . 17403 1 1179 . 1 1 90 90 ILE HG21 H 1 0.867 0.01 . 1 . 1303 . . 85 ILE HG21 . 17403 1 1180 . 1 1 90 90 ILE HG22 H 1 0.867 0.01 . 1 . 1303 . . 85 ILE HG22 . 17403 1 1181 . 1 1 90 90 ILE HG23 H 1 0.867 0.01 . 1 . 1303 . . 85 ILE HG23 . 17403 1 1182 . 1 1 90 90 ILE HD11 H 1 0.894 0.006 . 1 . 1308 . . 85 ILE HD11 . 17403 1 1183 . 1 1 90 90 ILE HD12 H 1 0.894 0.006 . 1 . 1308 . . 85 ILE HD12 . 17403 1 1184 . 1 1 90 90 ILE HD13 H 1 0.894 0.006 . 1 . 1308 . . 85 ILE HD13 . 17403 1 1185 . 1 1 90 90 ILE C C 13 175.243 . . 1 . 639 . . 85 ILE C . 17403 1 1186 . 1 1 90 90 ILE CA C 13 60.079 0.021 . 1 . 391 . . 85 ILE CA . 17403 1 1187 . 1 1 90 90 ILE CB C 13 40.845 0.051 . 1 . 390 . . 85 ILE CB . 17403 1 1188 . 1 1 90 90 ILE CG1 C 13 29.497 0.06 . 1 . 1307 . . 85 ILE CG1 . 17403 1 1189 . 1 1 90 90 ILE CG2 C 13 18.026 0.05 . 1 . 1306 . . 85 ILE CG2 . 17403 1 1190 . 1 1 90 90 ILE CD1 C 13 14.138 0.048 . 1 . 1309 . . 85 ILE CD1 . 17403 1 1191 . 1 1 90 90 ILE N N 15 119.330 0.038 . 1 . 194 . . 85 ILE N . 17403 1 1192 . 1 1 91 91 LEU H H 1 9.289 0.008 . 1 . 154 . . 86 LEU H . 17403 1 1193 . 1 1 91 91 LEU HA H 1 4.977 0.011 . 1 . 716 . . 86 LEU HA . 17403 1 1194 . 1 1 91 91 LEU HB2 H 1 1.296 0.003 . 2 . 951 . . 86 LEU HB2 . 17403 1 1195 . 1 1 91 91 LEU HB3 H 1 1.951 0.014 . 2 . 952 . . 86 LEU HB3 . 17403 1 1196 . 1 1 91 91 LEU HG H 1 1.546 0.006 . 1 . 1546 . . 86 LEU HG . 17403 1 1197 . 1 1 91 91 LEU HD11 H 1 1.082 0.01 . 2 . 1542 . . 86 LEU HD11 . 17403 1 1198 . 1 1 91 91 LEU HD12 H 1 1.082 0.01 . 2 . 1542 . . 86 LEU HD12 . 17403 1 1199 . 1 1 91 91 LEU HD13 H 1 1.082 0.01 . 2 . 1542 . . 86 LEU HD13 . 17403 1 1200 . 1 1 91 91 LEU HD21 H 1 0.770 0.004 . 2 . 1544 . . 86 LEU HD21 . 17403 1 1201 . 1 1 91 91 LEU HD22 H 1 0.770 0.004 . 2 . 1544 . . 86 LEU HD22 . 17403 1 1202 . 1 1 91 91 LEU HD23 H 1 0.770 0.004 . 2 . 1544 . . 86 LEU HD23 . 17403 1 1203 . 1 1 91 91 LEU C C 13 174.658 . . 1 . 652 . . 86 LEU C . 17403 1 1204 . 1 1 91 91 LEU CA C 13 54.542 0.051 . 1 . 326 . . 86 LEU CA . 17403 1 1205 . 1 1 91 91 LEU CB C 13 44.352 0.046 . 1 . 327 . . 86 LEU CB . 17403 1 1206 . 1 1 91 91 LEU CG C 13 27.217 0.042 . 1 . 1547 . . 86 LEU CG . 17403 1 1207 . 1 1 91 91 LEU CD1 C 13 23.554 0.028 . 2 . 1543 . . 86 LEU CD1 . 17403 1 1208 . 1 1 91 91 LEU CD2 C 13 26.546 0.055 . 2 . 1545 . . 86 LEU CD2 . 17403 1 1209 . 1 1 91 91 LEU N N 15 130.139 0.026 . 1 . 155 . . 86 LEU N . 17403 1 1210 . 1 1 92 92 THR H H 1 9.346 0.006 . 1 . 47 . . 87 THR H . 17403 1 1211 . 1 1 92 92 THR HA H 1 4.322 0.007 . 1 . 744 . . 87 THR HA . 17403 1 1212 . 1 1 92 92 THR HB H 1 4.046 0.004 . 1 . 953 . . 87 THR HB . 17403 1 1213 . 1 1 92 92 THR HG1 H 1 7.362 . . 1 . 1676 . . 87 THR HG1 . 17403 1 1214 . 1 1 92 92 THR HG21 H 1 1.095 0.007 . 1 . 1172 . . 87 THR HG21 . 17403 1 1215 . 1 1 92 92 THR HG22 H 1 1.095 0.007 . 1 . 1172 . . 87 THR HG22 . 17403 1 1216 . 1 1 92 92 THR HG23 H 1 1.095 0.007 . 1 . 1172 . . 87 THR HG23 . 17403 1 1217 . 1 1 92 92 THR C C 13 174.397 . . 1 . 633 . . 87 THR C . 17403 1 1218 . 1 1 92 92 THR CA C 13 63.737 0.037 . 1 . 406 . . 87 THR CA . 17403 1 1219 . 1 1 92 92 THR CB C 13 68.958 0.041 . 1 . 405 . . 87 THR CB . 17403 1 1220 . 1 1 92 92 THR CG2 C 13 22.840 0.046 . 1 . 1173 . . 87 THR CG2 . 17403 1 1221 . 1 1 92 92 THR N N 15 120.790 0.041 . 1 . 48 . . 87 THR N . 17403 1 1222 . 1 1 93 93 LYS H H 1 7.888 0.005 . 1 . 179 . . 88 LYS H . 17403 1 1223 . 1 1 93 93 LYS HA H 1 4.286 0.006 . 1 . 792 . . 88 LYS HA . 17403 1 1224 . 1 1 93 93 LYS HB2 H 1 1.833 0.004 . 2 . 955 . . 88 LYS HB2 . 17403 1 1225 . 1 1 93 93 LYS HB3 H 1 1.643 0.006 . 2 . 954 . . 88 LYS HB3 . 17403 1 1226 . 1 1 93 93 LYS HG2 H 1 1.172 0.013 . 2 . 1482 . . 88 LYS HG2 . 17403 1 1227 . 1 1 93 93 LYS HG3 H 1 1.380 0.012 . 2 . 1483 . . 88 LYS HG3 . 17403 1 1228 . 1 1 93 93 LYS HD2 H 1 1.593 0.014 . 2 . 1486 . . 88 LYS HD2 . 17403 1 1229 . 1 1 93 93 LYS HD3 H 1 1.586 0.007 . 2 . 1485 . . 88 LYS HD3 . 17403 1 1230 . 1 1 93 93 LYS HE2 H 1 2.906 0.006 . 2 . 1488 . . 88 LYS HE2 . 17403 1 1231 . 1 1 93 93 LYS HE3 H 1 2.908 0.014 . 2 . 1487 . . 88 LYS HE3 . 17403 1 1232 . 1 1 93 93 LYS C C 13 173.346 . . 1 . 561 . . 88 LYS C . 17403 1 1233 . 1 1 93 93 LYS CA C 13 57.286 0.049 . 1 . 320 . . 88 LYS CA . 17403 1 1234 . 1 1 93 93 LYS CB C 13 36.568 0.05 . 1 . 321 . . 88 LYS CB . 17403 1 1235 . 1 1 93 93 LYS CG C 13 25.276 0.044 . 1 . 1484 . . 88 LYS CG . 17403 1 1236 . 1 1 93 93 LYS CD C 13 29.321 0.038 . 1 . 1489 . . 88 LYS CD . 17403 1 1237 . 1 1 93 93 LYS CE C 13 42.036 0.057 . 1 . 1490 . . 88 LYS CE . 17403 1 1238 . 1 1 93 93 LYS N N 15 120.981 0.015 . 1 . 180 . . 88 LYS N . 17403 1 1239 . 1 1 94 94 VAL H H 1 8.473 0.005 . 1 . 33 . . 89 VAL H . 17403 1 1240 . 1 1 94 94 VAL HA H 1 3.932 0.007 . 1 . 779 . . 89 VAL HA . 17403 1 1241 . 1 1 94 94 VAL HB H 1 1.717 0.003 . 1 . 956 . . 89 VAL HB . 17403 1 1242 . 1 1 94 94 VAL HG11 H 1 0.667 0.017 . 2 . 1233 . . 89 VAL HG11 . 17403 1 1243 . 1 1 94 94 VAL HG12 H 1 0.667 0.017 . 2 . 1233 . . 89 VAL HG12 . 17403 1 1244 . 1 1 94 94 VAL HG13 H 1 0.667 0.017 . 2 . 1233 . . 89 VAL HG13 . 17403 1 1245 . 1 1 94 94 VAL HG21 H 1 0.414 0.008 . 2 . 1234 . . 89 VAL HG21 . 17403 1 1246 . 1 1 94 94 VAL HG22 H 1 0.414 0.008 . 2 . 1234 . . 89 VAL HG22 . 17403 1 1247 . 1 1 94 94 VAL HG23 H 1 0.414 0.008 . 2 . 1234 . . 89 VAL HG23 . 17403 1 1248 . 1 1 94 94 VAL C C 13 175.128 . . 1 . 634 . . 89 VAL C . 17403 1 1249 . 1 1 94 94 VAL CA C 13 61.442 0.029 . 1 . 450 . . 89 VAL CA . 17403 1 1250 . 1 1 94 94 VAL CB C 13 33.552 0.042 . 1 . 449 . . 89 VAL CB . 17403 1 1251 . 1 1 94 94 VAL CG1 C 13 21.178 0.024 . 2 . 1235 . . 89 VAL CG1 . 17403 1 1252 . 1 1 94 94 VAL CG2 C 13 20.541 0.021 . 2 . 1349 . . 89 VAL CG2 . 17403 1 1253 . 1 1 94 94 VAL N N 15 125.177 0.029 . 1 . 34 . . 89 VAL N . 17403 1 1254 . 1 1 95 95 SER H H 1 8.125 0.002 . 1 . 235 . . 90 SER H . 17403 1 1255 . 1 1 95 95 SER HA H 1 4.551 0.005 . 1 . 780 . . 90 SER HA . 17403 1 1256 . 1 1 95 95 SER HB2 H 1 3.655 0.008 . 2 . 957 . . 90 SER HB2 . 17403 1 1257 . 1 1 95 95 SER HB3 H 1 3.769 0.003 . 2 . 958 . . 90 SER HB3 . 17403 1 1258 . 1 1 95 95 SER C C 13 175.182 . . 1 . 601 . . 90 SER C . 17403 1 1259 . 1 1 95 95 SER CA C 13 56.512 0.049 . 1 . 441 . . 90 SER CA . 17403 1 1260 . 1 1 95 95 SER CB C 13 63.045 0.078 . 1 . 442 . . 90 SER CB . 17403 1 1261 . 1 1 95 95 SER N N 15 122.325 0.03 . 1 . 236 . . 90 SER N . 17403 1 1262 . 1 1 96 96 LYS H H 1 8.719 0.007 . 1 . 227 . . 91 LYS H . 17403 1 1263 . 1 1 96 96 LYS HA H 1 3.923 0.011 . 1 . 959 . . 91 LYS HA . 17403 1 1264 . 1 1 96 96 LYS HB2 H 1 1.732 0.006 . 2 . 1491 . . 91 LYS HB2 . 17403 1 1265 . 1 1 96 96 LYS HB3 H 1 1.733 0.003 . 2 . 960 . . 91 LYS HB3 . 17403 1 1266 . 1 1 96 96 LYS HG2 H 1 1.363 0.01 . 2 . 1493 . . 91 LYS HG2 . 17403 1 1267 . 1 1 96 96 LYS HG3 H 1 1.347 0.011 . 2 . 1492 . . 91 LYS HG3 . 17403 1 1268 . 1 1 96 96 LYS HD2 H 1 1.600 0.016 . 2 . 1660 . . 91 LYS HD2 . 17403 1 1269 . 1 1 96 96 LYS HD3 H 1 1.598 0.016 . 2 . 1661 . . 91 LYS HD3 . 17403 1 1270 . 1 1 96 96 LYS HE2 H 1 2.949 0.002 . 2 . 1658 . . 91 LYS HE2 . 17403 1 1271 . 1 1 96 96 LYS HE3 H 1 2.951 0.0 . 2 . 1657 . . 91 LYS HE3 . 17403 1 1272 . 1 1 96 96 LYS C C 13 178.338 . . 1 . 650 . . 91 LYS C . 17403 1 1273 . 1 1 96 96 LYS CA C 13 58.875 0.052 . 1 . 686 . . 91 LYS CA . 17403 1 1274 . 1 1 96 96 LYS CB C 13 32.264 0.041 . 1 . 687 . . 91 LYS CB . 17403 1 1275 . 1 1 96 96 LYS CG C 13 24.732 0.038 . 1 . 1494 . . 91 LYS CG . 17403 1 1276 . 1 1 96 96 LYS CD C 13 29.013 0.005 . 1 . 1659 . . 91 LYS CD . 17403 1 1277 . 1 1 96 96 LYS CE C 13 41.900 0.025 . 1 . 1656 . . 91 LYS CE . 17403 1 1278 . 1 1 96 96 LYS N N 15 126.743 0.027 . 1 . 228 . . 91 LYS N . 17403 1 1279 . 1 1 97 97 GLU H H 1 8.727 0.007 . 1 . 45 . . 92 GLU H . 17403 1 1280 . 1 1 97 97 GLU HA H 1 4.065 0.002 . 1 . 751 . . 92 GLU HA . 17403 1 1281 . 1 1 97 97 GLU HB2 H 1 1.915 0.005 . 2 . 961 . . 92 GLU HB2 . 17403 1 1282 . 1 1 97 97 GLU HB3 H 1 1.976 0.004 . 2 . 962 . . 92 GLU HB3 . 17403 1 1283 . 1 1 97 97 GLU HG2 H 1 2.255 0.013 . 2 . 1258 . . 92 GLU HG2 . 17403 1 1284 . 1 1 97 97 GLU HG3 H 1 2.236 0.004 . 2 . 1259 . . 92 GLU HG3 . 17403 1 1285 . 1 1 97 97 GLU C C 13 176.553 . . 1 . 635 . . 92 GLU C . 17403 1 1286 . 1 1 97 97 GLU CA C 13 58.342 0.036 . 1 . 378 . . 92 GLU CA . 17403 1 1287 . 1 1 97 97 GLU CB C 13 28.780 0.037 . 1 . 377 . . 92 GLU CB . 17403 1 1288 . 1 1 97 97 GLU CG C 13 36.456 0.033 . 1 . 1260 . . 92 GLU CG . 17403 1 1289 . 1 1 97 97 GLU N N 15 118.261 0.026 . 1 . 46 . . 92 GLU N . 17403 1 1290 . 1 1 98 98 ALA H H 1 7.588 0.006 . 1 . 1648 . . 93 ALA H . 17403 1 1291 . 1 1 98 98 ALA HA H 1 4.205 0.005 . 1 . 814 . . 93 ALA HA . 17403 1 1292 . 1 1 98 98 ALA HB1 H 1 1.256 0.002 . 1 . 963 . . 93 ALA HB1 . 17403 1 1293 . 1 1 98 98 ALA HB2 H 1 1.256 0.002 . 1 . 963 . . 93 ALA HB2 . 17403 1 1294 . 1 1 98 98 ALA HB3 H 1 1.256 0.002 . 1 . 963 . . 93 ALA HB3 . 17403 1 1295 . 1 1 98 98 ALA C C 13 175.828 . . 1 . 592 . . 93 ALA C . 17403 1 1296 . 1 1 98 98 ALA CA C 13 51.451 0.047 . 1 . 452 . . 93 ALA CA . 17403 1 1297 . 1 1 98 98 ALA CB C 13 18.912 0.032 . 1 . 451 . . 93 ALA CB . 17403 1 1298 . 1 1 98 98 ALA N N 15 119.239 0.029 . 1 . 137 . . 93 ALA N . 17403 1 1299 . 1 1 99 99 ASN H H 1 7.761 0.002 . 1 . 237 . . 94 ASN H . 17403 1 1300 . 1 1 99 99 ASN HA H 1 4.310 0.015 . 1 . 966 . . 94 ASN HA . 17403 1 1301 . 1 1 99 99 ASN HB2 H 1 3.013 0.006 . 2 . 965 . . 94 ASN HB2 . 17403 1 1302 . 1 1 99 99 ASN HB3 H 1 2.876 0.003 . 2 . 964 . . 94 ASN HB3 . 17403 1 1303 . 1 1 99 99 ASN HD21 H 1 6.861 0.002 . 1 . 258 . . 94 ASN HD21 . 17403 1 1304 . 1 1 99 99 ASN HD22 H 1 7.484 0.002 . 1 . 92 . . 94 ASN HD22 . 17403 1 1305 . 1 1 99 99 ASN C C 13 173.502 . . 1 . 544 . . 94 ASN C . 17403 1 1306 . 1 1 99 99 ASN CA C 13 53.688 0.043 . 1 . 535 . . 94 ASN CA . 17403 1 1307 . 1 1 99 99 ASN CB C 13 37.718 0.042 . 1 . 428 . . 94 ASN CB . 17403 1 1308 . 1 1 99 99 ASN N N 15 115.596 0.038 . 1 . 238 . . 94 ASN N . 17403 1 1309 . 1 1 99 99 ASN ND2 N 15 112.209 0.025 . 1 . 93 . . 94 ASN ND2 . 17403 1 1310 . 1 1 100 100 ARG H H 1 7.155 0.003 . 1 . 210 . . 95 ARG H . 17403 1 1311 . 1 1 100 100 ARG HA H 1 4.922 0.016 . 1 . 762 . . 95 ARG HA . 17403 1 1312 . 1 1 100 100 ARG HB2 H 1 1.344 0.011 . 2 . 967 . . 95 ARG HB2 . 17403 1 1313 . 1 1 100 100 ARG HB3 H 1 1.525 0.021 . 2 . 968 . . 95 ARG HB3 . 17403 1 1314 . 1 1 100 100 ARG HG2 H 1 1.430 0.014 . 2 . 1203 . . 95 ARG HG2 . 17403 1 1315 . 1 1 100 100 ARG HG3 H 1 1.557 0.005 . 2 . 1202 . . 95 ARG HG3 . 17403 1 1316 . 1 1 100 100 ARG HD2 H 1 2.993 0.004 . 2 . 1205 . . 95 ARG HD2 . 17403 1 1317 . 1 1 100 100 ARG HD3 H 1 2.995 0.005 . 2 . 1206 . . 95 ARG HD3 . 17403 1 1318 . 1 1 100 100 ARG HE H 1 7.598 0.003 . 1 . 1594 . . 95 ARG HE . 17403 1 1319 . 1 1 100 100 ARG C C 13 174.128 . . 1 . 602 . . 95 ARG C . 17403 1 1320 . 1 1 100 100 ARG CA C 13 54.830 0.052 . 1 . 348 . . 95 ARG CA . 17403 1 1321 . 1 1 100 100 ARG CB C 13 34.787 0.049 . 1 . 538 . . 95 ARG CB . 17403 1 1322 . 1 1 100 100 ARG CG C 13 27.954 0.04 . 1 . 1204 . . 95 ARG CG . 17403 1 1323 . 1 1 100 100 ARG CD C 13 43.680 0.032 . 1 . 1207 . . 95 ARG CD . 17403 1 1324 . 1 1 100 100 ARG N N 15 114.976 0.048 . 1 . 211 . . 95 ARG N . 17403 1 1325 . 1 1 100 100 ARG NE N 15 85.515 0.063 . 1 . 1595 . . 95 ARG NE . 17403 1 1326 . 1 1 101 101 TYR H H 1 8.892 0.006 . 1 . 94 . . 96 TYR H . 17403 1 1327 . 1 1 101 101 TYR HA H 1 4.413 0.003 . 1 . 754 . . 96 TYR HA . 17403 1 1328 . 1 1 101 101 TYR HB2 H 1 2.181 0.015 . 2 . 969 . . 96 TYR HB2 . 17403 1 1329 . 1 1 101 101 TYR HB3 H 1 2.523 0.004 . 2 . 970 . . 96 TYR HB3 . 17403 1 1330 . 1 1 101 101 TYR HD1 H 1 6.292 0.003 . 3 . 1054 . . 96 TYR HD1 . 17403 1 1331 . 1 1 101 101 TYR HD2 H 1 6.292 0.003 . 3 . 1054 . . 96 TYR HD2 . 17403 1 1332 . 1 1 101 101 TYR HE1 H 1 6.163 0.002 . 3 . 1072 . . 96 TYR HE1 . 17403 1 1333 . 1 1 101 101 TYR HE2 H 1 6.163 0.002 . 3 . 1072 . . 96 TYR HE2 . 17403 1 1334 . 1 1 101 101 TYR C C 13 173.566 . . 1 . 621 . . 96 TYR C . 17403 1 1335 . 1 1 101 101 TYR CA C 13 57.403 0.051 . 1 . 385 . . 96 TYR CA . 17403 1 1336 . 1 1 101 101 TYR CB C 13 40.666 0.048 . 1 . 386 . . 96 TYR CB . 17403 1 1337 . 1 1 101 101 TYR CD1 C 13 132.090 0.032 . 3 . 1055 . . 96 TYR CD1 . 17403 1 1338 . 1 1 101 101 TYR CD2 C 13 132.090 0.032 . 3 . 1055 . . 96 TYR CD2 . 17403 1 1339 . 1 1 101 101 TYR CE1 C 13 116.991 0.022 . 3 . 1073 . . 96 TYR CE1 . 17403 1 1340 . 1 1 101 101 TYR CE2 C 13 116.991 0.022 . 3 . 1073 . . 96 TYR CE2 . 17403 1 1341 . 1 1 101 101 TYR N N 15 121.135 0.029 . 1 . 95 . . 96 TYR N . 17403 1 1342 . 1 1 102 102 LEU H H 1 9.051 0.005 . 1 . 147 . . 97 LEU H . 17403 1 1343 . 1 1 102 102 LEU HA H 1 5.009 0.002 . 1 . 742 . . 97 LEU HA . 17403 1 1344 . 1 1 102 102 LEU HB2 H 1 1.434 0.004 . 2 . 971 . . 97 LEU HB2 . 17403 1 1345 . 1 1 102 102 LEU HB3 H 1 1.890 0.004 . 2 . 972 . . 97 LEU HB3 . 17403 1 1346 . 1 1 102 102 LEU HG H 1 1.555 0.003 . 1 . 1423 . . 97 LEU HG . 17403 1 1347 . 1 1 102 102 LEU HD11 H 1 0.837 0.012 . 2 . 1426 . . 97 LEU HD11 . 17403 1 1348 . 1 1 102 102 LEU HD12 H 1 0.837 0.012 . 2 . 1426 . . 97 LEU HD12 . 17403 1 1349 . 1 1 102 102 LEU HD13 H 1 0.837 0.012 . 2 . 1426 . . 97 LEU HD13 . 17403 1 1350 . 1 1 102 102 LEU HD21 H 1 0.840 0.01 . 2 . 1425 . . 97 LEU HD21 . 17403 1 1351 . 1 1 102 102 LEU HD22 H 1 0.840 0.01 . 2 . 1425 . . 97 LEU HD22 . 17403 1 1352 . 1 1 102 102 LEU HD23 H 1 0.840 0.01 . 2 . 1425 . . 97 LEU HD23 . 17403 1 1353 . 1 1 102 102 LEU C C 13 175.806 . . 1 . 622 . . 97 LEU C . 17403 1 1354 . 1 1 102 102 LEU CA C 13 55.082 0.042 . 1 . 403 . . 97 LEU CA . 17403 1 1355 . 1 1 102 102 LEU CB C 13 42.553 0.047 . 1 . 404 . . 97 LEU CB . 17403 1 1356 . 1 1 102 102 LEU CG C 13 28.484 0.029 . 1 . 1424 . . 97 LEU CG . 17403 1 1357 . 1 1 102 102 LEU CD1 C 13 25.996 0.031 . 2 . 1428 . . 97 LEU CD1 . 17403 1 1358 . 1 1 102 102 LEU CD2 C 13 23.757 0.05 . 2 . 1427 . . 97 LEU CD2 . 17403 1 1359 . 1 1 102 102 LEU N N 15 126.938 0.034 . 1 . 148 . . 97 LEU N . 17403 1 1360 . 1 1 103 103 ILE H H 1 9.034 0.004 . 1 . 177 . . 98 ILE H . 17403 1 1361 . 1 1 103 103 ILE HA H 1 5.804 0.004 . 1 . 786 . . 98 ILE HA . 17403 1 1362 . 1 1 103 103 ILE HB H 1 2.219 0.014 . 1 . 973 . . 98 ILE HB . 17403 1 1363 . 1 1 103 103 ILE HG12 H 1 1.015 0.02 . 2 . 1312 . . 98 ILE HG12 . 17403 1 1364 . 1 1 103 103 ILE HG13 H 1 1.217 0.004 . 2 . 1311 . . 98 ILE HG13 . 17403 1 1365 . 1 1 103 103 ILE HG21 H 1 1.062 0.013 . 1 . 1310 . . 98 ILE HG21 . 17403 1 1366 . 1 1 103 103 ILE HG22 H 1 1.062 0.013 . 1 . 1310 . . 98 ILE HG22 . 17403 1 1367 . 1 1 103 103 ILE HG23 H 1 1.062 0.013 . 1 . 1310 . . 98 ILE HG23 . 17403 1 1368 . 1 1 103 103 ILE HD11 H 1 0.454 0.005 . 1 . 1315 . . 98 ILE HD11 . 17403 1 1369 . 1 1 103 103 ILE HD12 H 1 0.454 0.005 . 1 . 1315 . . 98 ILE HD12 . 17403 1 1370 . 1 1 103 103 ILE HD13 H 1 0.454 0.005 . 1 . 1315 . . 98 ILE HD13 . 17403 1 1371 . 1 1 103 103 ILE C C 13 176.382 . . 1 . 562 . . 98 ILE C . 17403 1 1372 . 1 1 103 103 ILE CA C 13 58.288 0.051 . 1 . 364 . . 98 ILE CA . 17403 1 1373 . 1 1 103 103 ILE CB C 13 42.520 0.042 . 1 . 363 . . 98 ILE CB . 17403 1 1374 . 1 1 103 103 ILE CG1 C 13 26.258 0.046 . 1 . 1314 . . 98 ILE CG1 . 17403 1 1375 . 1 1 103 103 ILE CG2 C 13 18.321 0.025 . 1 . 1313 . . 98 ILE CG2 . 17403 1 1376 . 1 1 103 103 ILE CD1 C 13 14.301 0.026 . 1 . 1316 . . 98 ILE CD1 . 17403 1 1377 . 1 1 103 103 ILE N N 15 118.361 0.022 . 1 . 178 . . 98 ILE N . 17403 1 1378 . 1 1 104 104 PHE H H 1 9.744 0.006 . 1 . 118 . . 99 PHE H . 17403 1 1379 . 1 1 104 104 PHE HA H 1 4.540 0.015 . 1 . 804 . . 99 PHE HA . 17403 1 1380 . 1 1 104 104 PHE HB2 H 1 2.845 0.003 . 2 . 541 . . 99 PHE HB2 . 17403 1 1381 . 1 1 104 104 PHE HB3 H 1 2.999 0.014 . 2 . 974 . . 99 PHE HB3 . 17403 1 1382 . 1 1 104 104 PHE HD1 H 1 6.913 0.014 . 3 . 1076 . . 99 PHE HD1 . 17403 1 1383 . 1 1 104 104 PHE HD2 H 1 6.913 0.014 . 3 . 1076 . . 99 PHE HD2 . 17403 1 1384 . 1 1 104 104 PHE HE1 H 1 7.247 0.009 . 3 . 1084 . . 99 PHE HE1 . 17403 1 1385 . 1 1 104 104 PHE HE2 H 1 7.247 0.009 . 3 . 1084 . . 99 PHE HE2 . 17403 1 1386 . 1 1 104 104 PHE HZ H 1 7.117 0.013 . 1 . 1080 . . 99 PHE HZ . 17403 1 1387 . 1 1 104 104 PHE C C 13 173.852 . . 1 . 617 . . 99 PHE C . 17403 1 1388 . 1 1 104 104 PHE CA C 13 59.707 0.049 . 1 . 313 . . 99 PHE CA . 17403 1 1389 . 1 1 104 104 PHE CB C 13 40.962 0.095 . 1 . 312 . . 99 PHE CB . 17403 1 1390 . 1 1 104 104 PHE CD1 C 13 130.858 0.034 . 3 . 1077 . . 99 PHE CD1 . 17403 1 1391 . 1 1 104 104 PHE CD2 C 13 130.858 0.034 . 3 . 1077 . . 99 PHE CD2 . 17403 1 1392 . 1 1 104 104 PHE CE1 C 13 131.210 0.06 . 3 . 1085 . . 99 PHE CE1 . 17403 1 1393 . 1 1 104 104 PHE CE2 C 13 131.210 0.06 . 3 . 1085 . . 99 PHE CE2 . 17403 1 1394 . 1 1 104 104 PHE CZ C 13 129.736 0.008 . 1 . 1081 . . 99 PHE CZ . 17403 1 1395 . 1 1 104 104 PHE N N 15 123.945 0.038 . 1 . 119 . . 99 PHE N . 17403 1 1396 . 1 1 105 105 ASP H H 1 7.637 0.004 . 1 . 21 . . 100 ASP H . 17403 1 1397 . 1 1 105 105 ASP HA H 1 4.499 0.011 . 1 . 800 . . 100 ASP HA . 17403 1 1398 . 1 1 105 105 ASP HB2 H 1 2.040 0.009 . 2 . 1176 . . 100 ASP HB2 . 17403 1 1399 . 1 1 105 105 ASP HB3 H 1 2.942 0.018 . 2 . 1177 . . 100 ASP HB3 . 17403 1 1400 . 1 1 105 105 ASP C C 13 176.165 . . 1 . 566 . . 100 ASP C . 17403 1 1401 . 1 1 105 105 ASP CA C 13 53.898 0.046 . 1 . 712 . . 100 ASP CA . 17403 1 1402 . 1 1 105 105 ASP CB C 13 42.849 0.05 . 1 . 711 . . 100 ASP CB . 17403 1 1403 . 1 1 105 105 ASP N N 15 128.631 0.033 . 1 . 22 . . 100 ASP N . 17403 1 1404 . 1 1 106 106 LEU H H 1 8.751 0.014 . 1 . 294 . . 101 LEU H . 17403 1 1405 . 1 1 106 106 LEU HA H 1 4.199 0.01 . 1 . 975 . . 101 LEU HA . 17403 1 1406 . 1 1 106 106 LEU HB2 H 1 1.913 0.008 . 2 . 1410 . . 101 LEU HB2 . 17403 1 1407 . 1 1 106 106 LEU HB3 H 1 1.823 0.016 . 2 . 1409 . . 101 LEU HB3 . 17403 1 1408 . 1 1 106 106 LEU HG H 1 2.034 0.017 . 1 . 1548 . . 101 LEU HG . 17403 1 1409 . 1 1 106 106 LEU HD11 H 1 1.086 0.003 . 2 . 1552 . . 101 LEU HD11 . 17403 1 1410 . 1 1 106 106 LEU HD12 H 1 1.086 0.003 . 2 . 1552 . . 101 LEU HD12 . 17403 1 1411 . 1 1 106 106 LEU HD13 H 1 1.086 0.003 . 2 . 1552 . . 101 LEU HD13 . 17403 1 1412 . 1 1 106 106 LEU HD21 H 1 0.901 0.008 . 2 . 1550 . . 101 LEU HD21 . 17403 1 1413 . 1 1 106 106 LEU HD22 H 1 0.901 0.008 . 2 . 1550 . . 101 LEU HD22 . 17403 1 1414 . 1 1 106 106 LEU HD23 H 1 0.901 0.008 . 2 . 1550 . . 101 LEU HD23 . 17403 1 1415 . 1 1 106 106 LEU C C 13 176.185 0.002 . 1 . 1558 . . 101 LEU C . 17403 1 1416 . 1 1 106 106 LEU CA C 13 56.793 0.042 . 1 . 302 . . 101 LEU CA . 17403 1 1417 . 1 1 106 106 LEU CB C 13 41.714 0.019 . 1 . 303 . . 101 LEU CB . 17403 1 1418 . 1 1 106 106 LEU CG C 13 27.917 0.035 . 1 . 1551 . . 101 LEU CG . 17403 1 1419 . 1 1 106 106 LEU CD1 C 13 27.129 0.041 . 2 . 1553 . . 101 LEU CD1 . 17403 1 1420 . 1 1 106 106 LEU CD2 C 13 23.708 0.05 . 2 . 1549 . . 101 LEU CD2 . 17403 1 1421 . 1 1 106 106 LEU N N 15 126.791 0.024 . 1 . 295 . . 101 LEU N . 17403 1 1422 . 1 1 107 107 GLU H H 1 8.148 0.008 . 1 . 7 . . 102 GLU H . 17403 1 1423 . 1 1 107 107 GLU HA H 1 4.063 0.01 . 1 . 978 . . 102 GLU HA . 17403 1 1424 . 1 1 107 107 GLU HB2 H 1 2.073 0.01 . 2 . 977 . . 102 GLU HB2 . 17403 1 1425 . 1 1 107 107 GLU HB3 H 1 1.918 0.006 . 2 . 976 . . 102 GLU HB3 . 17403 1 1426 . 1 1 107 107 GLU HG2 H 1 1.921 0.006 . 2 . 1256 . . 102 GLU HG2 . 17403 1 1427 . 1 1 107 107 GLU HG3 H 1 2.114 0.011 . 2 . 1257 . . 102 GLU HG3 . 17403 1 1428 . 1 1 107 107 GLU C C 13 178.661 0.004 . 1 . 646 . . 102 GLU C . 17403 1 1429 . 1 1 107 107 GLU CA C 13 58.373 0.058 . 1 . 301 . . 102 GLU CA . 17403 1 1430 . 1 1 107 107 GLU CB C 13 30.067 0.037 . 1 . 300 . . 102 GLU CB . 17403 1 1431 . 1 1 107 107 GLU CG C 13 36.180 0.033 . 1 . 1255 . . 102 GLU CG . 17403 1 1432 . 1 1 107 107 GLU N N 15 119.101 0.026 . 1 . 8 . . 102 GLU N . 17403 1 1433 . 1 1 108 108 GLN H H 1 8.371 0.005 . 1 . 5 . . 103 GLN H . 17403 1 1434 . 1 1 108 108 GLN HA H 1 4.026 0.005 . 1 . 776 . . 103 GLN HA . 17403 1 1435 . 1 1 108 108 GLN HB2 H 1 1.432 0.004 . 2 . 979 . . 103 GLN HB2 . 17403 1 1436 . 1 1 108 108 GLN HB3 H 1 2.167 0.01 . 2 . 980 . . 103 GLN HB3 . 17403 1 1437 . 1 1 108 108 GLN HG2 H 1 2.350 0.004 . 2 . 1152 . . 103 GLN HG2 . 17403 1 1438 . 1 1 108 108 GLN HG3 H 1 2.243 0.003 . 2 . 1153 . . 103 GLN HG3 . 17403 1 1439 . 1 1 108 108 GLN HE21 H 1 7.404 0.002 . 1 . 226 . . 103 GLN HE21 . 17403 1 1440 . 1 1 108 108 GLN HE22 H 1 6.627 0.002 . 1 . 208 . . 103 GLN HE22 . 17403 1 1441 . 1 1 108 108 GLN C C 13 175.655 . . 1 . 582 . . 103 GLN C . 17403 1 1442 . 1 1 108 108 GLN CA C 13 55.969 0.044 . 1 . 360 . . 103 GLN CA . 17403 1 1443 . 1 1 108 108 GLN CB C 13 29.089 0.036 . 1 . 359 . . 103 GLN CB . 17403 1 1444 . 1 1 108 108 GLN CG C 13 33.864 0.028 . 1 . 1154 . . 103 GLN CG . 17403 1 1445 . 1 1 108 108 GLN N N 15 116.441 0.024 . 1 . 6 . . 103 GLN N . 17403 1 1446 . 1 1 108 108 GLN NE2 N 15 111.089 0.026 . 1 . 209 . . 103 GLN NE2 . 17403 1 1447 . 1 1 109 109 ARG H H 1 7.979 0.005 . 1 . 112 . . 104 ARG H . 17403 1 1448 . 1 1 109 109 ARG HA H 1 3.766 0.007 . 1 . 787 . . 104 ARG HA . 17403 1 1449 . 1 1 109 109 ARG HB2 H 1 2.056 0.01 . 2 . 981 . . 104 ARG HB2 . 17403 1 1450 . 1 1 109 109 ARG HB3 H 1 2.187 0.013 . 2 . 982 . . 104 ARG HB3 . 17403 1 1451 . 1 1 109 109 ARG HG2 H 1 1.707 0.009 . 2 . 1209 . . 104 ARG HG2 . 17403 1 1452 . 1 1 109 109 ARG HG3 H 1 1.441 0.01 . 2 . 1208 . . 104 ARG HG3 . 17403 1 1453 . 1 1 109 109 ARG HD2 H 1 3.145 0.013 . 2 . 1211 . . 104 ARG HD2 . 17403 1 1454 . 1 1 109 109 ARG HD3 H 1 3.191 0.013 . 2 . 1212 . . 104 ARG HD3 . 17403 1 1455 . 1 1 109 109 ARG HE H 1 7.157 0.001 . 1 . 1601 . . 104 ARG HE . 17403 1 1456 . 1 1 109 109 ARG C C 13 174.842 . . 1 . 543 . . 104 ARG C . 17403 1 1457 . 1 1 109 109 ARG CA C 13 57.182 0.051 . 1 . 394 . . 104 ARG CA . 17403 1 1458 . 1 1 109 109 ARG CB C 13 27.031 0.037 . 1 . 395 . . 104 ARG CB . 17403 1 1459 . 1 1 109 109 ARG CG C 13 27.945 0.041 . 1 . 1210 . . 104 ARG CG . 17403 1 1460 . 1 1 109 109 ARG CD C 13 44.069 0.035 . 1 . 1213 . . 104 ARG CD . 17403 1 1461 . 1 1 109 109 ARG N N 15 115.526 0.028 . 1 . 113 . . 104 ARG N . 17403 1 1462 . 1 1 109 109 ARG NE N 15 85.368 0.057 . 1 . 1602 . . 104 ARG NE . 17403 1 1463 . 1 1 110 110 ASN H H 1 7.110 0.007 . 1 . 158 . . 105 ASN H . 17403 1 1464 . 1 1 110 110 ASN HA H 1 5.024 0.003 . 1 . 761 . . 105 ASN HA . 17403 1 1465 . 1 1 110 110 ASN HB2 H 1 2.669 0.004 . 2 . 1134 . . 105 ASN HB2 . 17403 1 1466 . 1 1 110 110 ASN HB3 H 1 2.398 0.005 . 2 . 1133 . . 105 ASN HB3 . 17403 1 1467 . 1 1 110 110 ASN HD21 H 1 7.113 0.006 . 1 . 81 . . 105 ASN HD21 . 17403 1 1468 . 1 1 110 110 ASN HD22 H 1 6.875 0.018 . 1 . 35 . . 105 ASN HD22 . 17403 1 1469 . 1 1 110 110 ASN CA C 13 51.078 0.044 . 1 . 698 . . 105 ASN CA . 17403 1 1470 . 1 1 110 110 ASN CB C 13 42.866 0.025 . 1 . 697 . . 105 ASN CB . 17403 1 1471 . 1 1 110 110 ASN N N 15 114.676 0.031 . 1 . 159 . . 105 ASN N . 17403 1 1472 . 1 1 110 110 ASN ND2 N 15 111.987 0.039 . 1 . 36 . . 105 ASN ND2 . 17403 1 1473 . 1 1 111 111 PRO HA H 1 5.414 0.003 . 1 . 983 . . 106 PRO HA . 17403 1 1474 . 1 1 111 111 PRO HB2 H 1 2.410 0.004 . 2 . 985 . . 106 PRO HB2 . 17403 1 1475 . 1 1 111 111 PRO HB3 H 1 1.970 0.007 . 2 . 984 . . 106 PRO HB3 . 17403 1 1476 . 1 1 111 111 PRO HG2 H 1 2.144 0.012 . 2 . 1121 . . 106 PRO HG2 . 17403 1 1477 . 1 1 111 111 PRO HG3 H 1 2.173 0.013 . 2 . 1122 . . 106 PRO HG3 . 17403 1 1478 . 1 1 111 111 PRO HD2 H 1 3.914 0.004 . 2 . 1125 . . 106 PRO HD2 . 17403 1 1479 . 1 1 111 111 PRO HD3 H 1 3.818 0.008 . 2 . 1124 . . 106 PRO HD3 . 17403 1 1480 . 1 1 111 111 PRO C C 13 176.290 . . 1 . 609 . . 106 PRO C . 17403 1 1481 . 1 1 111 111 PRO CA C 13 61.965 0.049 . 1 . 425 . . 106 PRO CA . 17403 1 1482 . 1 1 111 111 PRO CB C 13 32.713 0.049 . 1 . 424 . . 106 PRO CB . 17403 1 1483 . 1 1 111 111 PRO CG C 13 27.554 0.028 . 1 . 1123 . . 106 PRO CG . 17403 1 1484 . 1 1 111 111 PRO CD C 13 51.309 0.053 . 1 . 1126 . . 106 PRO CD . 17403 1 1485 . 1 1 112 112 ARG H H 1 8.664 0.005 . 1 . 201 . . 107 ARG H . 17403 1 1486 . 1 1 112 112 ARG HA H 1 4.549 0.003 . 1 . 729 . . 107 ARG HA . 17403 1 1487 . 1 1 112 112 ARG HB2 H 1 1.722 0.002 . 2 . 987 . . 107 ARG HB2 . 17403 1 1488 . 1 1 112 112 ARG HB3 H 1 1.471 0.02 . 2 . 986 . . 107 ARG HB3 . 17403 1 1489 . 1 1 112 112 ARG HG2 H 1 1.453 0.011 . 2 . 1215 . . 107 ARG HG2 . 17403 1 1490 . 1 1 112 112 ARG HG3 H 1 1.416 0.012 . 2 . 1216 . . 107 ARG HG3 . 17403 1 1491 . 1 1 112 112 ARG HD2 H 1 3.167 0.004 . 2 . 1217 . . 107 ARG HD2 . 17403 1 1492 . 1 1 112 112 ARG HD3 H 1 2.977 0.008 . 2 . 1218 . . 107 ARG HD3 . 17403 1 1493 . 1 1 112 112 ARG HE H 1 7.732 0.006 . 1 . 1593 . . 107 ARG HE . 17403 1 1494 . 1 1 112 112 ARG C C 13 173.364 . . 1 . 569 . . 107 ARG C . 17403 1 1495 . 1 1 112 112 ARG CA C 13 55.917 0.048 . 1 . 499 . . 107 ARG CA . 17403 1 1496 . 1 1 112 112 ARG CB C 13 34.971 0.044 . 1 . 500 . . 107 ARG CB . 17403 1 1497 . 1 1 112 112 ARG CG C 13 27.256 0.04 . 1 . 1214 . . 107 ARG CG . 17403 1 1498 . 1 1 112 112 ARG CD C 13 44.353 0.045 . 1 . 1219 . . 107 ARG CD . 17403 1 1499 . 1 1 112 112 ARG N N 15 119.268 0.025 . 1 . 202 . . 107 ARG N . 17403 1 1500 . 1 1 112 112 ARG NE N 15 84.274 0.047 . 1 . 1596 . . 107 ARG NE . 17403 1 1501 . 1 1 113 113 VAL H H 1 8.532 0.005 . 1 . 288 . . 108 VAL H . 17403 1 1502 . 1 1 113 113 VAL HA H 1 4.590 0.003 . 1 . 772 . . 108 VAL HA . 17403 1 1503 . 1 1 113 113 VAL HB H 1 1.950 0.003 . 1 . 988 . . 108 VAL HB . 17403 1 1504 . 1 1 113 113 VAL HG11 H 1 0.915 0.003 . 2 . 1237 . . 108 VAL HG11 . 17403 1 1505 . 1 1 113 113 VAL HG12 H 1 0.915 0.003 . 2 . 1237 . . 108 VAL HG12 . 17403 1 1506 . 1 1 113 113 VAL HG13 H 1 0.915 0.003 . 2 . 1237 . . 108 VAL HG13 . 17403 1 1507 . 1 1 113 113 VAL HG21 H 1 0.809 0.011 . 2 . 1236 . . 108 VAL HG21 . 17403 1 1508 . 1 1 113 113 VAL HG22 H 1 0.809 0.011 . 2 . 1236 . . 108 VAL HG22 . 17403 1 1509 . 1 1 113 113 VAL HG23 H 1 0.809 0.011 . 2 . 1236 . . 108 VAL HG23 . 17403 1 1510 . 1 1 113 113 VAL C C 13 175.466 . . 1 . 564 . . 108 VAL C . 17403 1 1511 . 1 1 113 113 VAL CA C 13 61.730 0.049 . 1 . 421 . . 108 VAL CA . 17403 1 1512 . 1 1 113 113 VAL CB C 13 32.746 0.042 . 1 . 420 . . 108 VAL CB . 17403 1 1513 . 1 1 113 113 VAL CG1 C 13 21.816 0.036 . 2 . 1654 . . 108 VAL CG1 . 17403 1 1514 . 1 1 113 113 VAL CG2 C 13 21.624 0.033 . 2 . 1238 . . 108 VAL CG2 . 17403 1 1515 . 1 1 113 113 VAL N N 15 122.967 0.024 . 1 . 289 . . 108 VAL N . 17403 1 1516 . 1 1 114 114 LEU H H 1 9.453 0.005 . 1 . 197 . . 109 LEU H . 17403 1 1517 . 1 1 114 114 LEU HA H 1 4.875 0.004 . 1 . 760 . . 109 LEU HA . 17403 1 1518 . 1 1 114 114 LEU HB2 H 1 1.730 0.004 . 2 . 989 . . 109 LEU HB2 . 17403 1 1519 . 1 1 114 114 LEU HB3 H 1 1.903 0.006 . 2 . 990 . . 109 LEU HB3 . 17403 1 1520 . 1 1 114 114 LEU HG H 1 1.620 0.003 . 1 . 1403 . . 109 LEU HG . 17403 1 1521 . 1 1 114 114 LEU HD11 H 1 0.647 0.014 . 2 . 1406 . . 109 LEU HD11 . 17403 1 1522 . 1 1 114 114 LEU HD12 H 1 0.647 0.014 . 2 . 1406 . . 109 LEU HD12 . 17403 1 1523 . 1 1 114 114 LEU HD13 H 1 0.647 0.014 . 2 . 1406 . . 109 LEU HD13 . 17403 1 1524 . 1 1 114 114 LEU HD21 H 1 0.631 0.015 . 2 . 1405 . . 109 LEU HD21 . 17403 1 1525 . 1 1 114 114 LEU HD22 H 1 0.631 0.015 . 2 . 1405 . . 109 LEU HD22 . 17403 1 1526 . 1 1 114 114 LEU HD23 H 1 0.631 0.015 . 2 . 1405 . . 109 LEU HD23 . 17403 1 1527 . 1 1 114 114 LEU C C 13 177.339 . . 1 . 594 . . 109 LEU C . 17403 1 1528 . 1 1 114 114 LEU CA C 13 53.461 0.044 . 1 . 389 . . 109 LEU CA . 17403 1 1529 . 1 1 114 114 LEU CB C 13 44.714 0.04 . 1 . 388 . . 109 LEU CB . 17403 1 1530 . 1 1 114 114 LEU CG C 13 27.561 0.036 . 1 . 1404 . . 109 LEU CG . 17403 1 1531 . 1 1 114 114 LEU CD1 C 13 26.884 0.027 . 2 . 1407 . . 109 LEU CD1 . 17403 1 1532 . 1 1 114 114 LEU CD2 C 13 23.451 0.026 . 2 . 1408 . . 109 LEU CD2 . 17403 1 1533 . 1 1 114 114 LEU N N 15 128.287 0.022 . 1 . 198 . . 109 LEU N . 17403 1 1534 . 1 1 115 115 GLU H H 1 9.033 0.008 . 1 . 152 . . 110 GLU H . 17403 1 1535 . 1 1 115 115 GLU HA H 1 4.749 0.003 . 1 . 991 . . 110 GLU HA . 17403 1 1536 . 1 1 115 115 GLU HB2 H 1 2.513 0.004 . 2 . 993 . . 110 GLU HB2 . 17403 1 1537 . 1 1 115 115 GLU HB3 H 1 1.964 0.014 . 2 . 992 . . 110 GLU HB3 . 17403 1 1538 . 1 1 115 115 GLU HG2 H 1 2.428 0.008 . 2 . 1252 . . 110 GLU HG2 . 17403 1 1539 . 1 1 115 115 GLU HG3 H 1 2.514 0.003 . 2 . 1254 . . 110 GLU HG3 . 17403 1 1540 . 1 1 115 115 GLU C C 13 177.910 . . 1 . 603 . . 110 GLU C . 17403 1 1541 . 1 1 115 115 GLU CA C 13 55.343 0.042 . 1 . 328 . . 110 GLU CA . 17403 1 1542 . 1 1 115 115 GLU CB C 13 30.522 0.037 . 1 . 329 . . 110 GLU CB . 17403 1 1543 . 1 1 115 115 GLU CG C 13 36.180 0.026 . 1 . 1253 . . 110 GLU CG . 17403 1 1544 . 1 1 115 115 GLU N N 15 120.302 0.027 . 1 . 153 . . 110 GLU N . 17403 1 1545 . 1 1 116 116 GLN H H 1 8.986 0.012 . 1 . 49 . . 111 GLN H . 17403 1 1546 . 1 1 116 116 GLN HA H 1 3.970 0.009 . 1 . 994 . . 111 GLN HA . 17403 1 1547 . 1 1 116 116 GLN HB2 H 1 2.242 0.012 . 2 . 995 . . 111 GLN HB2 . 17403 1 1548 . 1 1 116 116 GLN HB3 H 1 2.600 0.002 . 2 . 996 . . 111 GLN HB3 . 17403 1 1549 . 1 1 116 116 GLN HG2 H 1 2.430 0.015 . 2 . 1156 . . 111 GLN HG2 . 17403 1 1550 . 1 1 116 116 GLN HG3 H 1 2.455 0.016 . 2 . 1155 . . 111 GLN HG3 . 17403 1 1551 . 1 1 116 116 GLN HE21 H 1 6.720 0.004 . 1 . 79 . . 111 GLN HE21 . 17403 1 1552 . 1 1 116 116 GLN HE22 H 1 7.857 0.006 . 1 . 151 . . 111 GLN HE22 . 17403 1 1553 . 1 1 116 116 GLN C C 13 177.886 . . 1 . 642 . . 111 GLN C . 17403 1 1554 . 1 1 116 116 GLN CA C 13 61.144 0.049 . 1 . 454 . . 111 GLN CA . 17403 1 1555 . 1 1 116 116 GLN CB C 13 28.394 0.037 . 1 . 453 . . 111 GLN CB . 17403 1 1556 . 1 1 116 116 GLN CG C 13 33.053 0.027 . 1 . 1157 . . 111 GLN CG . 17403 1 1557 . 1 1 116 116 GLN N N 15 123.157 0.038 . 1 . 50 . . 111 GLN N . 17403 1 1558 . 1 1 116 116 GLN NE2 N 15 111.619 0.019 . 1 . 80 . . 111 GLN NE2 . 17403 1 1559 . 1 1 117 117 SER H H 1 8.960 0.014 . 1 . 239 . . 112 SER H . 17403 1 1560 . 1 1 117 117 SER HA H 1 4.254 0.007 . 1 . 788 . . 112 SER HA . 17403 1 1561 . 1 1 117 117 SER HB2 H 1 3.956 0.004 . 2 . 997 . . 112 SER HB2 . 17403 1 1562 . 1 1 117 117 SER HB3 H 1 3.921 0.018 . 2 . 1444 . . 112 SER HB3 . 17403 1 1563 . 1 1 117 117 SER C C 13 177.159 . . 1 . 624 . . 112 SER C . 17403 1 1564 . 1 1 117 117 SER CA C 13 61.387 0.063 . 1 . 688 . . 112 SER CA . 17403 1 1565 . 1 1 117 117 SER CB C 13 61.908 0.051 . 1 . 1445 . . 112 SER CB . 17403 1 1566 . 1 1 117 117 SER N N 15 112.281 0.027 . 1 . 240 . . 112 SER N . 17403 1 1567 . 1 1 118 118 GLU H H 1 7.068 0.003 . 1 . 19 . . 113 GLU H . 17403 1 1568 . 1 1 118 118 GLU HA H 1 4.149 0.002 . 1 . 998 . . 113 GLU HA . 17403 1 1569 . 1 1 118 118 GLU HB2 H 1 2.001 0.003 . 2 . 999 . . 113 GLU HB2 . 17403 1 1570 . 1 1 118 118 GLU HB3 H 1 2.347 0.002 . 2 . 1000 . . 113 GLU HB3 . 17403 1 1571 . 1 1 118 118 GLU HG2 H 1 2.345 0.003 . 2 . 1247 . . 113 GLU HG2 . 17403 1 1572 . 1 1 118 118 GLU HG3 H 1 2.212 0.006 . 2 . 1245 . . 113 GLU HG3 . 17403 1 1573 . 1 1 118 118 GLU C C 13 178.487 . . 1 . 664 . . 113 GLU C . 17403 1 1574 . 1 1 118 118 GLU CA C 13 58.314 0.049 . 1 . 299 . . 113 GLU CA . 17403 1 1575 . 1 1 118 118 GLU CB C 13 30.821 0.028 . 1 . 298 . . 113 GLU CB . 17403 1 1576 . 1 1 118 118 GLU CG C 13 36.963 0.028 . 1 . 1246 . . 113 GLU CG . 17403 1 1577 . 1 1 118 118 GLU N N 15 122.350 0.024 . 1 . 20 . . 113 GLU N . 17403 1 1578 . 1 1 119 119 PHE H H 1 8.298 0.003 . 1 . 3 . . 114 PHE H . 17403 1 1579 . 1 1 119 119 PHE HA H 1 3.809 0.003 . 1 . 1001 . . 114 PHE HA . 17403 1 1580 . 1 1 119 119 PHE HB2 H 1 2.524 0.005 . 2 . 1136 . . 114 PHE HB2 . 17403 1 1581 . 1 1 119 119 PHE HB3 H 1 2.521 0.008 . 2 . 1002 . . 114 PHE HB3 . 17403 1 1582 . 1 1 119 119 PHE HD1 H 1 6.489 0.008 . 3 . 1074 . . 114 PHE HD1 . 17403 1 1583 . 1 1 119 119 PHE HD2 H 1 6.489 0.008 . 3 . 1074 . . 114 PHE HD2 . 17403 1 1584 . 1 1 119 119 PHE HE1 H 1 6.715 0.016 . 3 . 1086 . . 114 PHE HE1 . 17403 1 1585 . 1 1 119 119 PHE HE2 H 1 6.715 0.016 . 3 . 1086 . . 114 PHE HE2 . 17403 1 1586 . 1 1 119 119 PHE HZ H 1 6.465 0.013 . 1 . 1088 . . 114 PHE HZ . 17403 1 1587 . 1 1 119 119 PHE C C 13 177.156 . . 1 . 558 . . 114 PHE C . 17403 1 1588 . 1 1 119 119 PHE CA C 13 62.233 0.049 . 1 . 483 . . 114 PHE CA . 17403 1 1589 . 1 1 119 119 PHE CB C 13 39.574 0.041 . 1 . 482 . . 114 PHE CB . 17403 1 1590 . 1 1 119 119 PHE CD1 C 13 130.737 0.033 . 3 . 1075 . . 114 PHE CD1 . 17403 1 1591 . 1 1 119 119 PHE CD2 C 13 130.737 0.033 . 3 . 1075 . . 114 PHE CD2 . 17403 1 1592 . 1 1 119 119 PHE CE1 C 13 130.059 0.012 . 3 . 1087 . . 114 PHE CE1 . 17403 1 1593 . 1 1 119 119 PHE CE2 C 13 130.059 0.012 . 3 . 1087 . . 114 PHE CE2 . 17403 1 1594 . 1 1 119 119 PHE CZ C 13 128.188 0.007 . 1 . 1089 . . 114 PHE CZ . 17403 1 1595 . 1 1 119 119 PHE N N 15 119.673 0.031 . 1 . 4 . . 114 PHE N . 17403 1 1596 . 1 1 120 120 GLU H H 1 8.903 0.005 . 1 . 272 . . 115 GLU H . 17403 1 1597 . 1 1 120 120 GLU HA H 1 3.735 0.002 . 1 . 785 . . 115 GLU HA . 17403 1 1598 . 1 1 120 120 GLU HB2 H 1 2.061 0.007 . 2 . 1003 . . 115 GLU HB2 . 17403 1 1599 . 1 1 120 120 GLU HB3 H 1 2.133 0.012 . 2 . 1248 . . 115 GLU HB3 . 17403 1 1600 . 1 1 120 120 GLU HG2 H 1 2.277 0.013 . 2 . 1251 . . 115 GLU HG2 . 17403 1 1601 . 1 1 120 120 GLU HG3 H 1 2.522 0.003 . 2 . 1249 . . 115 GLU HG3 . 17403 1 1602 . 1 1 120 120 GLU C C 13 177.602 . . 1 . 576 . . 115 GLU C . 17403 1 1603 . 1 1 120 120 GLU CA C 13 59.780 0.058 . 1 . 381 . . 115 GLU CA . 17403 1 1604 . 1 1 120 120 GLU CB C 13 29.656 0.045 . 1 . 380 . . 115 GLU CB . 17403 1 1605 . 1 1 120 120 GLU CG C 13 37.471 0.031 . 1 . 1250 . . 115 GLU CG . 17403 1 1606 . 1 1 120 120 GLU N N 15 117.644 0.024 . 1 . 273 . . 115 GLU N . 17403 1 1607 . 1 1 121 121 ALA H H 1 7.060 0.004 . 1 . 142 . . 116 ALA H . 17403 1 1608 . 1 1 121 121 ALA HA H 1 4.215 0.019 . 1 . 746 . . 116 ALA HA . 17403 1 1609 . 1 1 121 121 ALA HB1 H 1 1.479 0.002 . 1 . 1004 . . 116 ALA HB1 . 17403 1 1610 . 1 1 121 121 ALA HB2 H 1 1.479 0.002 . 1 . 1004 . . 116 ALA HB2 . 17403 1 1611 . 1 1 121 121 ALA HB3 H 1 1.479 0.002 . 1 . 1004 . . 116 ALA HB3 . 17403 1 1612 . 1 1 121 121 ALA C C 13 178.838 . . 1 . 619 . . 116 ALA C . 17403 1 1613 . 1 1 121 121 ALA CA C 13 53.814 0.054 . 1 . 347 . . 116 ALA CA . 17403 1 1614 . 1 1 121 121 ALA CB C 13 18.508 0.04 . 1 . 382 . . 116 ALA CB . 17403 1 1615 . 1 1 121 121 ALA N N 15 117.194 0.031 . 1 . 143 . . 116 ALA N . 17403 1 1616 . 1 1 122 122 LEU H H 1 7.198 0.002 . 1 . 90 . . 117 LEU H . 17403 1 1617 . 1 1 122 122 LEU HA H 1 4.290 0.008 . 1 . 736 . . 117 LEU HA . 17403 1 1618 . 1 1 122 122 LEU HB2 H 1 1.533 0.014 . 2 . 1396 . . 117 LEU HB2 . 17403 1 1619 . 1 1 122 122 LEU HB3 H 1 1.481 0.004 . 2 . 1005 . . 117 LEU HB3 . 17403 1 1620 . 1 1 122 122 LEU HG H 1 1.628 0.002 . 1 . 1397 . . 117 LEU HG . 17403 1 1621 . 1 1 122 122 LEU HD11 H 1 0.654 0.007 . 2 . 1399 . . 117 LEU HD11 . 17403 1 1622 . 1 1 122 122 LEU HD12 H 1 0.654 0.007 . 2 . 1399 . . 117 LEU HD12 . 17403 1 1623 . 1 1 122 122 LEU HD13 H 1 0.654 0.007 . 2 . 1399 . . 117 LEU HD13 . 17403 1 1624 . 1 1 122 122 LEU HD21 H 1 0.433 0.011 . 2 . 1398 . . 117 LEU HD21 . 17403 1 1625 . 1 1 122 122 LEU HD22 H 1 0.433 0.011 . 2 . 1398 . . 117 LEU HD22 . 17403 1 1626 . 1 1 122 122 LEU HD23 H 1 0.433 0.011 . 2 . 1398 . . 117 LEU HD23 . 17403 1 1627 . 1 1 122 122 LEU C C 13 177.329 . . 1 . 574 . . 117 LEU C . 17403 1 1628 . 1 1 122 122 LEU CA C 13 54.735 0.043 . 1 . 498 . . 117 LEU CA . 17403 1 1629 . 1 1 122 122 LEU CB C 13 45.136 0.039 . 1 . 509 . . 117 LEU CB . 17403 1 1630 . 1 1 122 122 LEU CG C 13 26.565 0.037 . 1 . 1400 . . 117 LEU CG . 17403 1 1631 . 1 1 122 122 LEU CD1 C 13 22.284 0.027 . 2 . 1402 . . 117 LEU CD1 . 17403 1 1632 . 1 1 122 122 LEU CD2 C 13 24.928 0.025 . 2 . 1401 . . 117 LEU CD2 . 17403 1 1633 . 1 1 122 122 LEU N N 15 117.225 0.017 . 1 . 91 . . 117 LEU N . 17403 1 1634 . 1 1 123 123 TYR H H 1 7.959 0.003 . 1 . 286 . . 118 TYR H . 17403 1 1635 . 1 1 123 123 TYR HA H 1 3.951 0.006 . 1 . 747 . . 118 TYR HA . 17403 1 1636 . 1 1 123 123 TYR HB2 H 1 2.030 0.006 . 2 . 1006 . . 118 TYR HB2 . 17403 1 1637 . 1 1 123 123 TYR HB3 H 1 2.497 0.007 . 2 . 1007 . . 118 TYR HB3 . 17403 1 1638 . 1 1 123 123 TYR HD1 H 1 7.045 0.013 . 3 . 1060 . . 118 TYR HD1 . 17403 1 1639 . 1 1 123 123 TYR HD2 H 1 7.045 0.013 . 3 . 1060 . . 118 TYR HD2 . 17403 1 1640 . 1 1 123 123 TYR HE1 H 1 6.858 0.003 . 3 . 1066 . . 118 TYR HE1 . 17403 1 1641 . 1 1 123 123 TYR HE2 H 1 6.858 0.003 . 3 . 1066 . . 118 TYR HE2 . 17403 1 1642 . 1 1 123 123 TYR HH H 1 8.996 0.008 . 1 . 1675 . . 118 TYR HH . 17403 1 1643 . 1 1 123 123 TYR C C 13 175.620 . . 1 . 613 . . 118 TYR C . 17403 1 1644 . 1 1 123 123 TYR CA C 13 59.534 0.046 . 1 . 427 . . 118 TYR CA . 17403 1 1645 . 1 1 123 123 TYR CB C 13 39.133 0.035 . 1 . 426 . . 118 TYR CB . 17403 1 1646 . 1 1 123 123 TYR CD1 C 13 132.991 0.018 . 3 . 1061 . . 118 TYR CD1 . 17403 1 1647 . 1 1 123 123 TYR CD2 C 13 132.991 0.018 . 3 . 1061 . . 118 TYR CD2 . 17403 1 1648 . 1 1 123 123 TYR CE1 C 13 118.016 0.011 . 3 . 1067 . . 118 TYR CE1 . 17403 1 1649 . 1 1 123 123 TYR CE2 C 13 118.016 0.011 . 3 . 1067 . . 118 TYR CE2 . 17403 1 1650 . 1 1 123 123 TYR N N 15 120.436 0.018 . 1 . 287 . . 118 TYR N . 17403 1 1651 . 1 1 124 124 GLN H H 1 7.277 0.006 . 1 . 203 . . 119 GLN H . 17403 1 1652 . 1 1 124 124 GLN HA H 1 4.609 0.005 . 1 . 766 . . 119 GLN HA . 17403 1 1653 . 1 1 124 124 GLN HB2 H 1 2.410 0.007 . 2 . 1158 . . 119 GLN HB2 . 17403 1 1654 . 1 1 124 124 GLN HB3 H 1 1.810 0.01 . 2 . 1159 . . 119 GLN HB3 . 17403 1 1655 . 1 1 124 124 GLN HG2 H 1 2.221 0.006 . 2 . 1161 . . 119 GLN HG2 . 17403 1 1656 . 1 1 124 124 GLN HG3 H 1 2.290 0.006 . 2 . 1160 . . 119 GLN HG3 . 17403 1 1657 . 1 1 124 124 GLN HE21 H 1 7.335 0.006 . 1 . 53 . . 119 GLN HE21 . 17403 1 1658 . 1 1 124 124 GLN HE22 H 1 7.027 0.011 . 1 . 41 . . 119 GLN HE22 . 17403 1 1659 . 1 1 124 124 GLN CA C 13 54.739 0.049 . 1 . 699 . . 119 GLN CA . 17403 1 1660 . 1 1 124 124 GLN CB C 13 29.532 0.027 . 1 . 700 . . 119 GLN CB . 17403 1 1661 . 1 1 124 124 GLN CG C 13 34.354 0.03 . 1 . 1162 . . 119 GLN CG . 17403 1 1662 . 1 1 124 124 GLN N N 15 124.324 0.025 . 1 . 204 . . 119 GLN N . 17403 1 1663 . 1 1 124 124 GLN NE2 N 15 111.178 0.043 . 1 . 42 . . 119 GLN NE2 . 17403 1 1664 . 1 1 125 125 GLY H H 1 4.930 0.003 . 1 . 1680 . . 120 GLY H . 17403 1 1665 . 1 1 125 125 GLY HA2 H 1 3.397 0.002 . 2 . 1008 . . 120 GLY HA2 . 17403 1 1666 . 1 1 125 125 GLY HA3 H 1 3.935 0.006 . 2 . 1009 . . 120 GLY HA3 . 17403 1 1667 . 1 1 125 125 GLY C C 13 172.418 . . 1 . 584 . . 120 GLY C . 17403 1 1668 . 1 1 125 125 GLY CA C 13 46.302 0.047 . 1 . 708 . . 120 GLY CA . 17403 1 1669 . 1 1 125 125 GLY N N 15 102.962 . . 1 . 1681 . . 120 GLY N . 17403 1 1670 . 1 1 126 126 HIS H H 1 7.305 0.009 . 1 . 1624 . . 121 HIS H . 17403 1 1671 . 1 1 126 126 HIS HA H 1 5.337 0.004 . 1 . 1623 . . 121 HIS HA . 17403 1 1672 . 1 1 126 126 HIS HB2 H 1 3.036 0.013 . 2 . 1010 . . 121 HIS HB2 . 17403 1 1673 . 1 1 126 126 HIS HB3 H 1 3.080 0.012 . 2 . 1011 . . 121 HIS HB3 . 17403 1 1674 . 1 1 126 126 HIS HD2 H 1 7.013 0.005 . 1 . 1626 . . 121 HIS HD2 . 17403 1 1675 . 1 1 126 126 HIS HE1 H 1 8.074 0.006 . 1 . 1614 . . 121 HIS HE1 . 17403 1 1676 . 1 1 126 126 HIS C C 13 174.201 . . 1 . 550 . . 121 HIS C . 17403 1 1677 . 1 1 126 126 HIS CA C 13 54.721 0.042 . 1 . 1622 . . 121 HIS CA . 17403 1 1678 . 1 1 126 126 HIS CB C 13 32.741 0.04 . 1 . 1625 . . 121 HIS CB . 17403 1 1679 . 1 1 126 126 HIS CD2 C 13 120.128 0.038 . 1 . 1627 . . 121 HIS CD2 . 17403 1 1680 . 1 1 126 126 HIS CE1 C 13 137.399 0.025 . 1 . 1615 . . 121 HIS CE1 . 17403 1 1681 . 1 1 126 126 HIS N N 15 116.571 0.033 . 1 . 1644 . . 121 HIS N . 17403 1 1682 . 1 1 126 126 HIS ND1 N 15 197.049 0.027 . 1 . 1634 . . 121 HIS ND1 . 17403 1 1683 . 1 1 126 126 HIS NE2 N 15 184.343 0.002 . 1 . 1635 . . 121 HIS NE2 . 17403 1 1684 . 1 1 127 127 ILE H H 1 9.125 0.005 . 1 . 140 . . 122 ILE H . 17403 1 1685 . 1 1 127 127 ILE HA H 1 5.131 0.002 . 1 . 815 . . 122 ILE HA . 17403 1 1686 . 1 1 127 127 ILE HB H 1 1.867 0.006 . 1 . 1012 . . 122 ILE HB . 17403 1 1687 . 1 1 127 127 ILE HG12 H 1 1.176 0.007 . 2 . 1319 . . 122 ILE HG12 . 17403 1 1688 . 1 1 127 127 ILE HG13 H 1 1.454 0.013 . 2 . 1318 . . 122 ILE HG13 . 17403 1 1689 . 1 1 127 127 ILE HG21 H 1 0.833 0.019 . 1 . 1317 . . 122 ILE HG21 . 17403 1 1690 . 1 1 127 127 ILE HG22 H 1 0.833 0.019 . 1 . 1317 . . 122 ILE HG22 . 17403 1 1691 . 1 1 127 127 ILE HG23 H 1 0.833 0.019 . 1 . 1317 . . 122 ILE HG23 . 17403 1 1692 . 1 1 127 127 ILE HD11 H 1 0.781 0.01 . 1 . 1321 . . 122 ILE HD11 . 17403 1 1693 . 1 1 127 127 ILE HD12 H 1 0.781 0.01 . 1 . 1321 . . 122 ILE HD12 . 17403 1 1694 . 1 1 127 127 ILE HD13 H 1 0.781 0.01 . 1 . 1321 . . 122 ILE HD13 . 17403 1 1695 . 1 1 127 127 ILE C C 13 172.278 . . 1 . 559 . . 122 ILE C . 17403 1 1696 . 1 1 127 127 ILE CA C 13 58.865 0.046 . 1 . 409 . . 122 ILE CA . 17403 1 1697 . 1 1 127 127 ILE CB C 13 43.110 0.035 . 1 . 408 . . 122 ILE CB . 17403 1 1698 . 1 1 127 127 ILE CG1 C 13 28.231 0.027 . 1 . 1322 . . 122 ILE CG1 . 17403 1 1699 . 1 1 127 127 ILE CG2 C 13 17.573 0.029 . 1 . 1320 . . 122 ILE CG2 . 17403 1 1700 . 1 1 127 127 ILE CD1 C 13 15.089 0.033 . 1 . 1323 . . 122 ILE CD1 . 17403 1 1701 . 1 1 127 127 ILE N N 15 124.227 0.032 . 1 . 141 . . 122 ILE N . 17403 1 1702 . 1 1 128 128 ILE H H 1 9.202 0.007 . 1 . 183 . . 123 ILE H . 17403 1 1703 . 1 1 128 128 ILE HA H 1 4.793 0.004 . 1 . 743 . . 123 ILE HA . 17403 1 1704 . 1 1 128 128 ILE HB H 1 1.653 0.011 . 1 . 1013 . . 123 ILE HB . 17403 1 1705 . 1 1 128 128 ILE HG12 H 1 1.199 0.01 . 2 . 1325 . . 123 ILE HG12 . 17403 1 1706 . 1 1 128 128 ILE HG13 H 1 0.653 0.006 . 2 . 1324 . . 123 ILE HG13 . 17403 1 1707 . 1 1 128 128 ILE HG21 H 1 0.729 0.014 . 1 . 1326 . . 123 ILE HG21 . 17403 1 1708 . 1 1 128 128 ILE HG22 H 1 0.729 0.014 . 1 . 1326 . . 123 ILE HG22 . 17403 1 1709 . 1 1 128 128 ILE HG23 H 1 0.729 0.014 . 1 . 1326 . . 123 ILE HG23 . 17403 1 1710 . 1 1 128 128 ILE HD11 H 1 0.146 0.004 . 1 . 1328 . . 123 ILE HD11 . 17403 1 1711 . 1 1 128 128 ILE HD12 H 1 0.146 0.004 . 1 . 1328 . . 123 ILE HD12 . 17403 1 1712 . 1 1 128 128 ILE HD13 H 1 0.146 0.004 . 1 . 1328 . . 123 ILE HD13 . 17403 1 1713 . 1 1 128 128 ILE C C 13 175.166 . . 1 . 565 . . 123 ILE C . 17403 1 1714 . 1 1 128 128 ILE CA C 13 60.188 0.034 . 1 . 497 . . 123 ILE CA . 17403 1 1715 . 1 1 128 128 ILE CB C 13 38.841 0.043 . 1 . 496 . . 123 ILE CB . 17403 1 1716 . 1 1 128 128 ILE CG1 C 13 28.065 0.029 . 1 . 1329 . . 123 ILE CG1 . 17403 1 1717 . 1 1 128 128 ILE CG2 C 13 18.103 0.034 . 1 . 1327 . . 123 ILE CG2 . 17403 1 1718 . 1 1 128 128 ILE CD1 C 13 13.482 0.029 . 1 . 1330 . . 123 ILE CD1 . 17403 1 1719 . 1 1 128 128 ILE N N 15 125.053 0.024 . 1 . 184 . . 123 ILE N . 17403 1 1720 . 1 1 129 129 LEU H H 1 8.779 0.005 . 1 . 284 . . 124 LEU H . 17403 1 1721 . 1 1 129 129 LEU HA H 1 4.926 0.004 . 1 . 722 . . 124 LEU HA . 17403 1 1722 . 1 1 129 129 LEU HB2 H 1 1.509 0.009 . 2 . 1014 . . 124 LEU HB2 . 17403 1 1723 . 1 1 129 129 LEU HB3 H 1 1.749 0.013 . 2 . 1015 . . 124 LEU HB3 . 17403 1 1724 . 1 1 129 129 LEU HG H 1 1.719 0.009 . 1 . 1556 . . 124 LEU HG . 17403 1 1725 . 1 1 129 129 LEU HD11 H 1 0.904 0.008 . 2 . 1555 . . 124 LEU HD11 . 17403 1 1726 . 1 1 129 129 LEU HD12 H 1 0.904 0.008 . 2 . 1555 . . 124 LEU HD12 . 17403 1 1727 . 1 1 129 129 LEU HD13 H 1 0.904 0.008 . 2 . 1555 . . 124 LEU HD13 . 17403 1 1728 . 1 1 129 129 LEU HD21 H 1 0.901 0.003 . 2 . 1693 . . 124 LEU HD21 . 17403 1 1729 . 1 1 129 129 LEU HD22 H 1 0.901 0.003 . 2 . 1693 . . 124 LEU HD22 . 17403 1 1730 . 1 1 129 129 LEU HD23 H 1 0.901 0.003 . 2 . 1693 . . 124 LEU HD23 . 17403 1 1731 . 1 1 129 129 LEU C C 13 177.045 . . 1 . 605 . . 124 LEU C . 17403 1 1732 . 1 1 129 129 LEU CA C 13 53.308 0.051 . 1 . 353 . . 124 LEU CA . 17403 1 1733 . 1 1 129 129 LEU CB C 13 42.705 0.023 . 1 . 354 . . 124 LEU CB . 17403 1 1734 . 1 1 129 129 LEU CG C 13 26.858 0.053 . 1 . 1557 . . 124 LEU CG . 17403 1 1735 . 1 1 129 129 LEU CD1 C 13 26.400 0.041 . 2 . 1554 . . 124 LEU CD1 . 17403 1 1736 . 1 1 129 129 LEU CD2 C 13 23.907 0.037 . 2 . 1692 . . 124 LEU CD2 . 17403 1 1737 . 1 1 129 129 LEU N N 15 126.842 0.015 . 1 . 285 . . 124 LEU N . 17403 1 1738 . 1 1 130 130 ILE H H 1 8.783 0.004 . 1 . 104 . . 125 ILE H . 17403 1 1739 . 1 1 130 130 ILE HA H 1 4.882 0.007 . 1 . 1016 . . 125 ILE HA . 17403 1 1740 . 1 1 130 130 ILE HB H 1 1.875 0.008 . 1 . 1017 . . 125 ILE HB . 17403 1 1741 . 1 1 130 130 ILE HG12 H 1 1.602 0.003 . 2 . 1333 . . 125 ILE HG12 . 17403 1 1742 . 1 1 130 130 ILE HG13 H 1 1.233 0.01 . 2 . 1332 . . 125 ILE HG13 . 17403 1 1743 . 1 1 130 130 ILE HG21 H 1 0.634 0.01 . 1 . 1331 . . 125 ILE HG21 . 17403 1 1744 . 1 1 130 130 ILE HG22 H 1 0.634 0.01 . 1 . 1331 . . 125 ILE HG22 . 17403 1 1745 . 1 1 130 130 ILE HG23 H 1 0.634 0.01 . 1 . 1331 . . 125 ILE HG23 . 17403 1 1746 . 1 1 130 130 ILE HD11 H 1 0.986 0.007 . 1 . 1335 . . 125 ILE HD11 . 17403 1 1747 . 1 1 130 130 ILE HD12 H 1 0.986 0.007 . 1 . 1335 . . 125 ILE HD12 . 17403 1 1748 . 1 1 130 130 ILE HD13 H 1 0.986 0.007 . 1 . 1335 . . 125 ILE HD13 . 17403 1 1749 . 1 1 130 130 ILE C C 13 174.422 . . 1 . 648 . . 125 ILE C . 17403 1 1750 . 1 1 130 130 ILE CA C 13 60.073 0.058 . 1 . 458 . . 125 ILE CA . 17403 1 1751 . 1 1 130 130 ILE CB C 13 40.905 0.066 . 1 . 457 . . 125 ILE CB . 17403 1 1752 . 1 1 130 130 ILE CG1 C 13 28.719 0.048 . 1 . 1336 . . 125 ILE CG1 . 17403 1 1753 . 1 1 130 130 ILE CG2 C 13 19.851 0.018 . 1 . 1334 . . 125 ILE CG2 . 17403 1 1754 . 1 1 130 130 ILE CD1 C 13 16.514 0.054 . 1 . 1337 . . 125 ILE CD1 . 17403 1 1755 . 1 1 130 130 ILE N N 15 119.678 0.043 . 1 . 105 . . 125 ILE N . 17403 1 1756 . 1 1 131 131 ALA H H 1 8.859 0.008 . 1 . 245 . . 126 ALA H . 17403 1 1757 . 1 1 131 131 ALA HA H 1 4.498 0.01 . 1 . 676 . . 126 ALA HA . 17403 1 1758 . 1 1 131 131 ALA HB1 H 1 1.403 0.002 . 1 . 677 . . 126 ALA HB1 . 17403 1 1759 . 1 1 131 131 ALA HB2 H 1 1.403 0.002 . 1 . 677 . . 126 ALA HB2 . 17403 1 1760 . 1 1 131 131 ALA HB3 H 1 1.403 0.002 . 1 . 677 . . 126 ALA HB3 . 17403 1 1761 . 1 1 131 131 ALA C C 13 175.288 . . 1 . 580 . . 126 ALA C . 17403 1 1762 . 1 1 131 131 ALA CA C 13 50.738 0.034 . 1 . 460 . . 126 ALA CA . 17403 1 1763 . 1 1 131 131 ALA CB C 13 22.234 0.05 . 1 . 459 . . 126 ALA CB . 17403 1 1764 . 1 1 131 131 ALA N N 15 130.248 0.014 . 1 . 246 . . 126 ALA N . 17403 1 1765 . 1 1 132 132 SER H H 1 8.478 0.004 . 1 . 241 . . 127 SER H . 17403 1 1766 . 1 1 132 132 SER HA H 1 4.600 0.003 . 1 . 530 . . 127 SER HA . 17403 1 1767 . 1 1 132 132 SER HB2 H 1 3.805 0.004 . 2 . 1018 . . 127 SER HB2 . 17403 1 1768 . 1 1 132 132 SER HB3 H 1 4.085 0.004 . 2 . 1019 . . 127 SER HB3 . 17403 1 1769 . 1 1 132 132 SER HG H 1 8.937 . . 1 . 1694 . . 127 SER HG . 17403 1 1770 . 1 1 132 132 SER C C 13 174.882 . . 1 . 627 . . 127 SER C . 17403 1 1771 . 1 1 132 132 SER CA C 13 57.557 0.064 . 1 . 675 . . 127 SER CA . 17403 1 1772 . 1 1 132 132 SER CB C 13 64.718 0.058 . 1 . 674 . . 127 SER CB . 17403 1 1773 . 1 1 132 132 SER N N 15 113.898 0.027 . 1 . 242 . . 127 SER N . 17403 1 1774 . 1 1 133 133 ARG H H 1 8.769 0.006 . 1 . 27 . . 128 ARG H . 17403 1 1775 . 1 1 133 133 ARG HA H 1 4.326 0.02 . 1 . 790 . . 128 ARG HA . 17403 1 1776 . 1 1 133 133 ARG HB2 H 1 1.822 0.002 . 2 . 1434 . . 128 ARG HB2 . 17403 1 1777 . 1 1 133 133 ARG HB3 H 1 1.920 0.003 . 2 . 1433 . . 128 ARG HB3 . 17403 1 1778 . 1 1 133 133 ARG HG2 H 1 1.655 0.01 . 2 . 1436 . . 128 ARG HG2 . 17403 1 1779 . 1 1 133 133 ARG HG3 H 1 1.693 0.019 . 2 . 1435 . . 128 ARG HG3 . 17403 1 1780 . 1 1 133 133 ARG HD2 H 1 3.209 0.002 . 2 . 1438 . . 128 ARG HD2 . 17403 1 1781 . 1 1 133 133 ARG HD3 H 1 3.209 0.002 . 2 . 1439 . . 128 ARG HD3 . 17403 1 1782 . 1 1 133 133 ARG HE H 1 7.241 0.005 . 1 . 1603 . . 128 ARG HE . 17403 1 1783 . 1 1 133 133 ARG C C 13 177.006 0.002 . 1 . 1450 . . 128 ARG C . 17403 1 1784 . 1 1 133 133 ARG CA C 13 57.267 0.075 . 1 . 1432 . . 128 ARG CA . 17403 1 1785 . 1 1 133 133 ARG CB C 13 30.611 0.032 . 1 . 1452 . . 128 ARG CB . 17403 1 1786 . 1 1 133 133 ARG CG C 13 27.480 0.034 . 1 . 1437 . . 128 ARG CG . 17403 1 1787 . 1 1 133 133 ARG CD C 13 43.508 0.04 . 1 . 1440 . . 128 ARG CD . 17403 1 1788 . 1 1 133 133 ARG N N 15 122.019 0.02 . 1 . 28 . . 128 ARG N . 17403 1 1789 . 1 1 133 133 ARG NE N 15 84.642 . . 1 . 1604 . . 128 ARG NE . 17403 1 1790 . 1 1 134 134 SER H H 1 8.437 0.003 . 1 . 98 . . 129 SER H . 17403 1 1791 . 1 1 134 134 SER HA H 1 4.466 0.01 . 1 . 798 . . 129 SER HA . 17403 1 1792 . 1 1 134 134 SER HB2 H 1 3.928 0.007 . 2 . 1431 . . 129 SER HB2 . 17403 1 1793 . 1 1 134 134 SER HB3 H 1 3.868 0.015 . 2 . 1567 . . 129 SER HB3 . 17403 1 1794 . 1 1 134 134 SER C C 13 174.994 0.002 . 1 . 1566 . . 129 SER C . 17403 1 1795 . 1 1 134 134 SER CA C 13 58.864 0.029 . 1 . 397 . . 129 SER CA . 17403 1 1796 . 1 1 134 134 SER CB C 13 63.641 0.032 . 1 . 396 . . 129 SER CB . 17403 1 1797 . 1 1 134 134 SER N N 15 115.832 0.026 . 1 . 99 . . 129 SER N . 17403 1 1798 . 1 1 135 135 SER H H 1 8.392 0.01 . 1 . 1569 . . 130 SER H . 17403 1 1799 . 1 1 135 135 SER HA H 1 4.481 0.007 . 1 . 1575 . . 130 SER HA . 17403 1 1800 . 1 1 135 135 SER HB2 H 1 3.990 0.014 . 2 . 1573 . . 130 SER HB2 . 17403 1 1801 . 1 1 135 135 SER HB3 H 1 3.943 0.011 . 2 . 1574 . . 130 SER HB3 . 17403 1 1802 . 1 1 135 135 SER C C 13 175.029 0.003 . 1 . 1572 . . 130 SER C . 17403 1 1803 . 1 1 135 135 SER CA C 13 58.905 0.07 . 1 . 1451 . . 130 SER CA . 17403 1 1804 . 1 1 135 135 SER CB C 13 63.634 0.041 . 1 . 1571 . . 130 SER CB . 17403 1 1805 . 1 1 135 135 SER N N 15 118.547 0.028 . 1 . 1570 . . 130 SER N . 17403 1 1806 . 1 1 136 136 VAL H H 1 8.064 0.004 . 1 . 163 . . 131 VAL H . 17403 1 1807 . 1 1 136 136 VAL HA H 1 4.138 0.002 . 1 . 1020 . . 131 VAL HA . 17403 1 1808 . 1 1 136 136 VAL HB H 1 2.117 0.003 . 1 . 1021 . . 131 VAL HB . 17403 1 1809 . 1 1 136 136 VAL HG11 H 1 0.944 0.003 . 2 . 1239 . . 131 VAL HG11 . 17403 1 1810 . 1 1 136 136 VAL HG12 H 1 0.944 0.003 . 2 . 1239 . . 131 VAL HG12 . 17403 1 1811 . 1 1 136 136 VAL HG13 H 1 0.944 0.003 . 2 . 1239 . . 131 VAL HG13 . 17403 1 1812 . 1 1 136 136 VAL HG21 H 1 0.942 0.01 . 2 . 1241 . . 131 VAL HG21 . 17403 1 1813 . 1 1 136 136 VAL HG22 H 1 0.942 0.01 . 2 . 1241 . . 131 VAL HG22 . 17403 1 1814 . 1 1 136 136 VAL HG23 H 1 0.942 0.01 . 2 . 1241 . . 131 VAL HG23 . 17403 1 1815 . 1 1 136 136 VAL C C 13 176.126 0.001 . 1 . 656 . . 131 VAL C . 17403 1 1816 . 1 1 136 136 VAL CA C 13 62.513 0.053 . 1 . 705 . . 131 VAL CA . 17403 1 1817 . 1 1 136 136 VAL CB C 13 32.561 0.033 . 1 . 340 . . 131 VAL CB . 17403 1 1818 . 1 1 136 136 VAL CG1 C 13 20.514 0.038 . 2 . 1240 . . 131 VAL CG1 . 17403 1 1819 . 1 1 136 136 VAL CG2 C 13 21.200 0.027 . 2 . 1353 . . 131 VAL CG2 . 17403 1 1820 . 1 1 136 136 VAL N N 15 121.275 0.023 . 1 . 164 . . 131 VAL N . 17403 1 1821 . 1 1 137 137 ALA H H 1 8.200 0.005 . 1 . 77 . . 132 ALA H . 17403 1 1822 . 1 1 137 137 ALA HA H 1 4.309 0.006 . 1 . 778 . . 132 ALA HA . 17403 1 1823 . 1 1 137 137 ALA HB1 H 1 1.406 0.009 . 1 . 1022 . . 132 ALA HB1 . 17403 1 1824 . 1 1 137 137 ALA HB2 H 1 1.406 0.009 . 1 . 1022 . . 132 ALA HB2 . 17403 1 1825 . 1 1 137 137 ALA HB3 H 1 1.406 0.009 . 1 . 1022 . . 132 ALA HB3 . 17403 1 1826 . 1 1 137 137 ALA C C 13 178.271 . . 1 . 628 . . 132 ALA C . 17403 1 1827 . 1 1 137 137 ALA CA C 13 52.791 0.056 . 1 . 704 . . 132 ALA CA . 17403 1 1828 . 1 1 137 137 ALA CB C 13 19.213 0.071 . 1 . 703 . . 132 ALA CB . 17403 1 1829 . 1 1 137 137 ALA N N 15 126.464 0.033 . 1 . 78 . . 132 ALA N . 17403 1 1830 . 1 1 138 138 GLY H H 1 8.219 0.004 . 1 . 54 . . 133 GLY H . 17403 1 1831 . 1 1 138 138 GLY HA2 H 1 3.934 0.005 . 2 . 1178 . . 133 GLY HA2 . 17403 1 1832 . 1 1 138 138 GLY HA3 H 1 3.934 0.005 . 2 . 1023 . . 133 GLY HA3 . 17403 1 1833 . 1 1 138 138 GLY C C 13 174.198 . . 1 . 662 . . 133 GLY C . 17403 1 1834 . 1 1 138 138 GLY CA C 13 45.359 0.045 . 1 . 332 . . 133 GLY CA . 17403 1 1835 . 1 1 138 138 GLY N N 15 107.877 0.033 . 1 . 55 . . 133 GLY N . 17403 1 1836 . 1 1 139 139 LYS H H 1 8.055 0.008 . 1 . 62 . . 134 LYS H . 17403 1 1837 . 1 1 139 139 LYS HA H 1 4.319 0.003 . 1 . 1024 . . 134 LYS HA . 17403 1 1838 . 1 1 139 139 LYS HB2 H 1 1.738 0.007 . 2 . 1025 . . 134 LYS HB2 . 17403 1 1839 . 1 1 139 139 LYS HB3 H 1 1.841 0.003 . 2 . 1026 . . 134 LYS HB3 . 17403 1 1840 . 1 1 139 139 LYS HG2 H 1 1.389 0.004 . 2 . 1496 . . 134 LYS HG2 . 17403 1 1841 . 1 1 139 139 LYS HG3 H 1 1.434 0.008 . 2 . 1495 . . 134 LYS HG3 . 17403 1 1842 . 1 1 139 139 LYS HD2 H 1 1.674 0.005 . 2 . 1498 . . 134 LYS HD2 . 17403 1 1843 . 1 1 139 139 LYS HD3 H 1 1.674 0.005 . 2 . 1499 . . 134 LYS HD3 . 17403 1 1844 . 1 1 139 139 LYS HE2 H 1 2.992 0.005 . 2 . 1501 . . 134 LYS HE2 . 17403 1 1845 . 1 1 139 139 LYS HE3 H 1 2.992 0.005 . 2 . 1502 . . 134 LYS HE3 . 17403 1 1846 . 1 1 139 139 LYS C C 13 176.522 . . 1 . 556 . . 134 LYS C . 17403 1 1847 . 1 1 139 139 LYS CA C 13 56.247 0.06 . 1 . 331 . . 134 LYS CA . 17403 1 1848 . 1 1 139 139 LYS CB C 13 33.116 0.021 . 1 . 330 . . 134 LYS CB . 17403 1 1849 . 1 1 139 139 LYS CG C 13 24.710 0.027 . 1 . 1497 . . 134 LYS CG . 17403 1 1850 . 1 1 139 139 LYS CD C 13 29.065 0.005 . 1 . 1500 . . 134 LYS CD . 17403 1 1851 . 1 1 139 139 LYS CE C 13 42.123 0.066 . 1 . 1503 . . 134 LYS CE . 17403 1 1852 . 1 1 139 139 LYS N N 15 120.517 0.038 . 1 . 63 . . 134 LYS N . 17403 1 1853 . 1 1 140 140 LEU H H 1 8.194 0.003 . 1 . 56 . . 135 LEU H . 17403 1 1854 . 1 1 140 140 LEU HA H 1 4.324 0.003 . 1 . 748 . . 135 LEU HA . 17403 1 1855 . 1 1 140 140 LEU HB2 H 1 1.549 0.014 . 2 . 1027 . . 135 LEU HB2 . 17403 1 1856 . 1 1 140 140 LEU HB3 H 1 1.618 0.009 . 2 . 1028 . . 135 LEU HB3 . 17403 1 1857 . 1 1 140 140 LEU HG H 1 1.588 0.014 . 1 . 1568 . . 135 LEU HG . 17403 1 1858 . 1 1 140 140 LEU HD11 H 1 0.874 0.003 . 2 . 1393 . . 135 LEU HD11 . 17403 1 1859 . 1 1 140 140 LEU HD12 H 1 0.874 0.003 . 2 . 1393 . . 135 LEU HD12 . 17403 1 1860 . 1 1 140 140 LEU HD13 H 1 0.874 0.003 . 2 . 1393 . . 135 LEU HD13 . 17403 1 1861 . 1 1 140 140 LEU HD21 H 1 0.814 0.002 . 2 . 1391 . . 135 LEU HD21 . 17403 1 1862 . 1 1 140 140 LEU HD22 H 1 0.814 0.002 . 2 . 1391 . . 135 LEU HD22 . 17403 1 1863 . 1 1 140 140 LEU HD23 H 1 0.814 0.002 . 2 . 1391 . . 135 LEU HD23 . 17403 1 1864 . 1 1 140 140 LEU C C 13 176.745 . . 1 . 554 . . 135 LEU C . 17403 1 1865 . 1 1 140 140 LEU CA C 13 54.982 0.039 . 1 . 399 . . 135 LEU CA . 17403 1 1866 . 1 1 140 140 LEU CB C 13 42.348 0.043 . 1 . 398 . . 135 LEU CB . 17403 1 1867 . 1 1 140 140 LEU CG C 13 26.971 0.034 . 1 . 1392 . . 135 LEU CG . 17403 1 1868 . 1 1 140 140 LEU CD1 C 13 25.036 0.033 . 2 . 1394 . . 135 LEU CD1 . 17403 1 1869 . 1 1 140 140 LEU CD2 C 13 23.551 0.035 . 2 . 1395 . . 135 LEU CD2 . 17403 1 1870 . 1 1 140 140 LEU N N 15 122.935 0.034 . 1 . 57 . . 135 LEU N . 17403 1 1871 . 1 1 141 141 ALA H H 1 8.132 0.007 . 1 . 166 . . 136 ALA H . 17403 1 1872 . 1 1 141 141 ALA HA H 1 4.319 0.004 . 1 . 774 . . 136 ALA HA . 17403 1 1873 . 1 1 141 141 ALA HB1 H 1 1.371 0.003 . 1 . 1029 . . 136 ALA HB1 . 17403 1 1874 . 1 1 141 141 ALA HB2 H 1 1.371 0.003 . 1 . 1029 . . 136 ALA HB2 . 17403 1 1875 . 1 1 141 141 ALA HB3 H 1 1.371 0.003 . 1 . 1029 . . 136 ALA HB3 . 17403 1 1876 . 1 1 141 141 ALA C C 13 176.395 . . 1 . 612 . . 136 ALA C . 17403 1 1877 . 1 1 141 141 ALA CA C 13 52.271 0.04 . 1 . 473 . . 136 ALA CA . 17403 1 1878 . 1 1 141 141 ALA CB C 13 19.304 0.016 . 1 . 400 . . 136 ALA CB . 17403 1 1879 . 1 1 141 141 ALA N N 15 125.443 0.048 . 1 . 167 . . 136 ALA N . 17403 1 1880 . 1 1 142 142 LYS H H 1 7.807 0.005 . 1 . 261 . . 137 LYS H . 17403 1 1881 . 1 1 142 142 LYS HA H 1 4.124 0.004 . 1 . 1354 . . 137 LYS HA . 17403 1 1882 . 1 1 142 142 LYS HB2 H 1 1.802 0.002 . 2 . 1505 . . 137 LYS HB2 . 17403 1 1883 . 1 1 142 142 LYS HB3 H 1 1.697 0.004 . 2 . 1504 . . 137 LYS HB3 . 17403 1 1884 . 1 1 142 142 LYS HG2 H 1 1.381 0.013 . 2 . 1507 . . 137 LYS HG2 . 17403 1 1885 . 1 1 142 142 LYS HG3 H 1 1.381 0.012 . 2 . 1506 . . 137 LYS HG3 . 17403 1 1886 . 1 1 142 142 LYS HD2 H 1 1.664 0.002 . 1 . 1509 . . 137 LYS HD2 . 17403 1 1887 . 1 1 142 142 LYS HD3 H 1 1.664 0.002 . 1 . 1510 . . 137 LYS HD3 . 17403 1 1888 . 1 1 142 142 LYS HE2 H 1 2.978 0.006 . 2 . 1513 . . 137 LYS HE2 . 17403 1 1889 . 1 1 142 142 LYS HE3 H 1 2.976 0.007 . 2 . 1514 . . 137 LYS HE3 . 17403 1 1890 . 1 1 142 142 LYS CA C 13 57.634 0.08 . 1 . 1355 . . 137 LYS CA . 17403 1 1891 . 1 1 142 142 LYS CB C 13 33.779 0.028 . 1 . 1508 . . 137 LYS CB . 17403 1 1892 . 1 1 142 142 LYS CG C 13 24.712 0.03 . 1 . 1511 . . 137 LYS CG . 17403 1 1893 . 1 1 142 142 LYS CD C 13 29.119 0.046 . 1 . 1512 . . 137 LYS CD . 17403 1 1894 . 1 1 142 142 LYS CE C 13 42.072 0.074 . 1 . 1515 . . 137 LYS CE . 17403 1 1895 . 1 1 142 142 LYS N N 15 125.808 0.018 . 1 . 262 . . 137 LYS N . 17403 1 stop_ save_