###################################
# 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_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 18589
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 18589 1
2 '3D CBCA(CO)NH' . . . 18589 1
3 '3D HNCO' . . . 18589 1
4 '3D HNCA' . . . 18589 1
5 '3D HNCACB' . . . 18589 1
6 '3D HN(CO)CA' . . . 18589 1
7 '3D HCCH-TOCSY' . . . 18589 1
10 '3D HN(COCA)CB' . . . 18589 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 2 2 PRO HA H 1 4.4344 0.002 . 1 . . . . 2 PRO HA . 18589 1
2 . 1 1 2 2 PRO HB2 H 1 2.3008 0.003 . 2 . . . . 2 PRO HB1|HB2 . 18589 1
3 . 1 1 2 2 PRO HB3 H 1 1.9109 0.003 . 2 . . . . 2 PRO HB2|HB1 . 18589 1
4 . 1 1 2 2 PRO HG2 H 1 1.9967 0.004 . 2 . . . . 2 PRO HG1|HG2 . 18589 1
5 . 1 1 2 2 PRO HG3 H 1 2.0465 0.004 . 2 . . . . 2 PRO HG2|HG1 . 18589 1
6 . 1 1 2 2 PRO HD2 H 1 3.836 0.003 . 2 . . . . 2 PRO HD1|HD2 . 18589 1
7 . 1 1 2 2 PRO HD3 H 1 3.656 0.004 . 2 . . . . 2 PRO HD2|HD1 . 18589 1
8 . 1 1 2 2 PRO C C 13 176.8861 0 . 1 . . . . 2 PRO C . 18589 1
9 . 1 1 2 2 PRO CA C 13 63.4062 0.01 . 1 . . . . 2 PRO CA . 18589 1
10 . 1 1 2 2 PRO CB C 13 32.1634 0.011 . 1 . . . . 2 PRO CB . 18589 1
11 . 1 1 2 2 PRO CG C 13 27.475 0.013 . 1 . . . . 2 PRO CG . 18589 1
12 . 1 1 2 2 PRO CD C 13 50.6124 0.03 . 1 . . . . 2 PRO CD . 18589 1
13 . 1 1 3 3 SER H H 1 8.4935 0.001 . 1 . . . . 3 SER HN . 18589 1
14 . 1 1 3 3 SER C C 13 175.6492 0 . 1 . . . . 3 SER C . 18589 1
15 . 1 1 3 3 SER CA C 13 57.9798 0 . 1 . . . . 3 SER CA . 18589 1
16 . 1 1 3 3 SER CB C 13 64.138 0 . 1 . . . . 3 SER CB . 18589 1
17 . 1 1 3 3 SER N N 15 115.8258 0.006 . 1 . . . . 3 SER N . 18589 1
18 . 1 1 4 4 VAL HA H 1 3.8757 0.004 . 1 . . . . 4 VAL HA . 18589 1
19 . 1 1 4 4 VAL HB H 1 2.0891 0.003 . 1 . . . . 4 VAL HB . 18589 1
20 . 1 1 4 4 VAL HG11 H 1 0.8633 0.001 . 2 . . . . 4 VAL HG1#|HG2# . 18589 1
21 . 1 1 4 4 VAL HG12 H 1 0.8633 0.001 . 2 . . . . 4 VAL HG1#|HG2# . 18589 1
22 . 1 1 4 4 VAL HG13 H 1 0.8633 0.001 . 2 . . . . 4 VAL HG1#|HG2# . 18589 1
23 . 1 1 4 4 VAL HG21 H 1 0.9745 0.003 . 2 . . . . 4 VAL HG2#|HG1# . 18589 1
24 . 1 1 4 4 VAL HG22 H 1 0.9745 0.003 . 2 . . . . 4 VAL HG2#|HG1# . 18589 1
25 . 1 1 4 4 VAL HG23 H 1 0.9745 0.003 . 2 . . . . 4 VAL HG2#|HG1# . 18589 1
26 . 1 1 4 4 VAL C C 13 176.8174 0 . 1 . . . . 4 VAL C . 18589 1
27 . 1 1 4 4 VAL CA C 13 64.3247 0.047 . 1 . . . . 4 VAL CA . 18589 1
28 . 1 1 4 4 VAL CB C 13 32.1853 0.053 . 1 . . . . 4 VAL CB . 18589 1
29 . 1 1 4 4 VAL CG1 C 13 20.8993 0.017 . 2 . . . . 4 VAL CG1|CG2 . 18589 1
30 . 1 1 4 4 VAL CG2 C 13 21.5453 0.024 . 2 . . . . 4 VAL CG2|CG1 . 18589 1
31 . 1 1 5 5 ASN H H 1 8.3628 0.001 . 1 . . . . 5 ASN HN . 18589 1
32 . 1 1 5 5 ASN HA H 1 4.5169 0.005 . 1 . . . . 5 ASN HA . 18589 1
33 . 1 1 5 5 ASN HB2 H 1 2.8259 0.004 . 2 . . . . 5 ASN HB1|HB2 . 18589 1
34 . 1 1 5 5 ASN HB3 H 1 2.7012 0.003 . 2 . . . . 5 ASN HB2|HB1 . 18589 1
35 . 1 1 5 5 ASN C C 13 176.462 0.024 . 1 . . . . 5 ASN C . 18589 1
36 . 1 1 5 5 ASN CA C 13 54.8788 0.09 . 1 . . . . 5 ASN CA . 18589 1
37 . 1 1 5 5 ASN CB C 13 38.4091 0.019 . 1 . . . . 5 ASN CB . 18589 1
38 . 1 1 5 5 ASN N N 15 119.8312 0.015 . 1 . . . . 5 ASN N . 18589 1
39 . 1 1 6 6 ASP H H 1 8.1976 0.013 . 1 . . . . 6 ASP HN . 18589 1
40 . 1 1 6 6 ASP HA H 1 3.863 0.003 . 1 . . . . 6 ASP HA . 18589 1
41 . 1 1 6 6 ASP HB2 H 1 2.2046 0 . 2 . . . . 6 ASP HB1|HB2 . 18589 1
42 . 1 1 6 6 ASP HB3 H 1 1.9357 0 . 2 . . . . 6 ASP HB2|HB1 . 18589 1
43 . 1 1 6 6 ASP C C 13 177.0785 0.002 . 1 . . . . 6 ASP C . 18589 1
44 . 1 1 6 6 ASP CA C 13 55.6072 0.004 . 1 . . . . 6 ASP CA . 18589 1
45 . 1 1 6 6 ASP CB C 13 40.9859 0.01 . 1 . . . . 6 ASP CB . 18589 1
46 . 1 1 6 6 ASP N N 15 119.8927 0.01 . 1 . . . . 6 ASP N . 18589 1
47 . 1 1 7 7 SER H H 1 8.0451 0.001 . 1 . . . . 7 SER HN . 18589 1
48 . 1 1 7 7 SER HA H 1 4.4707 0.001 . 1 . . . . 7 SER HA . 18589 1
49 . 1 1 7 7 SER HB2 H 1 3.8083 0.002 . 2 . . . . 7 SER HB1|HB2 . 18589 1
50 . 1 1 7 7 SER HB3 H 1 3.9525 0 . 2 . . . . 7 SER HB2|HB1 . 18589 1
51 . 1 1 7 7 SER C C 13 174.6085 0.006 . 1 . . . . 7 SER C . 18589 1
52 . 1 1 7 7 SER CA C 13 59.9487 0.057 . 1 . . . . 7 SER CA . 18589 1
53 . 1 1 7 7 SER CB C 13 63.7213 0.016 . 1 . . . . 7 SER CB . 18589 1
54 . 1 1 7 7 SER N N 15 114.3306 0.008 . 1 . . . . 7 SER N . 18589 1
55 . 1 1 8 8 LEU H H 1 7.6197 0.001 . 1 . . . . 8 LEU HN . 18589 1
56 . 1 1 8 8 LEU HA H 1 3.7805 0.005 . 1 . . . . 8 LEU HA . 18589 1
57 . 1 1 8 8 LEU HB2 H 1 1.4468 0.005 . 2 . . . . 8 LEU HB1|HB2 . 18589 1
58 . 1 1 8 8 LEU HB3 H 1 1.857 0.009 . 2 . . . . 8 LEU HB2|HB1 . 18589 1
59 . 1 1 8 8 LEU HG H 1 1.9278 0.004 . 1 . . . . 8 LEU HG . 18589 1
60 . 1 1 8 8 LEU HD11 H 1 0.7736 0.005 . 2 . . . . 8 LEU HD1#|HD2# . 18589 1
61 . 1 1 8 8 LEU HD12 H 1 0.7736 0.005 . 2 . . . . 8 LEU HD1#|HD2# . 18589 1
62 . 1 1 8 8 LEU HD13 H 1 0.7736 0.005 . 2 . . . . 8 LEU HD1#|HD2# . 18589 1
63 . 1 1 8 8 LEU HD21 H 1 0.8862 0.004 . 2 . . . . 8 LEU HD2#|HD1# . 18589 1
64 . 1 1 8 8 LEU HD22 H 1 0.8862 0.004 . 2 . . . . 8 LEU HD2#|HD1# . 18589 1
65 . 1 1 8 8 LEU HD23 H 1 0.8862 0.004 . 2 . . . . 8 LEU HD2#|HD1# . 18589 1
66 . 1 1 8 8 LEU C C 13 177.971 0.01 . 1 . . . . 8 LEU C . 18589 1
67 . 1 1 8 8 LEU CA C 13 58.728 0.012 . 1 . . . . 8 LEU CA . 18589 1
68 . 1 1 8 8 LEU CB C 13 41.5195 0.032 . 1 . . . . 8 LEU CB . 18589 1
69 . 1 1 8 8 LEU CG C 13 26.5333 0 . 1 . . . . 8 LEU CG . 18589 1
70 . 1 1 8 8 LEU CD1 C 13 23.4081 0 . 2 . . . . 8 LEU CD1|CD2 . 18589 1
71 . 1 1 8 8 LEU CD2 C 13 25.5958 0 . 2 . . . . 8 LEU CD2|CD1 . 18589 1
72 . 1 1 8 8 LEU N N 15 120.3367 0.008 . 1 . . . . 8 LEU N . 18589 1
73 . 1 1 9 9 ASP H H 1 8.1716 0.002 . 1 . . . . 9 ASP HN . 18589 1
74 . 1 1 9 9 ASP HA H 1 4.1993 0.004 . 1 . . . . 9 ASP HA . 18589 1
75 . 1 1 9 9 ASP HB2 H 1 2.6093 0.006 . 2 . . . . 9 ASP HB1|HB2 . 18589 1
76 . 1 1 9 9 ASP HB3 H 1 2.6999 0.005 . 2 . . . . 9 ASP HB2|HB1 . 18589 1
77 . 1 1 9 9 ASP C C 13 179.0591 0.042 . 1 . . . . 9 ASP C . 18589 1
78 . 1 1 9 9 ASP CA C 13 57.7956 0.036 . 1 . . . . 9 ASP CA . 18589 1
79 . 1 1 9 9 ASP CB C 13 39.9782 0.01 . 1 . . . . 9 ASP CB . 18589 1
80 . 1 1 9 9 ASP N N 15 116.9232 0.04 . 1 . . . . 9 ASP N . 18589 1
81 . 1 1 10 10 ILE H H 1 8.0392 0 . 1 . . . . 10 ILE HN . 18589 1
82 . 1 1 10 10 ILE HA H 1 4.0532 0.003 . 1 . . . . 10 ILE HA . 18589 1
83 . 1 1 10 10 ILE HB H 1 1.8623 0.002 . 1 . . . . 10 ILE HB . 18589 1
84 . 1 1 10 10 ILE HG12 H 1 1.4642 0.004 . 2 . . . . 10 ILE HG12 . 18589 1
85 . 1 1 10 10 ILE HG13 H 1 1.2195 0.004 . 2 . . . . 10 ILE HG13 . 18589 1
86 . 1 1 10 10 ILE HG21 H 1 0.9499 0.003 . 2 . . . . 10 ILE HG2# . 18589 1
87 . 1 1 10 10 ILE HG22 H 1 0.9499 0.003 . 2 . . . . 10 ILE HG2# . 18589 1
88 . 1 1 10 10 ILE HG23 H 1 0.9499 0.003 . 2 . . . . 10 ILE HG2# . 18589 1
89 . 1 1 10 10 ILE HD11 H 1 0.8674 0.005 . 2 . . . . 10 ILE HD1# . 18589 1
90 . 1 1 10 10 ILE HD12 H 1 0.8674 0.005 . 2 . . . . 10 ILE HD1# . 18589 1
91 . 1 1 10 10 ILE HD13 H 1 0.8674 0.005 . 2 . . . . 10 ILE HD1# . 18589 1
92 . 1 1 10 10 ILE C C 13 176.8145 0.012 . 1 . . . . 10 ILE C . 18589 1
93 . 1 1 10 10 ILE CA C 13 62.8558 0.086 . 1 . . . . 10 ILE CA . 18589 1
94 . 1 1 10 10 ILE CB C 13 37.8184 0.045 . 1 . . . . 10 ILE CB . 18589 1
95 . 1 1 10 10 ILE CG1 C 13 29.3462 0.001 . 1 . . . . 10 ILE CG1 . 18589 1
96 . 1 1 10 10 ILE CG2 C 13 17.7994 0.041 . 1 . . . . 10 ILE CG2 . 18589 1
97 . 1 1 10 10 ILE CD1 C 13 13.387 0.041 . 1 . . . . 10 ILE CD1 . 18589 1
98 . 1 1 10 10 ILE N N 15 120.7805 0.012 . 1 . . . . 10 ILE N . 18589 1
99 . 1 1 11 11 VAL H H 1 7.8082 0.001 . 1 . . . . 11 VAL HN . 18589 1
100 . 1 1 11 11 VAL C C 13 176.7603 0 . 1 . . . . 11 VAL C . 18589 1
101 . 1 1 11 11 VAL CA C 13 67.3311 0.019 . 1 . . . . 11 VAL CA . 18589 1
102 . 1 1 11 11 VAL CB C 13 31.0575 0.029 . 1 . . . . 11 VAL CB . 18589 1
103 . 1 1 11 11 VAL CG1 C 13 21.8492 0 . 2 . . . . 11 VAL CG1|CG2 . 18589 1
104 . 1 1 11 11 VAL CG2 C 13 22.7127 0 . 2 . . . . 11 VAL CG2|CG1 . 18589 1
105 . 1 1 11 11 VAL N N 15 121.2167 0.008 . 1 . . . . 11 VAL N . 18589 1
106 . 1 1 12 12 GLU H H 1 8.3775 0.001 . 1 . . . . 12 GLU HN . 18589 1
107 . 1 1 12 12 GLU HA H 1 3.4873 0.001 . 1 . . . . 12 GLU HA . 18589 1
108 . 1 1 12 12 GLU HB2 H 1 2.1159 0.006 . 2 . . . . 12 GLU HB1|HB2 . 18589 1
109 . 1 1 12 12 GLU HB3 H 1 2.1969 0.005 . 2 . . . . 12 GLU HB2|HB1 . 18589 1
110 . 1 1 12 12 GLU HG2 H 1 1.997 0.003 . 2 . . . . 12 GLU HG1|HG2 . 18589 1
111 . 1 1 12 12 GLU HG3 H 1 2.1124 0.007 . 2 . . . . 12 GLU HG2|HG1 . 18589 1
112 . 1 1 12 12 GLU C C 13 177.3883 0 . 1 . . . . 12 GLU C . 18589 1
113 . 1 1 12 12 GLU CA C 13 60.5397 0.06 . 1 . . . . 12 GLU CA . 18589 1
114 . 1 1 12 12 GLU CB C 13 29.9314 0.081 . 1 . . . . 12 GLU CB . 18589 1
115 . 1 1 12 12 GLU CG C 13 36.2174 0.008 . 1 . . . . 12 GLU CG . 18589 1
116 . 1 1 12 12 GLU N N 15 118.8496 0.01 . 1 . . . . 12 GLU N . 18589 1
117 . 1 1 13 13 LYS H H 1 7.7415 0.001 . 1 . . . . 13 LYS HN . 18589 1
118 . 1 1 13 13 LYS HA H 1 3.897 0 . 1 . . . . 13 LYS HA . 18589 1
119 . 1 1 13 13 LYS HB2 H 1 1.959 0.003 . 2 . . . . 13 LYS HB1|HB2 . 18589 1
120 . 1 1 13 13 LYS HB3 H 1 1.8979 0.001 . 2 . . . . 13 LYS HB2|HB1 . 18589 1
121 . 1 1 13 13 LYS HG2 H 1 1.3968 0.004 . 2 . . . . 13 LYS HG1|HG2 . 18589 1
122 . 1 1 13 13 LYS HG3 H 1 1.5005 0.007 . 2 . . . . 13 LYS HG2|HG1 . 18589 1
123 . 1 1 13 13 LYS HD2 H 1 1.6346 0.001 . 2 . . . . 13 LYS HD1|HD2 . 18589 1
124 . 1 1 13 13 LYS HD3 H 1 1.5913 0.001 . 2 . . . . 13 LYS HD2|HD1 . 18589 1
125 . 1 1 13 13 LYS HE2 H 1 2.9163 0.001 . 2 . . . . 13 LYS HE1|HE2 . 18589 1
126 . 1 1 13 13 LYS C C 13 179.2274 0.047 . 1 . . . . 13 LYS C . 18589 1
127 . 1 1 13 13 LYS CA C 13 59.6714 0.015 . 1 . . . . 13 LYS CA . 18589 1
128 . 1 1 13 13 LYS CB C 13 32.8089 0.04 . 1 . . . . 13 LYS CB . 18589 1
129 . 1 1 13 13 LYS CG C 13 25.2833 0 . 1 . . . . 13 LYS CG . 18589 1
130 . 1 1 13 13 LYS CD C 13 28.721 0 . 1 . . . . 13 LYS CD . 18589 1
131 . 1 1 13 13 LYS CE C 13 42.4719 0 . 1 . . . . 13 LYS CE . 18589 1
132 . 1 1 13 13 LYS N N 15 117.6394 0.003 . 1 . . . . 13 LYS N . 18589 1
133 . 1 1 14 14 LEU H H 1 8.1712 0.001 . 1 . . . . 14 LEU HN . 18589 1
134 . 1 1 14 14 LEU HA H 1 4.1068 0.007 . 1 . . . . 14 LEU HA . 18589 1
135 . 1 1 14 14 LEU HB2 H 1 1.1614 0.009 . 2 . . . . 14 LEU HB1|HB2 . 18589 1
136 . 1 1 14 14 LEU HB3 H 1 1.8354 0.004 . 2 . . . . 14 LEU HB2|HB1 . 18589 1
137 . 1 1 14 14 LEU HG H 1 2.039 0.006 . 1 . . . . 14 LEU HG . 18589 1
138 . 1 1 14 14 LEU HD11 H 1 0.8418 0.014 . 2 . . . . 14 LEU HD1#|HD2# . 18589 1
139 . 1 1 14 14 LEU HD12 H 1 0.8418 0.014 . 2 . . . . 14 LEU HD1#|HD2# . 18589 1
140 . 1 1 14 14 LEU HD13 H 1 0.8418 0.014 . 2 . . . . 14 LEU HD1#|HD2# . 18589 1
141 . 1 1 14 14 LEU HD21 H 1 0.8803 0.006 . 2 . . . . 14 LEU HD2#|HD1# . 18589 1
142 . 1 1 14 14 LEU HD22 H 1 0.8803 0.006 . 2 . . . . 14 LEU HD2#|HD1# . 18589 1
143 . 1 1 14 14 LEU HD23 H 1 0.8803 0.006 . 2 . . . . 14 LEU HD2#|HD1# . 18589 1
144 . 1 1 14 14 LEU C C 13 178.8973 0.048 . 1 . . . . 14 LEU C . 18589 1
145 . 1 1 14 14 LEU CA C 13 57.6967 0.074 . 1 . . . . 14 LEU CA . 18589 1
146 . 1 1 14 14 LEU CB C 13 42.2248 0.094 . 1 . . . . 14 LEU CB . 18589 1
147 . 1 1 14 14 LEU CG C 13 27.1584 0 . 1 . . . . 14 LEU CG . 18589 1
148 . 1 1 14 14 LEU CD1 C 13 27.5751 0.074 . 2 . . . . 14 LEU CD1|CD2 . 18589 1
149 . 1 1 14 14 LEU CD2 C 13 22.4706 0 . 2 . . . . 14 LEU CD2|CD1 . 18589 1
150 . 1 1 14 14 LEU N N 15 116.9424 0.043 . 1 . . . . 14 LEU N . 18589 1
151 . 1 1 15 15 TYR H H 1 8.9947 0.001 . 1 . . . . 15 TYR HN . 18589 1
152 . 1 1 15 15 TYR HA H 1 4.0009 0.002 . 1 . . . . 15 TYR HA . 18589 1
153 . 1 1 15 15 TYR HB2 H 1 2.9496 0.003 . 2 . . . . 15 TYR HB1|HB2 . 18589 1
154 . 1 1 15 15 TYR HB3 H 1 3.0109 0.005 . 2 . . . . 15 TYR HB2|HB1 . 18589 1
155 . 1 1 15 15 TYR HD1 H 1 6.7832 0.012 . 2 . . . . 15 TYR HD# . 18589 1
156 . 1 1 15 15 TYR HD2 H 1 6.7832 0.012 . 2 . . . . 15 TYR HD# . 18589 1
157 . 1 1 15 15 TYR C C 13 181.2784 0.006 . 1 . . . . 15 TYR C . 18589 1
158 . 1 1 15 15 TYR CA C 13 62.4714 0.059 . 1 . . . . 15 TYR CA . 18589 1
159 . 1 1 15 15 TYR CB C 13 39.0335 0.052 . 1 . . . . 15 TYR CB . 18589 1
160 . 1 1 15 15 TYR N N 15 120.723 0.011 . 1 . . . . 15 TYR N . 18589 1
161 . 1 1 16 16 LYS H H 1 8.6662 0.001 . 1 . . . . 16 LYS HN . 18589 1
162 . 1 1 16 16 LYS HA H 1 3.9494 0.003 . 1 . . . . 16 LYS HA . 18589 1
163 . 1 1 16 16 LYS HB2 H 1 2.0283 0.001 . 2 . . . . 16 LYS HB1|HB2 . 18589 1
164 . 1 1 16 16 LYS HB3 H 1 1.9518 0.001 . 2 . . . . 16 LYS HB2|HB1 . 18589 1
165 . 1 1 16 16 LYS HD2 H 1 1.777 0.002 . 2 . . . . 16 LYS HD1|HD2 . 18589 1
166 . 1 1 16 16 LYS HD3 H 1 1.7463 0 . 2 . . . . 16 LYS HD2|HD1 . 18589 1
167 . 1 1 16 16 LYS C C 13 177.8792 0.017 . 1 . . . . 16 LYS C . 18589 1
168 . 1 1 16 16 LYS CA C 13 60.0874 0.066 . 1 . . . . 16 LYS CA . 18589 1
169 . 1 1 16 16 LYS CB C 13 32.2778 0.086 . 1 . . . . 16 LYS CB . 18589 1
170 . 1 1 16 16 LYS CG C 13 27.5517 0 . 1 . . . . 16 LYS CG . 18589 1
171 . 1 1 16 16 LYS CD C 13 29.7013 0.06 . 1 . . . . 16 LYS CD . 18589 1
172 . 1 1 16 16 LYS CE C 13 42.5652 0 . 1 . . . . 16 LYS CE . 18589 1
173 . 1 1 16 16 LYS N N 15 121.4935 0.019 . 1 . . . . 16 LYS N . 18589 1
174 . 1 1 17 17 ASP H H 1 7.7087 0.001 . 1 . . . . 17 ASP HN . 18589 1
175 . 1 1 17 17 ASP HA H 1 4.5423 0.002 . 1 . . . . 17 ASP HA . 18589 1
176 . 1 1 17 17 ASP HB2 H 1 2.7507 0.003 . 2 . . . . 17 ASP HB1|HB2 . 18589 1
177 . 1 1 17 17 ASP C C 13 176.7858 0.008 . 1 . . . . 17 ASP C . 18589 1
178 . 1 1 17 17 ASP CA C 13 54.7914 0.116 . 1 . . . . 17 ASP CA . 18589 1
179 . 1 1 17 17 ASP CB C 13 41.3349 0.081 . 1 . . . . 17 ASP CB . 18589 1
180 . 1 1 17 17 ASP N N 15 118.9147 0.002 . 1 . . . . 17 ASP N . 18589 1
181 . 1 1 18 18 GLY H H 1 7.7495 0.001 . 1 . . . . 18 GLY HN . 18589 1
182 . 1 1 18 18 GLY HA2 H 1 3.5185 0.003 . 2 . . . . 18 GLY HA1|HA2 . 18589 1
183 . 1 1 18 18 GLY HA3 H 1 4.0126 0.002 . 2 . . . . 18 GLY HA2|HA1 . 18589 1
184 . 1 1 18 18 GLY C C 13 174.5177 0 . 1 . . . . 18 GLY C . 18589 1
185 . 1 1 18 18 GLY CA C 13 45.4976 0.058 . 1 . . . . 18 GLY CA . 18589 1
186 . 1 1 18 18 GLY N N 15 107.4168 0.008 . 1 . . . . 18 GLY N . 18589 1
187 . 1 1 19 19 VAL H H 1 7.5749 0.001 . 1 . . . . 19 VAL HN . 18589 1
188 . 1 1 19 19 VAL HA H 1 4.074 0.002 . 1 . . . . 19 VAL HA . 18589 1
189 . 1 1 19 19 VAL HB H 1 1.6886 0.003 . 1 . . . . 19 VAL HB . 18589 1
190 . 1 1 19 19 VAL HG11 H 1 0.9749 0.003 . 2 . . . . 19 VAL HG1#|HG2# . 18589 1
191 . 1 1 19 19 VAL HG12 H 1 0.9749 0.003 . 2 . . . . 19 VAL HG1#|HG2# . 18589 1
192 . 1 1 19 19 VAL HG13 H 1 0.9749 0.003 . 2 . . . . 19 VAL HG1#|HG2# . 18589 1
193 . 1 1 19 19 VAL HG21 H 1 0.9785 0 . 2 . . . . 19 VAL HG2#|HG1# . 18589 1
194 . 1 1 19 19 VAL HG22 H 1 0.9785 0 . 2 . . . . 19 VAL HG2#|HG1# . 18589 1
195 . 1 1 19 19 VAL HG23 H 1 0.9785 0 . 2 . . . . 19 VAL HG2#|HG1# . 18589 1
196 . 1 1 19 19 VAL C C 13 174.3344 0 . 1 . . . . 19 VAL C . 18589 1
197 . 1 1 19 19 VAL CA C 13 60.8932 0.03 . 1 . . . . 19 VAL CA . 18589 1
198 . 1 1 19 19 VAL CB C 13 32.1805 0.022 . 1 . . . . 19 VAL CB . 18589 1
199 . 1 1 19 19 VAL CG1 C 13 21.8455 0 . 2 . . . . 19 VAL CG1|CG2 . 18589 1
200 . 1 1 19 19 VAL CG2 C 13 22.7831 0 . 2 . . . . 19 VAL CG2|CG1 . 18589 1
201 . 1 1 19 19 VAL N N 15 123.5186 0.002 . 1 . . . . 19 VAL N . 18589 1
202 . 1 1 20 20 PRO HA H 1 4.3698 0.002 . 1 . . . . 20 PRO HA . 18589 1
203 . 1 1 20 20 PRO HB2 H 1 2.2444 0.004 . 2 . . . . 20 PRO HB1|HB2 . 18589 1
204 . 1 1 20 20 PRO HB3 H 1 1.846 0.006 . 2 . . . . 20 PRO HB2|HB1 . 18589 1
205 . 1 1 20 20 PRO HG2 H 1 1.9975 0.003 . 2 . . . . 20 PRO HG1|HG2 . 18589 1
206 . 1 1 20 20 PRO HG3 H 1 1.9121 0.004 . 2 . . . . 20 PRO HG2|HG1 . 18589 1
207 . 1 1 20 20 PRO HD2 H 1 3.6144 0.005 . 2 . . . . 20 PRO HD1|HD2 . 18589 1
208 . 1 1 20 20 PRO HD3 H 1 3.8309 0.005 . 2 . . . . 20 PRO HD2|HD1 . 18589 1
209 . 1 1 20 20 PRO C C 13 178.5071 0 . 1 . . . . 20 PRO C . 18589 1
210 . 1 1 20 20 PRO CA C 13 62.7945 0.023 . 1 . . . . 20 PRO CA . 18589 1
211 . 1 1 20 20 PRO CB C 13 32.477 0.018 . 1 . . . . 20 PRO CB . 18589 1
212 . 1 1 20 20 PRO CG C 13 28.093 0.009 . 1 . . . . 20 PRO CG . 18589 1
213 . 1 1 20 20 PRO CD C 13 50.5974 0 . 1 . . . . 20 PRO CD . 18589 1
214 . 1 1 21 21 VAL H H 1 8.9176 0.001 . 1 . . . . 21 VAL HN . 18589 1
215 . 1 1 21 21 VAL HA H 1 3.4217 0.005 . 1 . . . . 21 VAL HA . 18589 1
216 . 1 1 21 21 VAL HB H 1 1.9954 0.004 . 1 . . . . 21 VAL HB . 18589 1
217 . 1 1 21 21 VAL HG11 H 1 1.066 0.003 . 2 . . . . 21 VAL HG1#|HG2# . 18589 1
218 . 1 1 21 21 VAL HG12 H 1 1.066 0.003 . 2 . . . . 21 VAL HG1#|HG2# . 18589 1
219 . 1 1 21 21 VAL HG13 H 1 1.066 0.003 . 2 . . . . 21 VAL HG1#|HG2# . 18589 1
220 . 1 1 21 21 VAL HG21 H 1 0.6556 0.003 . 2 . . . . 21 VAL HG2#|HG1# . 18589 1
221 . 1 1 21 21 VAL HG22 H 1 0.6556 0.003 . 2 . . . . 21 VAL HG2#|HG1# . 18589 1
222 . 1 1 21 21 VAL HG23 H 1 0.6556 0.003 . 2 . . . . 21 VAL HG2#|HG1# . 18589 1
223 . 1 1 21 21 VAL C C 13 177.2645 0.009 . 1 . . . . 21 VAL C . 18589 1
224 . 1 1 21 21 VAL CA C 13 68.0986 0.011 . 1 . . . . 21 VAL CA . 18589 1
225 . 1 1 21 21 VAL CB C 13 31.2466 0.043 . 1 . . . . 21 VAL CB . 18589 1
226 . 1 1 21 21 VAL CG1 C 13 22.7734 0.019 . 2 . . . . 21 VAL CG1|CG2 . 18589 1
227 . 1 1 21 21 VAL CG2 C 13 20.9429 0.07 . 2 . . . . 21 VAL CG2|CG1 . 18589 1
228 . 1 1 21 21 VAL N N 15 123.1546 0.023 . 1 . . . . 21 VAL N . 18589 1
229 . 1 1 22 22 LYS H H 1 8.9919 0.001 . 1 . . . . 22 LYS HN . 18589 1
230 . 1 1 22 22 LYS HA H 1 4.1235 0.004 . 1 . . . . 22 LYS HA . 18589 1
231 . 1 1 22 22 LYS HB2 H 1 1.7758 0.001 . 2 . . . . 22 LYS HB1|HB2 . 18589 1
232 . 1 1 22 22 LYS HB3 H 1 1.8762 0.003 . 2 . . . . 22 LYS HB2|HB1 . 18589 1
233 . 1 1 22 22 LYS HG2 H 1 1.5405 0 . 2 . . . . 22 LYS HG1|HG2 . 18589 1
234 . 1 1 22 22 LYS HG3 H 1 1.4405 0 . 2 . . . . 22 LYS HG2|HG1 . 18589 1
235 . 1 1 22 22 LYS HD2 H 1 1.7066 0.005 . 2 . . . . 22 LYS HD1|HD2 . 18589 1
236 . 1 1 22 22 LYS HD3 H 1 1.7305 0.003 . 2 . . . . 22 LYS HD2|HD1 . 18589 1
237 . 1 1 22 22 LYS HE2 H 1 3.0004 0 . 2 . . . . 22 LYS HE1|HE2 . 18589 1
238 . 1 1 22 22 LYS C C 13 178.8067 0.009 . 1 . . . . 22 LYS C . 18589 1
239 . 1 1 22 22 LYS CA C 13 59.9737 0.011 . 1 . . . . 22 LYS CA . 18589 1
240 . 1 1 22 22 LYS CB C 13 32.4953 0.026 . 1 . . . . 22 LYS CB . 18589 1
241 . 1 1 22 22 LYS CG C 13 25.1181 0 . 1 . . . . 22 LYS CG . 18589 1
242 . 1 1 22 22 LYS CD C 13 29.6459 0.031 . 1 . . . . 22 LYS CD . 18589 1
243 . 1 1 22 22 LYS CE C 13 42.1125 0 . 1 . . . . 22 LYS CE . 18589 1
244 . 1 1 22 22 LYS N N 15 118.0239 0.006 . 1 . . . . 22 LYS N . 18589 1
245 . 1 1 23 23 GLU H H 1 7.1778 0.001 . 1 . . . . 23 GLU HN . 18589 1
246 . 1 1 23 23 GLU HA H 1 4.2783 0.003 . 1 . . . . 23 GLU HA . 18589 1
247 . 1 1 23 23 GLU HB2 H 1 2.0218 0 . 2 . . . . 23 GLU HB1|HB2 . 18589 1
248 . 1 1 23 23 GLU HB3 H 1 1.834 0 . 2 . . . . 23 GLU HB2|HB1 . 18589 1
249 . 1 1 23 23 GLU HG2 H 1 2.2372 0.006 . 2 . . . . 23 GLU HG1|HG2 . 18589 1
250 . 1 1 23 23 GLU HG3 H 1 2.036 0.005 . 2 . . . . 23 GLU HG2|HG1 . 18589 1
251 . 1 1 23 23 GLU C C 13 178.1377 0.003 . 1 . . . . 23 GLU C . 18589 1
252 . 1 1 23 23 GLU CA C 13 57.7211 0.056 . 1 . . . . 23 GLU CA . 18589 1
253 . 1 1 23 23 GLU CB C 13 29.6772 0.032 . 1 . . . . 23 GLU CB . 18589 1
254 . 1 1 23 23 GLU CG C 13 35.9176 0.017 . 1 . . . . 23 GLU CG . 18589 1
255 . 1 1 23 23 GLU N N 15 118.5328 0.004 . 1 . . . . 23 GLU N . 18589 1
256 . 1 1 24 24 ILE H H 1 8.4016 0.001 . 1 . . . . 24 ILE HN . 18589 1
257 . 1 1 24 24 ILE HA H 1 3.409 0.004 . 1 . . . . 24 ILE HA . 18589 1
258 . 1 1 24 24 ILE HB H 1 2.0861 0.003 . 1 . . . . 24 ILE HB . 18589 1
259 . 1 1 24 24 ILE HG12 H 1 0.6668 0.005 . 2 . . . . 24 ILE HG12 . 18589 1
260 . 1 1 24 24 ILE HG13 H 1 1.8864 0.004 . 2 . . . . 24 ILE HG13 . 18589 1
261 . 1 1 24 24 ILE HG21 H 1 0.8638 0.002 . 2 . . . . 24 ILE HG2# . 18589 1
262 . 1 1 24 24 ILE HG22 H 1 0.8638 0.002 . 2 . . . . 24 ILE HG2# . 18589 1
263 . 1 1 24 24 ILE HG23 H 1 0.8638 0.002 . 2 . . . . 24 ILE HG2# . 18589 1
264 . 1 1 24 24 ILE HD11 H 1 0.937 0.002 . 2 . . . . 24 ILE HD1# . 18589 1
265 . 1 1 24 24 ILE HD12 H 1 0.937 0.002 . 2 . . . . 24 ILE HD1# . 18589 1
266 . 1 1 24 24 ILE HD13 H 1 0.937 0.002 . 2 . . . . 24 ILE HD1# . 18589 1
267 . 1 1 24 24 ILE C C 13 179.7032 0.001 . 1 . . . . 24 ILE C . 18589 1
268 . 1 1 24 24 ILE CA C 13 66.4709 0.076 . 1 . . . . 24 ILE CA . 18589 1
269 . 1 1 24 24 ILE CB C 13 37.4722 0.01 . 1 . . . . 24 ILE CB . 18589 1
270 . 1 1 24 24 ILE CG1 C 13 28.4151 0.021 . 1 . . . . 24 ILE CG1 . 18589 1
271 . 1 1 24 24 ILE CG2 C 13 18.7025 0.04 . 1 . . . . 24 ILE CG2 . 18589 1
272 . 1 1 24 24 ILE CD1 C 13 12.7917 0.023 . 1 . . . . 24 ILE CD1 . 18589 1
273 . 1 1 24 24 ILE N N 15 122.3404 0.013 . 1 . . . . 24 ILE N . 18589 1
274 . 1 1 25 25 ALA H H 1 8.1578 0.001 . 1 . . . . 25 ALA HN . 18589 1
275 . 1 1 25 25 ALA HA H 1 3.5537 0.003 . 1 . . . . 25 ALA HA . 18589 1
276 . 1 1 25 25 ALA HB1 H 1 1.381 0.008 . 2 . . . . 25 ALA HB# . 18589 1
277 . 1 1 25 25 ALA HB2 H 1 1.381 0.008 . 2 . . . . 25 ALA HB# . 18589 1
278 . 1 1 25 25 ALA HB3 H 1 1.381 0.008 . 2 . . . . 25 ALA HB# . 18589 1
279 . 1 1 25 25 ALA C C 13 177.9859 0.002 . 1 . . . . 25 ALA C . 18589 1
280 . 1 1 25 25 ALA CA C 13 56.3156 0.068 . 1 . . . . 25 ALA CA . 18589 1
281 . 1 1 25 25 ALA CB C 13 17.5551 0.062 . 1 . . . . 25 ALA CB . 18589 1
282 . 1 1 25 25 ALA N N 15 123.6863 0.008 . 1 . . . . 25 ALA N . 18589 1
283 . 1 1 26 26 LYS H H 1 7.3254 0.001 . 1 . . . . 26 LYS HN . 18589 1
284 . 1 1 26 26 LYS HA H 1 4.0549 0.002 . 1 . . . . 26 LYS HA . 18589 1
285 . 1 1 26 26 LYS HB2 H 1 1.9592 0.005 . 2 . . . . 26 LYS HB1|HB2 . 18589 1
286 . 1 1 26 26 LYS HB3 H 1 1.9033 0.001 . 2 . . . . 26 LYS HB2|HB1 . 18589 1
287 . 1 1 26 26 LYS HG2 H 1 1.4083 0.001 . 2 . . . . 26 LYS HG1|HG2 . 18589 1
288 . 1 1 26 26 LYS HG3 H 1 1.5354 0.002 . 2 . . . . 26 LYS HG2|HG1 . 18589 1
289 . 1 1 26 26 LYS HD2 H 1 1.7125 0 . 2 . . . . 26 LYS HD1|HD2 . 18589 1
290 . 1 1 26 26 LYS HE2 H 1 2.9254 0 . 2 . . . . 26 LYS HE1|HE2 . 18589 1
291 . 1 1 26 26 LYS HE3 H 1 2.9595 0.003 . 2 . . . . 26 LYS HE2|HE1 . 18589 1
292 . 1 1 26 26 LYS C C 13 180.277 0.009 . 1 . . . . 26 LYS C . 18589 1
293 . 1 1 26 26 LYS CA C 13 59.6086 0.053 . 1 . . . . 26 LYS CA . 18589 1
294 . 1 1 26 26 LYS CB C 13 32.8171 0.044 . 1 . . . . 26 LYS CB . 18589 1
295 . 1 1 26 26 LYS CG C 13 24.6484 0.032 . 1 . . . . 26 LYS CG . 18589 1
296 . 1 1 26 26 LYS CD C 13 29.1711 0 . 1 . . . . 26 LYS CD . 18589 1
297 . 1 1 26 26 LYS CE C 13 42.1477 0.012 . 1 . . . . 26 LYS CE . 18589 1
298 . 1 1 26 26 LYS N N 15 117.2615 0.005 . 1 . . . . 26 LYS N . 18589 1
299 . 1 1 27 27 ARG H H 1 8.6643 0.001 . 1 . . . . 27 ARG HN . 18589 1
300 . 1 1 27 27 ARG HA H 1 4.0942 0.006 . 1 . . . . 27 ARG HA . 18589 1
301 . 1 1 27 27 ARG HB2 H 1 1.9193 0.004 . 2 . . . . 27 ARG HB1|HB2 . 18589 1
302 . 1 1 27 27 ARG HB3 H 1 1.6748 0.003 . 2 . . . . 27 ARG HB2|HB1 . 18589 1
303 . 1 1 27 27 ARG HG2 H 1 1.9156 0.005 . 2 . . . . 27 ARG HG1|HG2 . 18589 1
304 . 1 1 27 27 ARG HG3 H 1 1.7537 0.003 . 2 . . . . 27 ARG HG2|HG1 . 18589 1
305 . 1 1 27 27 ARG HD2 H 1 3.037 0.002 . 2 . . . . 27 ARG HD1|HD2 . 18589 1
306 . 1 1 27 27 ARG HD3 H 1 3.1449 0.003 . 2 . . . . 27 ARG HD2|HD1 . 18589 1
307 . 1 1 27 27 ARG C C 13 177.1237 0.003 . 1 . . . . 27 ARG C . 18589 1
308 . 1 1 27 27 ARG CA C 13 58.4634 0.06 . 1 . . . . 27 ARG CA . 18589 1
309 . 1 1 27 27 ARG CB C 13 30.878 0.05 . 1 . . . . 27 ARG CB . 18589 1
310 . 1 1 27 27 ARG CG C 13 27.7829 0.002 . 1 . . . . 27 ARG CG . 18589 1
311 . 1 1 27 27 ARG CD C 13 43.7425 0.05 . 1 . . . . 27 ARG CD . 18589 1
312 . 1 1 27 27 ARG N N 15 116.4599 0.005 . 1 . . . . 27 ARG N . 18589 1
313 . 1 1 28 28 SER H H 1 7.8878 0.001 . 1 . . . . 28 SER HN . 18589 1
314 . 1 1 28 28 SER HA H 1 4.4939 0.002 . 1 . . . . 28 SER HA . 18589 1
315 . 1 1 28 28 SER HB2 H 1 3.8711 0.004 . 2 . . . . 28 SER HB1|HB2 . 18589 1
316 . 1 1 28 28 SER HB3 H 1 3.9516 0.001 . 2 . . . . 28 SER HB2|HB1 . 18589 1
317 . 1 1 28 28 SER C C 13 172.859 0.022 . 1 . . . . 28 SER C . 18589 1
318 . 1 1 28 28 SER CA C 13 57.8604 0.057 . 1 . . . . 28 SER CA . 18589 1
319 . 1 1 28 28 SER CB C 13 65.024 0.04 . 1 . . . . 28 SER CB . 18589 1
320 . 1 1 28 28 SER N N 15 110.5675 0.007 . 1 . . . . 28 SER N . 18589 1
321 . 1 1 29 29 ASN H H 1 7.6874 0.001 . 1 . . . . 29 ASN HN . 18589 1
322 . 1 1 29 29 ASN HA H 1 4.3453 0.004 . 1 . . . . 29 ASN HA . 18589 1
323 . 1 1 29 29 ASN HB2 H 1 2.6935 0.003 . 2 . . . . 29 ASN HB1|HB2 . 18589 1
324 . 1 1 29 29 ASN HB3 H 1 3.1061 0.003 . 2 . . . . 29 ASN HB2|HB1 . 18589 1
325 . 1 1 29 29 ASN C C 13 173.135 0.018 . 1 . . . . 29 ASN C . 18589 1
326 . 1 1 29 29 ASN CA C 13 54.3793 0.034 . 1 . . . . 29 ASN CA . 18589 1
327 . 1 1 29 29 ASN CB C 13 37.1566 0.016 . 1 . . . . 29 ASN CB . 18589 1
328 . 1 1 29 29 ASN N N 15 118.3532 0.004 . 1 . . . . 29 ASN N . 18589 1
329 . 1 1 30 30 ASN H H 1 8.3663 0.001 . 1 . . . . 30 ASN HN . 18589 1
330 . 1 1 30 30 ASN HA H 1 5.1771 0.005 . 1 . . . . 30 ASN HA . 18589 1
331 . 1 1 30 30 ASN HB2 H 1 2.1901 0.003 . 2 . . . . 30 ASN HB1|HB2 . 18589 1
332 . 1 1 30 30 ASN HB3 H 1 2.5688 0.001 . 2 . . . . 30 ASN HB2|HB1 . 18589 1
333 . 1 1 30 30 ASN C C 13 174.6894 0.013 . 1 . . . . 30 ASN C . 18589 1
334 . 1 1 30 30 ASN CA C 13 51.804 0.039 . 1 . . . . 30 ASN CA . 18589 1
335 . 1 1 30 30 ASN CB C 13 44.4172 0.087 . 1 . . . . 30 ASN CB . 18589 1
336 . 1 1 30 30 ASN N N 15 115.8459 0.011 . 1 . . . . 30 ASN N . 18589 1
337 . 1 1 31 31 SER H H 1 8.7038 0.001 . 1 . . . . 31 SER HN . 18589 1
338 . 1 1 31 31 SER HA H 1 4.4804 0.004 . 1 . . . . 31 SER HA . 18589 1
339 . 1 1 31 31 SER HB2 H 1 4.0041 0.007 . 2 . . . . 31 SER HB1|HB2 . 18589 1
340 . 1 1 31 31 SER HB3 H 1 4.2786 0.008 . 2 . . . . 31 SER HB2|HB1 . 18589 1
341 . 1 1 31 31 SER C C 13 175.6704 0 . 1 . . . . 31 SER C . 18589 1
342 . 1 1 31 31 SER CA C 13 56.8495 0.003 . 1 . . . . 31 SER CA . 18589 1
343 . 1 1 31 31 SER CB C 13 64.6887 0.062 . 1 . . . . 31 SER CB . 18589 1
344 . 1 1 31 31 SER N N 15 113.9687 0.008 . 1 . . . . 31 SER N . 18589 1
345 . 1 1 32 32 MET HA H 1 3.8765 0.001 . 1 . . . . 32 MET HA . 18589 1
346 . 1 1 32 32 MET HB2 H 1 1.942 0.006 . 2 . . . . 32 MET HB1|HB2 . 18589 1
347 . 1 1 32 32 MET HB3 H 1 2.0742 0.003 . 2 . . . . 32 MET HB2|HB1 . 18589 1
348 . 1 1 32 32 MET HG2 H 1 2.4246 0.006 . 2 . . . . 32 MET HG1|HG2 . 18589 1
349 . 1 1 32 32 MET HG3 H 1 2.6175 0.004 . 2 . . . . 32 MET HG2|HG1 . 18589 1
350 . 1 1 32 32 MET C C 13 177.9431 0.003 . 1 . . . . 32 MET C . 18589 1
351 . 1 1 32 32 MET CA C 13 58.4544 0.054 . 1 . . . . 32 MET CA . 18589 1
352 . 1 1 32 32 MET CB C 13 31.2391 0.04 . 1 . . . . 32 MET CB . 18589 1
353 . 1 1 32 32 MET CG C 13 32.4769 0.017 . 1 . . . . 32 MET CG . 18589 1
354 . 1 1 33 33 SER H H 1 8.439 0.001 . 1 . . . . 33 SER HN . 18589 1
355 . 1 1 33 33 SER HA H 1 4.272 0.002 . 1 . . . . 33 SER HA . 18589 1
356 . 1 1 33 33 SER HB2 H 1 3.9343 0.002 . 2 . . . . 33 SER HB1|HB2 . 18589 1
357 . 1 1 33 33 SER HB3 H 1 3.8966 0.006 . 2 . . . . 33 SER HB2|HB1 . 18589 1
358 . 1 1 33 33 SER C C 13 177.3662 0.021 . 1 . . . . 33 SER C . 18589 1
359 . 1 1 33 33 SER CA C 13 61.6993 0.013 . 1 . . . . 33 SER CA . 18589 1
360 . 1 1 33 33 SER CB C 13 62.3006 0.036 . 1 . . . . 33 SER CB . 18589 1
361 . 1 1 33 33 SER N N 15 112.4559 0.009 . 1 . . . . 33 SER N . 18589 1
362 . 1 1 34 34 THR H H 1 7.8635 0.001 . 1 . . . . 34 THR HN . 18589 1
363 . 1 1 34 34 THR HA H 1 3.8137 0.004 . 1 . . . . 34 THR HA . 18589 1
364 . 1 1 34 34 THR HB H 1 4.1941 0.003 . 1 . . . . 34 THR HB . 18589 1
365 . 1 1 34 34 THR HG21 H 1 1.0595 0.003 . 2 . . . . 34 THR HG2# . 18589 1
366 . 1 1 34 34 THR HG22 H 1 1.0595 0.003 . 2 . . . . 34 THR HG2# . 18589 1
367 . 1 1 34 34 THR HG23 H 1 1.0595 0.003 . 2 . . . . 34 THR HG2# . 18589 1
368 . 1 1 34 34 THR C C 13 176.2541 0.001 . 1 . . . . 34 THR C . 18589 1
369 . 1 1 34 34 THR CA C 13 66.6067 0.077 . 1 . . . . 34 THR CA . 18589 1
370 . 1 1 34 34 THR CB C 13 68.2247 0.048 . 1 . . . . 34 THR CB . 18589 1
371 . 1 1 34 34 THR CG2 C 13 21.9623 0 . 1 . . . . 34 THR CG2 . 18589 1
372 . 1 1 34 34 THR N N 15 119.8064 0.018 . 1 . . . . 34 THR N . 18589 1
373 . 1 1 35 35 VAL H H 1 7.8128 0.003 . 1 . . . . 35 VAL HN . 18589 1
374 . 1 1 35 35 VAL HA H 1 3.3788 0.004 . 1 . . . . 35 VAL HA . 18589 1
375 . 1 1 35 35 VAL HB H 1 2.0019 0.006 . 1 . . . . 35 VAL HB . 18589 1
376 . 1 1 35 35 VAL HG11 H 1 0.7635 0.006 . 2 . . . . 35 VAL HG1#|HG2# . 18589 1
377 . 1 1 35 35 VAL HG12 H 1 0.7635 0.006 . 2 . . . . 35 VAL HG1#|HG2# . 18589 1
378 . 1 1 35 35 VAL HG13 H 1 0.7635 0.006 . 2 . . . . 35 VAL HG1#|HG2# . 18589 1
379 . 1 1 35 35 VAL HG21 H 1 0.8666 0.004 . 2 . . . . 35 VAL HG2#|HG1# . 18589 1
380 . 1 1 35 35 VAL HG22 H 1 0.8666 0.004 . 2 . . . . 35 VAL HG2#|HG1# . 18589 1
381 . 1 1 35 35 VAL HG23 H 1 0.8666 0.004 . 2 . . . . 35 VAL HG2#|HG1# . 18589 1
382 . 1 1 35 35 VAL C C 13 177.4662 0.001 . 1 . . . . 35 VAL C . 18589 1
383 . 1 1 35 35 VAL CA C 13 67.6842 0.056 . 1 . . . . 35 VAL CA . 18589 1
384 . 1 1 35 35 VAL CB C 13 30.7551 0.044 . 1 . . . . 35 VAL CB . 18589 1
385 . 1 1 35 35 VAL CG1 C 13 22.013 0.022 . 2 . . . . 35 VAL CG1|CG2 . 18589 1
386 . 1 1 35 35 VAL CG2 C 13 22.9647 0.051 . 2 . . . . 35 VAL CG2|CG1 . 18589 1
387 . 1 1 35 35 VAL N N 15 122.1453 0.024 . 1 . . . . 35 VAL N . 18589 1
388 . 1 1 36 36 TYR H H 1 8.6409 0.001 . 1 . . . . 36 TYR HN . 18589 1
389 . 1 1 36 36 TYR HA H 1 4.2711 0.002 . 1 . . . . 36 TYR HA . 18589 1
390 . 1 1 36 36 TYR HB2 H 1 2.9592 0.005 . 2 . . . . 36 TYR HB1|HB2 . 18589 1
391 . 1 1 36 36 TYR HB3 H 1 3.1331 0.002 . 2 . . . . 36 TYR HB2|HB1 . 18589 1
392 . 1 1 36 36 TYR HD1 H 1 7.0912 0 . 2 . . . . 36 TYR HD# . 18589 1
393 . 1 1 36 36 TYR HD2 H 1 7.0912 0 . 2 . . . . 36 TYR HD# . 18589 1
394 . 1 1 36 36 TYR C C 13 179.5659 0.023 . 1 . . . . 36 TYR C . 18589 1
395 . 1 1 36 36 TYR CA C 13 62.4467 0.062 . 1 . . . . 36 TYR CA . 18589 1
396 . 1 1 36 36 TYR CB C 13 37.1774 0.026 . 1 . . . . 36 TYR CB . 18589 1
397 . 1 1 36 36 TYR N N 15 118.541 0.008 . 1 . . . . 36 TYR N . 18589 1
398 . 1 1 37 37 LYS H H 1 8.0323 0.001 . 1 . . . . 37 LYS HN . 18589 1
399 . 1 1 37 37 LYS HA H 1 4.1356 0.002 . 1 . . . . 37 LYS HA . 18589 1
400 . 1 1 37 37 LYS HB2 H 1 1.8768 0 . 2 . . . . 37 LYS HB1|HB2 . 18589 1
401 . 1 1 37 37 LYS HB3 H 1 1.9662 0 . 2 . . . . 37 LYS HB2|HB1 . 18589 1
402 . 1 1 37 37 LYS C C 13 179.2505 0.005 . 1 . . . . 37 LYS C . 18589 1
403 . 1 1 37 37 LYS CA C 13 59.2648 0.045 . 1 . . . . 37 LYS CA . 18589 1
404 . 1 1 37 37 LYS CB C 13 32.2554 0.069 . 1 . . . . 37 LYS CB . 18589 1
405 . 1 1 37 37 LYS CG C 13 25.3254 0 . 1 . . . . 37 LYS CG . 18589 1
406 . 1 1 37 37 LYS CD C 13 28.9199 0 . 1 . . . . 37 LYS CD . 18589 1
407 . 1 1 37 37 LYS CE C 13 42.3253 0 . 1 . . . . 37 LYS CE . 18589 1
408 . 1 1 37 37 LYS N N 15 119.9743 0.005 . 1 . . . . 37 LYS N . 18589 1
409 . 1 1 38 38 ALA H H 1 8.4249 0.001 . 1 . . . . 38 ALA HN . 18589 1
410 . 1 1 38 38 ALA HA H 1 3.9442 0.005 . 1 . . . . 38 ALA HA . 18589 1
411 . 1 1 38 38 ALA HB1 H 1 1.4333 0.004 . 2 . . . . 38 ALA HB# . 18589 1
412 . 1 1 38 38 ALA HB2 H 1 1.4333 0.004 . 2 . . . . 38 ALA HB# . 18589 1
413 . 1 1 38 38 ALA HB3 H 1 1.4333 0.004 . 2 . . . . 38 ALA HB# . 18589 1
414 . 1 1 38 38 ALA C C 13 179.344 0.024 . 1 . . . . 38 ALA C . 18589 1
415 . 1 1 38 38 ALA CA C 13 55.0839 0.033 . 1 . . . . 38 ALA CA . 18589 1
416 . 1 1 38 38 ALA CB C 13 18.1907 0.046 . 1 . . . . 38 ALA CB . 18589 1
417 . 1 1 38 38 ALA N N 15 123.7082 0.006 . 1 . . . . 38 ALA N . 18589 1
418 . 1 1 39 39 LEU H H 1 8.5202 0.001 . 1 . . . . 39 LEU HN . 18589 1
419 . 1 1 39 39 LEU HA H 1 3.7417 0.003 . 1 . . . . 39 LEU HA . 18589 1
420 . 1 1 39 39 LEU HB2 H 1 0.9815 0.003 . 2 . . . . 39 LEU HB1|HB2 . 18589 1
421 . 1 1 39 39 LEU HB3 H 1 1.9261 0.003 . 2 . . . . 39 LEU HB2|HB1 . 18589 1
422 . 1 1 39 39 LEU HG H 1 1.6607 0.006 . 1 . . . . 39 LEU HG . 18589 1
423 . 1 1 39 39 LEU HD11 H 1 0.1278 0.005 . 2 . . . . 39 LEU HD1#|HD2# . 18589 1
424 . 1 1 39 39 LEU HD12 H 1 0.1278 0.005 . 2 . . . . 39 LEU HD1#|HD2# . 18589 1
425 . 1 1 39 39 LEU HD13 H 1 0.1278 0.005 . 2 . . . . 39 LEU HD1#|HD2# . 18589 1
426 . 1 1 39 39 LEU HD21 H 1 0.6421 0.005 . 2 . . . . 39 LEU HD2#|HD1# . 18589 1
427 . 1 1 39 39 LEU HD22 H 1 0.6421 0.005 . 2 . . . . 39 LEU HD2#|HD1# . 18589 1
428 . 1 1 39 39 LEU HD23 H 1 0.6421 0.005 . 2 . . . . 39 LEU HD2#|HD1# . 18589 1
429 . 1 1 39 39 LEU C C 13 178.9614 0.028 . 1 . . . . 39 LEU C . 18589 1
430 . 1 1 39 39 LEU CA C 13 58.2215 0.04 . 1 . . . . 39 LEU CA . 18589 1
431 . 1 1 39 39 LEU CB C 13 41.3634 0.026 . 1 . . . . 39 LEU CB . 18589 1
432 . 1 1 39 39 LEU CG C 13 26.3844 0.016 . 1 . . . . 39 LEU CG . 18589 1
433 . 1 1 39 39 LEU CD1 C 13 22.9466 0.016 . 2 . . . . 39 LEU CD1|CD2 . 18589 1
434 . 1 1 39 39 LEU CD2 C 13 26.3771 0 . 2 . . . . 39 LEU CD2|CD1 . 18589 1
435 . 1 1 39 39 LEU N N 15 117.6323 0.002 . 1 . . . . 39 LEU N . 18589 1
436 . 1 1 40 40 GLU H H 1 7.8839 0.001 . 1 . . . . 40 GLU HN . 18589 1
437 . 1 1 40 40 GLU HA H 1 3.9572 0.002 . 1 . . . . 40 GLU HA . 18589 1
438 . 1 1 40 40 GLU HB2 H 1 2.1176 0.003 . 2 . . . . 40 GLU HB1|HB2 . 18589 1
439 . 1 1 40 40 GLU HB3 H 1 2.1925 0.003 . 2 . . . . 40 GLU HB2|HB1 . 18589 1
440 . 1 1 40 40 GLU HG2 H 1 2.1956 0.003 . 2 . . . . 40 GLU HG1|HG2 . 18589 1
441 . 1 1 40 40 GLU HG3 H 1 2.4528 0.001 . 2 . . . . 40 GLU HG2|HG1 . 18589 1
442 . 1 1 40 40 GLU C C 13 179.5789 0 . 1 . . . . 40 GLU C . 18589 1
443 . 1 1 40 40 GLU CA C 13 59.743 0.053 . 1 . . . . 40 GLU CA . 18589 1
444 . 1 1 40 40 GLU CB C 13 29.7707 0.046 . 1 . . . . 40 GLU CB . 18589 1
445 . 1 1 40 40 GLU CG C 13 36.6622 0.063 . 1 . . . . 40 GLU CG . 18589 1
446 . 1 1 40 40 GLU N N 15 119.1213 0.006 . 1 . . . . 40 GLU N . 18589 1
447 . 1 1 41 41 LYS H H 1 7.867 0.001 . 1 . . . . 41 LYS HN . 18589 1
448 . 1 1 41 41 LYS HA H 1 4.1236 0.005 . 1 . . . . 41 LYS HA . 18589 1
449 . 1 1 41 41 LYS HB2 H 1 1.9098 0.004 . 2 . . . . 41 LYS HB1|HB2 . 18589 1
450 . 1 1 41 41 LYS HB3 H 1 1.774 0.004 . 2 . . . . 41 LYS HB2|HB1 . 18589 1
451 . 1 1 41 41 LYS HG2 H 1 1.4675 0.006 . 2 . . . . 41 LYS HG1|HG2 . 18589 1
452 . 1 1 41 41 LYS HG3 H 1 1.5369 0.005 . 2 . . . . 41 LYS HG2|HG1 . 18589 1
453 . 1 1 41 41 LYS HD2 H 1 1.6184 0.003 . 2 . . . . 41 LYS HD1|HD2 . 18589 1
454 . 1 1 41 41 LYS HD3 H 1 1.6884 0.007 . 2 . . . . 41 LYS HD2|HD1 . 18589 1
455 . 1 1 41 41 LYS HE2 H 1 2.9275 0.001 . 2 . . . . 41 LYS HE1|HE2 . 18589 1
456 . 1 1 41 41 LYS HE3 H 1 2.904 0.002 . 2 . . . . 41 LYS HE2|HE1 . 18589 1
457 . 1 1 41 41 LYS C C 13 178.6057 0.007 . 1 . . . . 41 LYS C . 18589 1
458 . 1 1 41 41 LYS CA C 13 59.2703 0.111 . 1 . . . . 41 LYS CA . 18589 1
459 . 1 1 41 41 LYS CB C 13 32.2078 0.102 . 1 . . . . 41 LYS CB . 18589 1
460 . 1 1 41 41 LYS CG C 13 25.1221 0.017 . 1 . . . . 41 LYS CG . 18589 1
461 . 1 1 41 41 LYS CD C 13 29.205 0.021 . 1 . . . . 41 LYS CD . 18589 1
462 . 1 1 41 41 LYS CE C 13 42.2517 0.09 . 1 . . . . 41 LYS CE . 18589 1
463 . 1 1 41 41 LYS N N 15 121.66 0.01 . 1 . . . . 41 LYS N . 18589 1
464 . 1 1 42 42 LEU H H 1 8.7879 0.001 . 1 . . . . 42 LEU HN . 18589 1
465 . 1 1 42 42 LEU HA H 1 3.8927 0.003 . 1 . . . . 42 LEU HA . 18589 1
466 . 1 1 42 42 LEU HB2 H 1 1.0962 0.004 . 2 . . . . 42 LEU HB1|HB2 . 18589 1
467 . 1 1 42 42 LEU HB3 H 1 1.9117 0.004 . 2 . . . . 42 LEU HB2|HB1 . 18589 1
468 . 1 1 42 42 LEU HG H 1 1.8672 0.007 . 1 . . . . 42 LEU HG . 18589 1
469 . 1 1 42 42 LEU HD11 H 1 0.8392 0.006 . 2 . . . . 42 LEU HD1#|HD2# . 18589 1
470 . 1 1 42 42 LEU HD12 H 1 0.8392 0.006 . 2 . . . . 42 LEU HD1#|HD2# . 18589 1
471 . 1 1 42 42 LEU HD13 H 1 0.8392 0.006 . 2 . . . . 42 LEU HD1#|HD2# . 18589 1
472 . 1 1 42 42 LEU HD21 H 1 0.7259 0.004 . 2 . . . . 42 LEU HD2#|HD1# . 18589 1
473 . 1 1 42 42 LEU HD22 H 1 0.7259 0.004 . 2 . . . . 42 LEU HD2#|HD1# . 18589 1
474 . 1 1 42 42 LEU HD23 H 1 0.7259 0.004 . 2 . . . . 42 LEU HD2#|HD1# . 18589 1
475 . 1 1 42 42 LEU C C 13 179.6993 0.006 . 1 . . . . 42 LEU C . 18589 1
476 . 1 1 42 42 LEU CA C 13 57.9654 0.037 . 1 . . . . 42 LEU CA . 18589 1
477 . 1 1 42 42 LEU CB C 13 42.9512 0.024 . 1 . . . . 42 LEU CB . 18589 1
478 . 1 1 42 42 LEU CG C 13 27.026 0.053 . 1 . . . . 42 LEU CG . 18589 1
479 . 1 1 42 42 LEU CD1 C 13 23.5911 0.065 . 2 . . . . 42 LEU CD1|CD2 . 18589 1
480 . 1 1 42 42 LEU CD2 C 13 25.1505 0.057 . 2 . . . . 42 LEU CD2|CD1 . 18589 1
481 . 1 1 42 42 LEU N N 15 119.0199 0.005 . 1 . . . . 42 LEU N . 18589 1
482 . 1 1 43 43 GLU H H 1 8.3924 0.015 . 1 . . . . 43 GLU HN . 18589 1
483 . 1 1 43 43 GLU HA H 1 4.155 0.003 . 1 . . . . 43 GLU HA . 18589 1
484 . 1 1 43 43 GLU HB2 H 1 2.0923 0.003 . 2 . . . . 43 GLU HB1|HB2 . 18589 1
485 . 1 1 43 43 GLU HB3 H 1 1.9442 0.003 . 2 . . . . 43 GLU HB2|HB1 . 18589 1
486 . 1 1 43 43 GLU HG2 H 1 2.3456 0.002 . 2 . . . . 43 GLU HG1|HG2 . 18589 1
487 . 1 1 43 43 GLU HG3 H 1 2.1863 0.002 . 2 . . . . 43 GLU HG2|HG1 . 18589 1
488 . 1 1 43 43 GLU C C 13 180.4151 0.035 . 1 . . . . 43 GLU C . 18589 1
489 . 1 1 43 43 GLU CA C 13 59.4537 0.058 . 1 . . . . 43 GLU CA . 18589 1
490 . 1 1 43 43 GLU CB C 13 29.816 0.019 . 1 . . . . 43 GLU CB . 18589 1
491 . 1 1 43 43 GLU CG C 13 36.688 0.007 . 1 . . . . 43 GLU CG . 18589 1
492 . 1 1 43 43 GLU N N 15 121.204 0.064 . 1 . . . . 43 GLU N . 18589 1
493 . 1 1 44 44 ALA H H 1 8.0964 0.001 . 1 . . . . 44 ALA HN . 18589 1
494 . 1 1 44 44 ALA HA H 1 4.1625 0.001 . 1 . . . . 44 ALA HA . 18589 1
495 . 1 1 44 44 ALA HB1 H 1 1.5728 0.001 . 2 . . . . 44 ALA HB# . 18589 1
496 . 1 1 44 44 ALA HB2 H 1 1.5728 0.001 . 2 . . . . 44 ALA HB# . 18589 1
497 . 1 1 44 44 ALA HB3 H 1 1.5728 0.001 . 2 . . . . 44 ALA HB# . 18589 1
498 . 1 1 44 44 ALA C C 13 179.9313 0.004 . 1 . . . . 44 ALA C . 18589 1
499 . 1 1 44 44 ALA CA C 13 55.1913 0.051 . 1 . . . . 44 ALA CA . 18589 1
500 . 1 1 44 44 ALA CB C 13 17.9147 0.026 . 1 . . . . 44 ALA CB . 18589 1
501 . 1 1 44 44 ALA N N 15 125.1261 0.004 . 1 . . . . 44 ALA N . 18589 1
502 . 1 1 45 45 MET H H 1 7.9568 0.001 . 1 . . . . 45 MET HN . 18589 1
503 . 1 1 45 45 MET HA H 1 4.3343 0.003 . 1 . . . . 45 MET HA . 18589 1
504 . 1 1 45 45 MET HB2 H 1 2.3517 0.003 . 2 . . . . 45 MET HB1|HB2 . 18589 1
505 . 1 1 45 45 MET HB3 H 1 1.9548 0.003 . 2 . . . . 45 MET HB2|HB1 . 18589 1
506 . 1 1 45 45 MET HG2 H 1 2.5565 0.003 . 2 . . . . 45 MET HG1|HG2 . 18589 1
507 . 1 1 45 45 MET HG3 H 1 2.865 0.002 . 2 . . . . 45 MET HG2|HG1 . 18589 1
508 . 1 1 45 45 MET C C 13 176.3966 0.001 . 1 . . . . 45 MET C . 18589 1
509 . 1 1 45 45 MET CA C 13 56.3656 0.012 . 1 . . . . 45 MET CA . 18589 1
510 . 1 1 45 45 MET CB C 13 35.1653 0.062 . 1 . . . . 45 MET CB . 18589 1
511 . 1 1 45 45 MET CG C 13 32.3124 0.008 . 1 . . . . 45 MET CG . 18589 1
512 . 1 1 45 45 MET N N 15 113.9938 0.008 . 1 . . . . 45 MET N . 18589 1
513 . 1 1 46 46 GLY H H 1 8.0031 0.001 . 1 . . . . 46 GLY HN . 18589 1
514 . 1 1 46 46 GLY HA2 H 1 3.9852 0.001 . 2 . . . . 46 GLY HA1|HA2 . 18589 1
515 . 1 1 46 46 GLY HA3 H 1 4.1288 0.001 . 2 . . . . 46 GLY HA2|HA1 . 18589 1
516 . 1 1 46 46 GLY C C 13 175.1493 0 . 1 . . . . 46 GLY C . 18589 1
517 . 1 1 46 46 GLY CA C 13 45.7256 0.03 . 1 . . . . 46 GLY CA . 18589 1
518 . 1 1 46 46 GLY N N 15 107.9732 0.006 . 1 . . . . 46 GLY N . 18589 1
519 . 1 1 47 47 ARG H H 1 8.1445 0.001 . 1 . . . . 47 ARG HN . 18589 1
520 . 1 1 47 47 ARG HA H 1 4.1022 0.006 . 1 . . . . 47 ARG HA . 18589 1
521 . 1 1 47 47 ARG HB2 H 1 1.4895 0.005 . 2 . . . . 47 ARG HB1|HB2 . 18589 1
522 . 1 1 47 47 ARG HB3 H 1 2.2043 0.005 . 2 . . . . 47 ARG HB2|HB1 . 18589 1
523 . 1 1 47 47 ARG HG2 H 1 1.704 0.007 . 2 . . . . 47 ARG HG1|HG2 . 18589 1
524 . 1 1 47 47 ARG HG3 H 1 1.6173 0.009 . 2 . . . . 47 ARG HG2|HG1 . 18589 1
525 . 1 1 47 47 ARG HD2 H 1 3.3813 0.003 . 2 . . . . 47 ARG HD1|HD2 . 18589 1
526 . 1 1 47 47 ARG HD3 H 1 3.0252 0.005 . 2 . . . . 47 ARG HD2|HD1 . 18589 1
527 . 1 1 47 47 ARG C C 13 176.0018 0.002 . 1 . . . . 47 ARG C . 18589 1
528 . 1 1 47 47 ARG CA C 13 57.9047 0.042 . 1 . . . . 47 ARG CA . 18589 1
529 . 1 1 47 47 ARG CB C 13 32.6196 0.017 . 1 . . . . 47 ARG CB . 18589 1
530 . 1 1 47 47 ARG CG C 13 27.6211 0.023 . 1 . . . . 47 ARG CG . 18589 1
531 . 1 1 47 47 ARG CD C 13 43.5591 0.022 . 1 . . . . 47 ARG CD . 18589 1
532 . 1 1 47 47 ARG N N 15 117.9494 0.003 . 1 . . . . 47 ARG N . 18589 1
533 . 1 1 48 48 ILE H H 1 6.8141 0.001 . 1 . . . . 48 ILE HN . 18589 1
534 . 1 1 48 48 ILE HA H 1 4.6267 0.002 . 1 . . . . 48 ILE HA . 18589 1
535 . 1 1 48 48 ILE HB H 1 1.8444 0.003 . 1 . . . . 48 ILE HB . 18589 1
536 . 1 1 48 48 ILE HG12 H 1 0.5036 0.002 . 2 . . . . 48 ILE HG12 . 18589 1
537 . 1 1 48 48 ILE HG13 H 1 0.9238 0.005 . 2 . . . . 48 ILE HG13 . 18589 1
538 . 1 1 48 48 ILE HG21 H 1 0.3234 0.002 . 2 . . . . 48 ILE HG2# . 18589 1
539 . 1 1 48 48 ILE HG22 H 1 0.3234 0.002 . 2 . . . . 48 ILE HG2# . 18589 1
540 . 1 1 48 48 ILE HG23 H 1 0.3234 0.002 . 2 . . . . 48 ILE HG2# . 18589 1
541 . 1 1 48 48 ILE HD11 H 1 0.7781 0.002 . 2 . . . . 48 ILE HD1# . 18589 1
542 . 1 1 48 48 ILE HD12 H 1 0.7781 0.002 . 2 . . . . 48 ILE HD1# . 18589 1
543 . 1 1 48 48 ILE HD13 H 1 0.7781 0.002 . 2 . . . . 48 ILE HD1# . 18589 1
544 . 1 1 48 48 ILE C C 13 174.2421 0.008 . 1 . . . . 48 ILE C . 18589 1
545 . 1 1 48 48 ILE CA C 13 58.5968 0.039 . 1 . . . . 48 ILE CA . 18589 1
546 . 1 1 48 48 ILE CB C 13 41.9767 0.027 . 1 . . . . 48 ILE CB . 18589 1
547 . 1 1 48 48 ILE CG1 C 13 24.82 0.012 . 1 . . . . 48 ILE CG1 . 18589 1
548 . 1 1 48 48 ILE CG2 C 13 14.176 0.029 . 1 . . . . 48 ILE CG2 . 18589 1
549 . 1 1 48 48 ILE CD1 C 13 18.58 0.036 . 1 . . . . 48 ILE CD1 . 18589 1
550 . 1 1 48 48 ILE N N 15 107.1464 0.005 . 1 . . . . 48 ILE N . 18589 1
551 . 1 1 49 49 LYS H H 1 8.6317 0.011 . 1 . . . . 49 LYS HN . 18589 1
552 . 1 1 49 49 LYS HA H 1 4.4432 0.003 . 1 . . . . 49 LYS HA . 18589 1
553 . 1 1 49 49 LYS HB2 H 1 1.6797 0.005 . 2 . . . . 49 LYS HB1|HB2 . 18589 1
554 . 1 1 49 49 LYS HB3 H 1 1.7773 0.002 . 2 . . . . 49 LYS HB2|HB1 . 18589 1
555 . 1 1 49 49 LYS HG2 H 1 1.4233 0.004 . 2 . . . . 49 LYS HG1|HG2 . 18589 1
556 . 1 1 49 49 LYS HG3 H 1 1.3846 0.003 . 2 . . . . 49 LYS HG2|HG1 . 18589 1
557 . 1 1 49 49 LYS HE2 H 1 2.9615 0.002 . 2 . . . . 49 LYS HE1|HE2 . 18589 1
558 . 1 1 49 49 LYS C C 13 176.1944 0.002 . 1 . . . . 49 LYS C . 18589 1
559 . 1 1 49 49 LYS CA C 13 55.4285 0.097 . 1 . . . . 49 LYS CA . 18589 1
560 . 1 1 49 49 LYS CB C 13 33.8679 0.018 . 1 . . . . 49 LYS CB . 18589 1
561 . 1 1 49 49 LYS CG C 13 24.8026 0.034 . 1 . . . . 49 LYS CG . 18589 1
562 . 1 1 49 49 LYS CD C 13 29.0777 0 . 1 . . . . 49 LYS CD . 18589 1
563 . 1 1 49 49 LYS CE C 13 42.3151 0.001 . 1 . . . . 49 LYS CE . 18589 1
564 . 1 1 49 49 LYS N N 15 121.7309 0.077 . 1 . . . . 49 LYS N . 18589 1
565 . 1 1 50 50 ARG H H 1 8.7195 0.001 . 1 . . . . 50 ARG HN . 18589 1
566 . 1 1 50 50 ARG HA H 1 4.289 0.005 . 1 . . . . 50 ARG HA . 18589 1
567 . 1 1 50 50 ARG HB2 H 1 1.7515 0.002 . 2 . . . . 50 ARG HB1|HB2 . 18589 1
568 . 1 1 50 50 ARG HB3 H 1 1.8315 0 . 2 . . . . 50 ARG HB2|HB1 . 18589 1
569 . 1 1 50 50 ARG HG2 H 1 1.6785 0.003 . 2 . . . . 50 ARG HG1|HG2 . 18589 1
570 . 1 1 50 50 ARG HG3 H 1 1.6291 0.001 . 2 . . . . 50 ARG HG2|HG1 . 18589 1
571 . 1 1 50 50 ARG C C 13 176.6875 0.063 . 1 . . . . 50 ARG C . 18589 1
572 . 1 1 50 50 ARG CA C 13 56.56 0.015 . 1 . . . . 50 ARG CA . 18589 1
573 . 1 1 50 50 ARG CB C 13 30.8695 0.034 . 1 . . . . 50 ARG CB . 18589 1
574 . 1 1 50 50 ARG CG C 13 27.1917 0.067 . 1 . . . . 50 ARG CG . 18589 1
575 . 1 1 50 50 ARG CD C 13 43.0691 0 . 1 . . . . 50 ARG CD . 18589 1
576 . 1 1 50 50 ARG N N 15 123.9814 0.006 . 1 . . . . 50 ARG N . 18589 1
577 . 1 1 51 51 ARG H H 1 8.534 0.001 . 1 . . . . 51 ARG HN . 18589 1
578 . 1 1 51 51 ARG C C 13 176.4286 0 . 1 . . . . 51 ARG C . 18589 1
579 . 1 1 51 51 ARG CA C 13 56.5435 0 . 1 . . . . 51 ARG CA . 18589 1
580 . 1 1 51 51 ARG CB C 13 31.1119 0 . 1 . . . . 51 ARG CB . 18589 1
581 . 1 1 51 51 ARG N N 15 124.0216 0 . 1 . . . . 51 ARG N . 18589 1
582 . 1 1 61 61 LEU H H 1 8.4448 0.011 . 1 . . . . 61 LEU HN . 18589 1
583 . 1 1 61 61 LEU HA H 1 4.6083 0.003 . 1 . . . . 61 LEU HA . 18589 1
584 . 1 1 61 61 LEU HB2 H 1 1.7147 0.007 . 2 . . . . 61 LEU HB1|HB2 . 18589 1
585 . 1 1 61 61 LEU HB3 H 1 1.3851 0.007 . 2 . . . . 61 LEU HB2|HB1 . 18589 1
586 . 1 1 61 61 LEU HG H 1 1.6745 0.001 . 1 . . . . 61 LEU HG . 18589 1
587 . 1 1 61 61 LEU HD11 H 1 0.737 0.006 . 2 . . . . 61 LEU HD1#|HD2# . 18589 1
588 . 1 1 61 61 LEU HD12 H 1 0.737 0.006 . 2 . . . . 61 LEU HD1#|HD2# . 18589 1
589 . 1 1 61 61 LEU HD13 H 1 0.737 0.006 . 2 . . . . 61 LEU HD1#|HD2# . 18589 1
590 . 1 1 61 61 LEU HD21 H 1 0.8819 0.002 . 2 . . . . 61 LEU HD2#|HD1# . 18589 1
591 . 1 1 61 61 LEU HD22 H 1 0.8819 0.002 . 2 . . . . 61 LEU HD2#|HD1# . 18589 1
592 . 1 1 61 61 LEU HD23 H 1 0.8819 0.002 . 2 . . . . 61 LEU HD2#|HD1# . 18589 1
593 . 1 1 61 61 LEU C C 13 177.4687 0.015 . 1 . . . . 61 LEU C . 18589 1
594 . 1 1 61 61 LEU CA C 13 54.7969 0.047 . 1 . . . . 61 LEU CA . 18589 1
595 . 1 1 61 61 LEU CB C 13 43.245 0.038 . 1 . . . . 61 LEU CB . 18589 1
596 . 1 1 61 61 LEU CG C 13 27.3305 0 . 1 . . . . 61 LEU CG . 18589 1
597 . 1 1 61 61 LEU CD1 C 13 24.2053 0 . 2 . . . . 61 LEU CD1|CD2 . 18589 1
598 . 1 1 61 61 LEU CD2 C 13 26.57 0 . 2 . . . . 61 LEU CD2|CD1 . 18589 1
599 . 1 1 61 61 LEU N N 15 124.7599 0.14 . 1 . . . . 61 LEU N . 18589 1
600 . 1 1 62 62 THR H H 1 9.1217 0.006 . 1 . . . . 62 THR HN . 18589 1
601 . 1 1 62 62 THR HA H 1 4.4722 0.005 . 1 . . . . 62 THR HA . 18589 1
602 . 1 1 62 62 THR HB H 1 4.8236 0.001 . 1 . . . . 62 THR HB . 18589 1
603 . 1 1 62 62 THR HG21 H 1 1.3369 0 . 2 . . . . 62 THR HG2# . 18589 1
604 . 1 1 62 62 THR HG22 H 1 1.3369 0 . 2 . . . . 62 THR HG2# . 18589 1
605 . 1 1 62 62 THR HG23 H 1 1.3369 0 . 2 . . . . 62 THR HG2# . 18589 1
606 . 1 1 62 62 THR C C 13 175.1811 0.019 . 1 . . . . 62 THR C . 18589 1
607 . 1 1 62 62 THR CA C 13 60.3848 0.044 . 1 . . . . 62 THR CA . 18589 1
608 . 1 1 62 62 THR CB C 13 71.3824 0.023 . 1 . . . . 62 THR CB . 18589 1
609 . 1 1 62 62 THR N N 15 115.1793 0.173 . 1 . . . . 62 THR N . 18589 1
610 . 1 1 63 63 GLU H H 1 9.0554 0.004 . 1 . . . . 63 GLU HN . 18589 1
611 . 1 1 63 63 GLU HA H 1 3.9876 0 . 1 . . . . 63 GLU HA . 18589 1
612 . 1 1 63 63 GLU C C 13 179.5072 0.017 . 1 . . . . 63 GLU C . 18589 1
613 . 1 1 63 63 GLU CA C 13 60.1544 0.11 . 1 . . . . 63 GLU CA . 18589 1
614 . 1 1 63 63 GLU CB C 13 28.981 0.016 . 1 . . . . 63 GLU CB . 18589 1
615 . 1 1 63 63 GLU N N 15 120.1586 0.098 . 1 . . . . 63 GLU N . 18589 1
616 . 1 1 64 64 GLU H H 1 8.7256 0.007 . 1 . . . . 64 GLU HN . 18589 1
617 . 1 1 64 64 GLU HA H 1 4.1212 0.002 . 1 . . . . 64 GLU HA . 18589 1
618 . 1 1 64 64 GLU HB2 H 1 2.0944 0.006 . 2 . . . . 64 GLU HB1|HB2 . 18589 1
619 . 1 1 64 64 GLU HB3 H 1 1.9556 0.003 . 2 . . . . 64 GLU HB2|HB1 . 18589 1
620 . 1 1 64 64 GLU HG2 H 1 2.3713 0.006 . 2 . . . . 64 GLU HG1|HG2 . 18589 1
621 . 1 1 64 64 GLU HG3 H 1 2.2945 0.004 . 2 . . . . 64 GLU HG2|HG1 . 18589 1
622 . 1 1 64 64 GLU C C 13 179.3815 0.014 . 1 . . . . 64 GLU C . 18589 1
623 . 1 1 64 64 GLU CA C 13 59.8974 0.046 . 1 . . . . 64 GLU CA . 18589 1
624 . 1 1 64 64 GLU CB C 13 29.1765 0.066 . 1 . . . . 64 GLU CB . 18589 1
625 . 1 1 64 64 GLU CG C 13 37.1957 0 . 1 . . . . 64 GLU CG . 18589 1
626 . 1 1 64 64 GLU N N 15 119.6318 0.128 . 1 . . . . 64 GLU N . 18589 1
627 . 1 1 65 65 GLU H H 1 7.9328 0.003 . 1 . . . . 65 GLU HN . 18589 1
628 . 1 1 65 65 GLU HA H 1 3.9217 0.004 . 1 . . . . 65 GLU HA . 18589 1
629 . 1 1 65 65 GLU HB2 H 1 1.7636 0.004 . 2 . . . . 65 GLU HB1|HB2 . 18589 1
630 . 1 1 65 65 GLU HB3 H 1 2.4402 0.015 . 2 . . . . 65 GLU HB2|HB1 . 18589 1
631 . 1 1 65 65 GLU HG2 H 1 2.4826 0.005 . 2 . . . . 65 GLU HG1|HG2 . 18589 1
632 . 1 1 65 65 GLU HG3 H 1 2.14 0.004 . 2 . . . . 65 GLU HG2|HG1 . 18589 1
633 . 1 1 65 65 GLU C C 13 178.9267 0.009 . 1 . . . . 65 GLU C . 18589 1
634 . 1 1 65 65 GLU CA C 13 60.0914 0.088 . 1 . . . . 65 GLU CA . 18589 1
635 . 1 1 65 65 GLU CB C 13 30.7536 0.023 . 1 . . . . 65 GLU CB . 18589 1
636 . 1 1 65 65 GLU CG C 13 38.4614 0.029 . 1 . . . . 65 GLU CG . 18589 1
637 . 1 1 65 65 GLU N N 15 121.3811 0.117 . 1 . . . . 65 GLU N . 18589 1
638 . 1 1 66 66 LEU H H 1 8.4089 0.01 . 1 . . . . 66 LEU HN . 18589 1
639 . 1 1 66 66 LEU HA H 1 3.8822 0.004 . 1 . . . . 66 LEU HA . 18589 1
640 . 1 1 66 66 LEU HB2 H 1 1.4996 0.006 . 2 . . . . 66 LEU HB1|HB2 . 18589 1
641 . 1 1 66 66 LEU HB3 H 1 1.9581 0.005 . 2 . . . . 66 LEU HB2|HB1 . 18589 1
642 . 1 1 66 66 LEU HG H 1 1.6885 0.002 . 1 . . . . 66 LEU HG . 18589 1
643 . 1 1 66 66 LEU HD21 H 1 0.8443 0.003 . 2 . . . . 66 LEU HD2#|HD1# . 18589 1
644 . 1 1 66 66 LEU HD22 H 1 0.8443 0.003 . 2 . . . . 66 LEU HD2#|HD1# . 18589 1
645 . 1 1 66 66 LEU HD23 H 1 0.8443 0.003 . 2 . . . . 66 LEU HD2#|HD1# . 18589 1
646 . 1 1 66 66 LEU C C 13 178.168 0.017 . 1 . . . . 66 LEU C . 18589 1
647 . 1 1 66 66 LEU CA C 13 58.612 0.071 . 1 . . . . 66 LEU CA . 18589 1
648 . 1 1 66 66 LEU CB C 13 41.6965 0.092 . 1 . . . . 66 LEU CB . 18589 1
649 . 1 1 66 66 LEU CD2 C 13 25.6325 0 . 2 . . . . 66 LEU CD2|CD1 . 18589 1
650 . 1 1 66 66 LEU N N 15 118.7304 0.131 . 1 . . . . 66 LEU N . 18589 1
651 . 1 1 67 67 ALA H H 1 7.9543 0.004 . 1 . . . . 67 ALA HN . 18589 1
652 . 1 1 67 67 ALA HA H 1 4.1015 0.003 . 1 . . . . 67 ALA HA . 18589 1
653 . 1 1 67 67 ALA HB1 H 1 1.5478 0.002 . 2 . . . . 67 ALA HB# . 18589 1
654 . 1 1 67 67 ALA HB2 H 1 1.5478 0.002 . 2 . . . . 67 ALA HB# . 18589 1
655 . 1 1 67 67 ALA HB3 H 1 1.5478 0.002 . 2 . . . . 67 ALA HB# . 18589 1
656 . 1 1 67 67 ALA C C 13 180.6553 0.007 . 1 . . . . 67 ALA C . 18589 1
657 . 1 1 67 67 ALA CA C 13 55.2576 0.016 . 1 . . . . 67 ALA CA . 18589 1
658 . 1 1 67 67 ALA CB C 13 17.8101 0.015 . 1 . . . . 67 ALA CB . 18589 1
659 . 1 1 67 67 ALA N N 15 120.2153 0.11 . 1 . . . . 67 ALA N . 18589 1
660 . 1 1 68 68 THR H H 1 8.081 0.005 . 1 . . . . 68 THR HN . 18589 1
661 . 1 1 68 68 THR HA H 1 3.9747 0.004 . 1 . . . . 68 THR HA . 18589 1
662 . 1 1 68 68 THR HB H 1 4.3553 0.004 . 1 . . . . 68 THR HB . 18589 1
663 . 1 1 68 68 THR HG21 H 1 1.2232 0.006 . 2 . . . . 68 THR HG2# . 18589 1
664 . 1 1 68 68 THR HG22 H 1 1.2232 0.006 . 2 . . . . 68 THR HG2# . 18589 1
665 . 1 1 68 68 THR HG23 H 1 1.2232 0.006 . 2 . . . . 68 THR HG2# . 18589 1
666 . 1 1 68 68 THR C C 13 175.5246 0.024 . 1 . . . . 68 THR C . 18589 1
667 . 1 1 68 68 THR CA C 13 66.9628 0.143 . 1 . . . . 68 THR CA . 18589 1
668 . 1 1 68 68 THR CB C 13 68.6315 0.159 . 1 . . . . 68 THR CB . 18589 1
669 . 1 1 68 68 THR CG2 C 13 21.6418 0 . 1 . . . . 68 THR CG2 . 18589 1
670 . 1 1 68 68 THR N N 15 117.8672 0.139 . 1 . . . . 68 THR N . 18589 1
671 . 1 1 69 69 ILE H H 1 8.51 0.004 . 1 . . . . 69 ILE HN . 18589 1
672 . 1 1 69 69 ILE HA H 1 3.3727 0.001 . 1 . . . . 69 ILE HA . 18589 1
673 . 1 1 69 69 ILE HB H 1 1.9138 0.004 . 1 . . . . 69 ILE HB . 18589 1
674 . 1 1 69 69 ILE HG12 H 1 1.9028 0.002 . 2 . . . . 69 ILE HG12 . 18589 1
675 . 1 1 69 69 ILE HG13 H 1 0.6744 0.003 . 2 . . . . 69 ILE HG13 . 18589 1
676 . 1 1 69 69 ILE HG21 H 1 0.716 0.005 . 2 . . . . 69 ILE HG2# . 18589 1
677 . 1 1 69 69 ILE HG22 H 1 0.716 0.005 . 2 . . . . 69 ILE HG2# . 18589 1
678 . 1 1 69 69 ILE HG23 H 1 0.716 0.005 . 2 . . . . 69 ILE HG2# . 18589 1
679 . 1 1 69 69 ILE HD11 H 1 0.6475 0.004 . 2 . . . . 69 ILE HD1# . 18589 1
680 . 1 1 69 69 ILE HD12 H 1 0.6475 0.004 . 2 . . . . 69 ILE HD1# . 18589 1
681 . 1 1 69 69 ILE HD13 H 1 0.6475 0.004 . 2 . . . . 69 ILE HD1# . 18589 1
682 . 1 1 69 69 ILE C C 13 176.3742 0.027 . 1 . . . . 69 ILE C . 18589 1
683 . 1 1 69 69 ILE CA C 13 66.6637 0.066 . 1 . . . . 69 ILE CA . 18589 1
684 . 1 1 69 69 ILE CB C 13 37.9331 0.033 . 1 . . . . 69 ILE CB . 18589 1
685 . 1 1 69 69 ILE CG1 C 13 30.1432 0 . 1 . . . . 69 ILE CG1 . 18589 1
686 . 1 1 69 69 ILE CG2 C 13 16.9867 0 . 1 . . . . 69 ILE CG2 . 18589 1
687 . 1 1 69 69 ILE CD1 C 13 15.1423 0 . 1 . . . . 69 ILE CD1 . 18589 1
688 . 1 1 69 69 ILE N N 15 121.638 0.145 . 1 . . . . 69 ILE N . 18589 1
689 . 1 1 70 70 ARG H H 1 7.9521 0.006 . 1 . . . . 70 ARG HN . 18589 1
690 . 1 1 70 70 ARG HA H 1 3.6871 0.004 . 1 . . . . 70 ARG HA . 18589 1
691 . 1 1 70 70 ARG HB2 H 1 1.8638 0.002 . 2 . . . . 70 ARG HB1|HB2 . 18589 1
692 . 1 1 70 70 ARG HB3 H 1 2.0526 0.003 . 2 . . . . 70 ARG HB2|HB1 . 18589 1
693 . 1 1 70 70 ARG HG2 H 1 1.643 0.003 . 2 . . . . 70 ARG HG1|HG2 . 18589 1
694 . 1 1 70 70 ARG HG3 H 1 1.6075 0.011 . 2 . . . . 70 ARG HG2|HG1 . 18589 1
695 . 1 1 70 70 ARG HD2 H 1 3.3179 0.002 . 2 . . . . 70 ARG HD1|HD2 . 18589 1
696 . 1 1 70 70 ARG HD3 H 1 3.2584 0.001 . 2 . . . . 70 ARG HD2|HD1 . 18589 1
697 . 1 1 70 70 ARG C C 13 176.9028 0.013 . 1 . . . . 70 ARG C . 18589 1
698 . 1 1 70 70 ARG CA C 13 60.0889 0.034 . 1 . . . . 70 ARG CA . 18589 1
699 . 1 1 70 70 ARG CB C 13 30.1451 0.063 . 1 . . . . 70 ARG CB . 18589 1
700 . 1 1 70 70 ARG CG C 13 27.8922 0 . 1 . . . . 70 ARG CG . 18589 1
701 . 1 1 70 70 ARG CD C 13 43.5182 0 . 1 . . . . 70 ARG CD . 18589 1
702 . 1 1 70 70 ARG N N 15 117.6735 0.143 . 1 . . . . 70 ARG N . 18589 1
703 . 1 1 71 71 GLU H H 1 7.9814 0.019 . 1 . . . . 71 GLU HN . 18589 1
704 . 1 1 71 71 GLU C C 13 179.5644 0 . 1 . . . . 71 GLU C . 18589 1
705 . 1 1 71 71 GLU CA C 13 59.3676 0.013 . 1 . . . . 71 GLU CA . 18589 1
706 . 1 1 71 71 GLU CB C 13 29.613 0.041 . 1 . . . . 71 GLU CB . 18589 1
707 . 1 1 71 71 GLU CG C 13 35.9066 0 . 1 . . . . 71 GLU CG . 18589 1
708 . 1 1 71 71 GLU N N 15 117.0654 0.114 . 1 . . . . 71 GLU N . 18589 1
709 . 1 1 72 72 LEU H H 1 8.5762 0.003 . 1 . . . . 72 LEU HN . 18589 1
710 . 1 1 72 72 LEU HA H 1 3.9983 0.003 . 1 . . . . 72 LEU HA . 18589 1
711 . 1 1 72 72 LEU HB2 H 1 1.8548 0.008 . 2 . . . . 72 LEU HB1|HB2 . 18589 1
712 . 1 1 72 72 LEU HB3 H 1 1.1937 0.008 . 2 . . . . 72 LEU HB2|HB1 . 18589 1
713 . 1 1 72 72 LEU HG H 1 1.9856 0.004 . 1 . . . . 72 LEU HG . 18589 1
714 . 1 1 72 72 LEU HD11 H 1 0.7417 0.002 . 2 . . . . 72 LEU HD1#|HD2# . 18589 1
715 . 1 1 72 72 LEU HD12 H 1 0.7417 0.002 . 2 . . . . 72 LEU HD1#|HD2# . 18589 1
716 . 1 1 72 72 LEU HD13 H 1 0.7417 0.002 . 2 . . . . 72 LEU HD1#|HD2# . 18589 1
717 . 1 1 72 72 LEU HD21 H 1 0.8359 0.004 . 2 . . . . 72 LEU HD2#|HD1# . 18589 1
718 . 1 1 72 72 LEU HD22 H 1 0.8359 0.004 . 2 . . . . 72 LEU HD2#|HD1# . 18589 1
719 . 1 1 72 72 LEU HD23 H 1 0.8359 0.004 . 2 . . . . 72 LEU HD2#|HD1# . 18589 1
720 . 1 1 72 72 LEU C C 13 179.2891 0.025 . 1 . . . . 72 LEU C . 18589 1
721 . 1 1 72 72 LEU CA C 13 57.6629 0.036 . 1 . . . . 72 LEU CA . 18589 1
722 . 1 1 72 72 LEU CB C 13 42.3801 0.083 . 1 . . . . 72 LEU CB . 18589 1
723 . 1 1 72 72 LEU CG C 13 26.9461 0 . 1 . . . . 72 LEU CG . 18589 1
724 . 1 1 72 72 LEU CD1 C 13 26.393 0 . 2 . . . . 72 LEU CD1|CD2 . 18589 1
725 . 1 1 72 72 LEU CD2 C 13 22.0177 0 . 2 . . . . 72 LEU CD2|CD1 . 18589 1
726 . 1 1 72 72 LEU N N 15 117.5039 0.119 . 1 . . . . 72 LEU N . 18589 1
727 . 1 1 73 73 TYR H H 1 8.7076 0.014 . 1 . . . . 73 TYR HN . 18589 1
728 . 1 1 73 73 TYR HA H 1 4.2227 0.001 . 1 . . . . 73 TYR HA . 18589 1
729 . 1 1 73 73 TYR HB2 H 1 2.9393 0.002 . 2 . . . . 73 TYR HB1|HB2 . 18589 1
730 . 1 1 73 73 TYR HB3 H 1 2.9883 0.003 . 2 . . . . 73 TYR HB2|HB1 . 18589 1
731 . 1 1 73 73 TYR HD1 H 1 6.8647 0.001 . 2 . . . . 73 TYR HD# . 18589 1
732 . 1 1 73 73 TYR HD2 H 1 6.8647 0.001 . 2 . . . . 73 TYR HD# . 18589 1
733 . 1 1 73 73 TYR HE1 H 1 7.1566 0.003 . 2 . . . . 73 TYR HE# . 18589 1
734 . 1 1 73 73 TYR HE2 H 1 7.1566 0.003 . 2 . . . . 73 TYR HE# . 18589 1
735 . 1 1 73 73 TYR C C 13 180.5112 0.029 . 1 . . . . 73 TYR C . 18589 1
736 . 1 1 73 73 TYR CA C 13 62.0193 0.017 . 1 . . . . 73 TYR CA . 18589 1
737 . 1 1 73 73 TYR CB C 13 38.8162 0.095 . 1 . . . . 73 TYR CB . 18589 1
738 . 1 1 73 73 TYR CD1 C 13 133.1805 0 . 2 . . . . 73 TYR CD* . 18589 1
739 . 1 1 73 73 TYR CD2 C 13 133.1805 0 . 2 . . . . 73 TYR CD* . 18589 1
740 . 1 1 73 73 TYR CE1 C 13 118.4935 0.001 . 2 . . . . 73 TYR CE* . 18589 1
741 . 1 1 73 73 TYR CE2 C 13 118.4935 0.001 . 2 . . . . 73 TYR CE* . 18589 1
742 . 1 1 73 73 TYR N N 15 120.8345 0.155 . 1 . . . . 73 TYR N . 18589 1
743 . 1 1 74 74 LEU H H 1 8.5831 0.002 . 1 . . . . 74 LEU HN . 18589 1
744 . 1 1 74 74 LEU HA H 1 4.0747 0.004 . 1 . . . . 74 LEU HA . 18589 1
745 . 1 1 74 74 LEU HB2 H 1 1.5404 0.009 . 2 . . . . 74 LEU HB1|HB2 . 18589 1
746 . 1 1 74 74 LEU HB3 H 1 2.0513 0.011 . 2 . . . . 74 LEU HB2|HB1 . 18589 1
747 . 1 1 74 74 LEU HG H 1 2.0777 0.002 . 1 . . . . 74 LEU HG . 18589 1
748 . 1 1 74 74 LEU HD11 H 1 0.9941 0.006 . 2 . . . . 74 LEU HD1#|HD2# . 18589 1
749 . 1 1 74 74 LEU HD12 H 1 0.9941 0.006 . 2 . . . . 74 LEU HD1#|HD2# . 18589 1
750 . 1 1 74 74 LEU HD13 H 1 0.9941 0.006 . 2 . . . . 74 LEU HD1#|HD2# . 18589 1
751 . 1 1 74 74 LEU HD21 H 1 0.9507 0.004 . 2 . . . . 74 LEU HD2#|HD1# . 18589 1
752 . 1 1 74 74 LEU HD22 H 1 0.9507 0.004 . 2 . . . . 74 LEU HD2#|HD1# . 18589 1
753 . 1 1 74 74 LEU HD23 H 1 0.9507 0.004 . 2 . . . . 74 LEU HD2#|HD1# . 18589 1
754 . 1 1 74 74 LEU C C 13 178.9302 0.016 . 1 . . . . 74 LEU C . 18589 1
755 . 1 1 74 74 LEU CA C 13 57.6736 0.123 . 1 . . . . 74 LEU CA . 18589 1
756 . 1 1 74 74 LEU CB C 13 41.2024 0.043 . 1 . . . . 74 LEU CB . 18589 1
757 . 1 1 74 74 LEU CG C 13 27.018 0 . 1 . . . . 74 LEU CG . 18589 1
758 . 1 1 74 74 LEU CD1 C 13 22.3302 0 . 2 . . . . 74 LEU CD1|CD2 . 18589 1
759 . 1 1 74 74 LEU CD2 C 13 25.7679 0 . 2 . . . . 74 LEU CD2|CD1 . 18589 1
760 . 1 1 74 74 LEU N N 15 120.3325 0.137 . 1 . . . . 74 LEU N . 18589 1
761 . 1 1 75 75 LYS H H 1 7.5305 0.01 . 1 . . . . 75 LYS HN . 18589 1
762 . 1 1 75 75 LYS HA H 1 4.3231 0.005 . 1 . . . . 75 LYS HA . 18589 1
763 . 1 1 75 75 LYS HB2 H 1 1.9712 0.005 . 2 . . . . 75 LYS HB1|HB2 . 18589 1
764 . 1 1 75 75 LYS HG2 H 1 1.6629 0.004 . 2 . . . . 75 LYS HG1|HG2 . 18589 1
765 . 1 1 75 75 LYS HD2 H 1 1.675 0.008 . 2 . . . . 75 LYS HD1|HD2 . 18589 1
766 . 1 1 75 75 LYS HE2 H 1 2.9864 0.008 . 2 . . . . 75 LYS HE1|HE2 . 18589 1
767 . 1 1 75 75 LYS C C 13 176.7738 0.037 . 1 . . . . 75 LYS C . 18589 1
768 . 1 1 75 75 LYS CA C 13 56.7227 0.089 . 1 . . . . 75 LYS CA . 18589 1
769 . 1 1 75 75 LYS CB C 13 32.7543 0.059 . 1 . . . . 75 LYS CB . 18589 1
770 . 1 1 75 75 LYS CG C 13 25.3847 0.079 . 1 . . . . 75 LYS CG . 18589 1
771 . 1 1 75 75 LYS CD C 13 29.5483 0.107 . 1 . . . . 75 LYS CD . 18589 1
772 . 1 1 75 75 LYS CE C 13 41.2875 0 . 1 . . . . 75 LYS CE . 18589 1
773 . 1 1 75 75 LYS N N 15 117.3208 0.149 . 1 . . . . 75 LYS N . 18589 1
774 . 1 1 76 76 GLY H H 1 7.6489 0.004 . 1 . . . . 76 GLY HN . 18589 1
775 . 1 1 76 76 GLY HA2 H 1 3.5042 0.019 . 2 . . . . 76 GLY HA1|HA2 . 18589 1
776 . 1 1 76 76 GLY HA3 H 1 4.2142 0.004 . 2 . . . . 76 GLY HA2|HA1 . 18589 1
777 . 1 1 76 76 GLY C C 13 174.6603 0 . 1 . . . . 76 GLY C . 18589 1
778 . 1 1 76 76 GLY CA C 13 45.2054 0.032 . 1 . . . . 76 GLY CA . 18589 1
779 . 1 1 76 76 GLY N N 15 106.636 0.099 . 1 . . . . 76 GLY N . 18589 1
780 . 1 1 77 77 ALA H H 1 7.8315 0.014 . 1 . . . . 77 ALA HN . 18589 1
781 . 1 1 77 77 ALA HA H 1 4.4417 0.003 . 1 . . . . 77 ALA HA . 18589 1
782 . 1 1 77 77 ALA HB1 H 1 1.2369 0.003 . 2 . . . . 77 ALA HB# . 18589 1
783 . 1 1 77 77 ALA HB2 H 1 1.2369 0.003 . 2 . . . . 77 ALA HB# . 18589 1
784 . 1 1 77 77 ALA HB3 H 1 1.2369 0.003 . 2 . . . . 77 ALA HB# . 18589 1
785 . 1 1 77 77 ALA C C 13 177.3798 0.009 . 1 . . . . 77 ALA C . 18589 1
786 . 1 1 77 77 ALA CA C 13 52.3018 0.039 . 1 . . . . 77 ALA CA . 18589 1
787 . 1 1 77 77 ALA CB C 13 19.7875 0.043 . 1 . . . . 77 ALA CB . 18589 1
788 . 1 1 77 77 ALA N N 15 123.7614 0.124 . 1 . . . . 77 ALA N . 18589 1
789 . 1 1 78 78 THR H H 1 8.3572 0.013 . 1 . . . . 78 THR HN . 18589 1
790 . 1 1 78 78 THR HA H 1 4.4784 0.001 . 1 . . . . 78 THR HA . 18589 1
791 . 1 1 78 78 THR HB H 1 4.7686 0.005 . 1 . . . . 78 THR HB . 18589 1
792 . 1 1 78 78 THR HG21 H 1 1.3829 0 . 2 . . . . 78 THR HG2# . 18589 1
793 . 1 1 78 78 THR HG22 H 1 1.3829 0 . 2 . . . . 78 THR HG2# . 18589 1
794 . 1 1 78 78 THR HG23 H 1 1.3829 0 . 2 . . . . 78 THR HG2# . 18589 1
795 . 1 1 78 78 THR C C 13 175.573 0.025 . 1 . . . . 78 THR C . 18589 1
796 . 1 1 78 78 THR CA C 13 60.2018 0.037 . 1 . . . . 78 THR CA . 18589 1
797 . 1 1 78 78 THR CB C 13 71.1599 0.098 . 1 . . . . 78 THR CB . 18589 1
798 . 1 1 78 78 THR N N 15 110.5566 0.106 . 1 . . . . 78 THR N . 18589 1
799 . 1 1 79 79 VAL H H 1 8.8673 0.005 . 1 . . . . 79 VAL HN . 18589 1
800 . 1 1 79 79 VAL HA H 1 3.3748 0.001 . 1 . . . . 79 VAL HA . 18589 1
801 . 1 1 79 79 VAL HB H 1 1.9274 0.003 . 1 . . . . 79 VAL HB . 18589 1
802 . 1 1 79 79 VAL HG11 H 1 0.8312 0.008 . 2 . . . . 79 VAL HG1#|HG2# . 18589 1
803 . 1 1 79 79 VAL HG12 H 1 0.8312 0.008 . 2 . . . . 79 VAL HG1#|HG2# . 18589 1
804 . 1 1 79 79 VAL HG13 H 1 0.8312 0.008 . 2 . . . . 79 VAL HG1#|HG2# . 18589 1
805 . 1 1 79 79 VAL HG21 H 1 0.4572 0.006 . 2 . . . . 79 VAL HG2#|HG1# . 18589 1
806 . 1 1 79 79 VAL HG22 H 1 0.4572 0.006 . 2 . . . . 79 VAL HG2#|HG1# . 18589 1
807 . 1 1 79 79 VAL HG23 H 1 0.4572 0.006 . 2 . . . . 79 VAL HG2#|HG1# . 18589 1
808 . 1 1 79 79 VAL C C 13 177.0029 0.026 . 1 . . . . 79 VAL C . 18589 1
809 . 1 1 79 79 VAL CA C 13 67.8718 0.066 . 1 . . . . 79 VAL CA . 18589 1
810 . 1 1 79 79 VAL CB C 13 30.4557 0 . 1 . . . . 79 VAL CB . 18589 1
811 . 1 1 79 79 VAL CG1 C 13 23.2678 0 . 2 . . . . 79 VAL CG1|CG2 . 18589 1
812 . 1 1 79 79 VAL CG2 C 13 20.4551 0 . 2 . . . . 79 VAL CG2|CG1 . 18589 1
813 . 1 1 79 79 VAL N N 15 120.2793 0.124 . 1 . . . . 79 VAL N . 18589 1
814 . 1 1 80 80 TYR H H 1 8.0952 0.004 . 1 . . . . 80 TYR HN . 18589 1
815 . 1 1 80 80 TYR HA H 1 4.0692 0.004 . 1 . . . . 80 TYR HA . 18589 1
816 . 1 1 80 80 TYR HB2 H 1 2.9133 0.005 . 2 . . . . 80 TYR HB1|HB2 . 18589 1
817 . 1 1 80 80 TYR HB3 H 1 3.2028 0.002 . 2 . . . . 80 TYR HB2|HB1 . 18589 1
818 . 1 1 80 80 TYR HD1 H 1 7.1561 0.002 . 2 . . . . 80 TYR HD# . 18589 1
819 . 1 1 80 80 TYR HD2 H 1 7.1561 0.002 . 2 . . . . 80 TYR HD# . 18589 1
820 . 1 1 80 80 TYR HE1 H 1 6.8569 0.001 . 2 . . . . 80 TYR HE# . 18589 1
821 . 1 1 80 80 TYR HE2 H 1 6.8569 0.001 . 2 . . . . 80 TYR HE# . 18589 1
822 . 1 1 80 80 TYR C C 13 177.3718 0.002 . 1 . . . . 80 TYR C . 18589 1
823 . 1 1 80 80 TYR CA C 13 61.3231 0.073 . 1 . . . . 80 TYR CA . 18589 1
824 . 1 1 80 80 TYR CB C 13 38.2897 0.038 . 1 . . . . 80 TYR CB . 18589 1
825 . 1 1 80 80 TYR CD1 C 13 133.1805 0 . 2 . . . . 80 TYR CD* . 18589 1
826 . 1 1 80 80 TYR CD2 C 13 133.1805 0 . 2 . . . . 80 TYR CD* . 18589 1
827 . 1 1 80 80 TYR CE1 C 13 118.0472 0 . 2 . . . . 80 TYR CE* . 18589 1
828 . 1 1 80 80 TYR CE2 C 13 118.0472 0 . 2 . . . . 80 TYR CE* . 18589 1
829 . 1 1 80 80 TYR N N 15 117.9043 0.165 . 1 . . . . 80 TYR N . 18589 1
830 . 1 1 81 81 GLU H H 1 7.7466 0.005 . 1 . . . . 81 GLU HN . 18589 1
831 . 1 1 81 81 GLU HA H 1 3.8639 0.002 . 1 . . . . 81 GLU HA . 18589 1
832 . 1 1 81 81 GLU HB2 H 1 2.3794 0.002 . 2 . . . . 81 GLU HB1|HB2 . 18589 1
833 . 1 1 81 81 GLU HB3 H 1 2.0194 0.003 . 2 . . . . 81 GLU HB2|HB1 . 18589 1
834 . 1 1 81 81 GLU HG2 H 1 2.4322 0.001 . 2 . . . . 81 GLU HG1|HG2 . 18589 1
835 . 1 1 81 81 GLU HG3 H 1 2.3961 0.001 . 2 . . . . 81 GLU HG2|HG1 . 18589 1
836 . 1 1 81 81 GLU C C 13 179.5528 0.004 . 1 . . . . 81 GLU C . 18589 1
837 . 1 1 81 81 GLU CA C 13 58.8687 0.034 . 1 . . . . 81 GLU CA . 18589 1
838 . 1 1 81 81 GLU CB C 13 29.8339 0.074 . 1 . . . . 81 GLU CB . 18589 1
839 . 1 1 81 81 GLU CG C 13 36.8831 0 . 1 . . . . 81 GLU CG . 18589 1
840 . 1 1 81 81 GLU N N 15 119.5617 0.172 . 1 . . . . 81 GLU N . 18589 1
841 . 1 1 82 82 ILE H H 1 8.6027 0.003 . 1 . . . . 82 ILE HN . 18589 1
842 . 1 1 82 82 ILE HA H 1 3.3863 0.009 . 1 . . . . 82 ILE HA . 18589 1
843 . 1 1 82 82 ILE HB H 1 1.8097 0.005 . 1 . . . . 82 ILE HB . 18589 1
844 . 1 1 82 82 ILE HG12 H 1 0.7782 0.003 . 2 . . . . 82 ILE HG12 . 18589 1
845 . 1 1 82 82 ILE HG13 H 1 2.0477 0.003 . 2 . . . . 82 ILE HG13 . 18589 1
846 . 1 1 82 82 ILE HG21 H 1 0.8588 0.003 . 2 . . . . 82 ILE HG2# . 18589 1
847 . 1 1 82 82 ILE HG22 H 1 0.8588 0.003 . 2 . . . . 82 ILE HG2# . 18589 1
848 . 1 1 82 82 ILE HG23 H 1 0.8588 0.003 . 2 . . . . 82 ILE HG2# . 18589 1
849 . 1 1 82 82 ILE HD11 H 1 0.8022 0.002 . 2 . . . . 82 ILE HD1# . 18589 1
850 . 1 1 82 82 ILE HD12 H 1 0.8022 0.002 . 2 . . . . 82 ILE HD1# . 18589 1
851 . 1 1 82 82 ILE HD13 H 1 0.8022 0.002 . 2 . . . . 82 ILE HD1# . 18589 1
852 . 1 1 82 82 ILE C C 13 177.0901 0.024 . 1 . . . . 82 ILE C . 18589 1
853 . 1 1 82 82 ILE CA C 13 66.0602 0.053 . 1 . . . . 82 ILE CA . 18589 1
854 . 1 1 82 82 ILE CB C 13 38.5548 0.053 . 1 . . . . 82 ILE CB . 18589 1
855 . 1 1 82 82 ILE CG1 C 13 28.8931 0 . 1 . . . . 82 ILE CG1 . 18589 1
856 . 1 1 82 82 ILE CG2 C 13 19.3821 0 . 1 . . . . 82 ILE CG2 . 18589 1
857 . 1 1 82 82 ILE CD1 C 13 13.2672 0 . 1 . . . . 82 ILE CD1 . 18589 1
858 . 1 1 82 82 ILE N N 15 120.8322 0.15 . 1 . . . . 82 ILE N . 18589 1
859 . 1 1 83 83 ALA H H 1 8.6313 0.003 . 1 . . . . 83 ALA HN . 18589 1
860 . 1 1 83 83 ALA HA H 1 3.6255 0.013 . 1 . . . . 83 ALA HA . 18589 1
861 . 1 1 83 83 ALA HB1 H 1 1.4963 0.004 . 2 . . . . 83 ALA HB# . 18589 1
862 . 1 1 83 83 ALA HB2 H 1 1.4963 0.004 . 2 . . . . 83 ALA HB# . 18589 1
863 . 1 1 83 83 ALA HB3 H 1 1.4963 0.004 . 2 . . . . 83 ALA HB# . 18589 1
864 . 1 1 83 83 ALA C C 13 179.5527 0.011 . 1 . . . . 83 ALA C . 18589 1
865 . 1 1 83 83 ALA CA C 13 56.1455 0.059 . 1 . . . . 83 ALA CA . 18589 1
866 . 1 1 83 83 ALA CB C 13 18.0045 0.022 . 1 . . . . 83 ALA CB . 18589 1
867 . 1 1 83 83 ALA N N 15 121.6114 0.161 . 1 . . . . 83 ALA N . 18589 1
868 . 1 1 84 84 ARG H H 1 7.8543 0.004 . 1 . . . . 84 ARG HN . 18589 1
869 . 1 1 84 84 ARG HA H 1 3.9382 0.009 . 1 . . . . 84 ARG HA . 18589 1
870 . 1 1 84 84 ARG HB2 H 1 1.6255 0.005 . 2 . . . . 84 ARG HB1|HB2 . 18589 1
871 . 1 1 84 84 ARG HB3 H 1 1.8014 0.004 . 2 . . . . 84 ARG HB2|HB1 . 18589 1
872 . 1 1 84 84 ARG HG2 H 1 1.5186 0.004 . 2 . . . . 84 ARG HG1|HG2 . 18589 1
873 . 1 1 84 84 ARG HG3 H 1 1.4407 0.003 . 2 . . . . 84 ARG HG2|HG1 . 18589 1
874 . 1 1 84 84 ARG HD2 H 1 2.9757 0.003 . 2 . . . . 84 ARG HD1|HD2 . 18589 1
875 . 1 1 84 84 ARG HD3 H 1 3.0999 0.004 . 2 . . . . 84 ARG HD2|HD1 . 18589 1
876 . 1 1 84 84 ARG C C 13 179.4188 0.031 . 1 . . . . 84 ARG C . 18589 1
877 . 1 1 84 84 ARG CA C 13 58.6094 0.04 . 1 . . . . 84 ARG CA . 18589 1
878 . 1 1 84 84 ARG CB C 13 29.5431 0.077 . 1 . . . . 84 ARG CB . 18589 1
879 . 1 1 84 84 ARG CG C 13 26.6851 0.058 . 1 . . . . 84 ARG CG . 18589 1
880 . 1 1 84 84 ARG CD C 13 42.9565 0 . 1 . . . . 84 ARG CD . 18589 1
881 . 1 1 84 84 ARG N N 15 116.3321 0.11 . 1 . . . . 84 ARG N . 18589 1
882 . 1 1 85 85 GLN H H 1 8.0702 0.005 . 1 . . . . 85 GLN HN . 18589 1
883 . 1 1 85 85 GLN HA H 1 3.9917 0.003 . 1 . . . . 85 GLN HA . 18589 1
884 . 1 1 85 85 GLN HB2 H 1 1.989 0.004 . 2 . . . . 85 GLN HB1|HB2 . 18589 1
885 . 1 1 85 85 GLN HB3 H 1 2.1258 0.006 . 2 . . . . 85 GLN HB2|HB1 . 18589 1
886 . 1 1 85 85 GLN HG2 H 1 2.2872 0.004 . 2 . . . . 85 GLN HG1|HG2 . 18589 1
887 . 1 1 85 85 GLN HG3 H 1 2.4307 0.003 . 2 . . . . 85 GLN HG2|HG1 . 18589 1
888 . 1 1 85 85 GLN C C 13 177.8232 0.015 . 1 . . . . 85 GLN C . 18589 1
889 . 1 1 85 85 GLN CA C 13 58.9383 0.038 . 1 . . . . 85 GLN CA . 18589 1
890 . 1 1 85 85 GLN CB C 13 27.9584 0.008 . 1 . . . . 85 GLN CB . 18589 1
891 . 1 1 85 85 GLN CG C 13 33.8777 0.05 . 1 . . . . 85 GLN CG . 18589 1
892 . 1 1 85 85 GLN N N 15 119.0563 0.137 . 1 . . . . 85 GLN N . 18589 1
893 . 1 1 86 86 LEU H H 1 8.1201 0.005 . 1 . . . . 86 LEU HN . 18589 1
894 . 1 1 86 86 LEU HA H 1 4.3441 0.031 . 1 . . . . 86 LEU HA . 18589 1
895 . 1 1 86 86 LEU HB2 H 1 1.1161 0.185 . 2 . . . . 86 LEU HB1|HB2 . 18589 1
896 . 1 1 86 86 LEU HB3 H 1 1.3814 0.124 . 2 . . . . 86 LEU HB2|HB1 . 18589 1
897 . 1 1 86 86 LEU HG H 1 1.4586 0.004 . 1 . . . . 86 LEU HG . 18589 1
898 . 1 1 86 86 LEU HD11 H 1 0.8494 0.006 . 2 . . . . 86 LEU HD1#|HD2# . 18589 1
899 . 1 1 86 86 LEU HD12 H 1 0.8494 0.006 . 2 . . . . 86 LEU HD1#|HD2# . 18589 1
900 . 1 1 86 86 LEU HD13 H 1 0.8494 0.006 . 2 . . . . 86 LEU HD1#|HD2# . 18589 1
901 . 1 1 86 86 LEU HD21 H 1 0.742 0.003 . 2 . . . . 86 LEU HD2#|HD1# . 18589 1
902 . 1 1 86 86 LEU HD22 H 1 0.742 0.003 . 2 . . . . 86 LEU HD2#|HD1# . 18589 1
903 . 1 1 86 86 LEU HD23 H 1 0.742 0.003 . 2 . . . . 86 LEU HD2#|HD1# . 18589 1
904 . 1 1 86 86 LEU C C 13 177.6666 0.031 . 1 . . . . 86 LEU C . 18589 1
905 . 1 1 86 86 LEU CA C 13 54.6889 0 . 1 . . . . 86 LEU CA . 18589 1
906 . 1 1 86 86 LEU CB C 13 41.6509 0.08 . 1 . . . . 86 LEU CB . 18589 1
907 . 1 1 86 86 LEU CG C 13 26.7055 0 . 1 . . . . 86 LEU CG . 18589 1
908 . 1 1 86 86 LEU CD1 C 13 22.6428 0 . 2 . . . . 86 LEU CD1|CD2 . 18589 1
909 . 1 1 86 86 LEU CD2 C 13 26.0805 0 . 2 . . . . 86 LEU CD2|CD1 . 18589 1
910 . 1 1 86 86 LEU N N 15 116.864 0.158 . 1 . . . . 86 LEU N . 18589 1
911 . 1 1 87 87 GLY H H 1 8.0153 0.005 . 1 . . . . 87 GLY HN . 18589 1
912 . 1 1 87 87 GLY HA2 H 1 3.8799 0.004 . 2 . . . . 87 GLY HA1|HA2 . 18589 1
913 . 1 1 87 87 GLY HA3 H 1 3.9226 0.001 . 2 . . . . 87 GLY HA2|HA1 . 18589 1
914 . 1 1 87 87 GLY C C 13 174.6086 0 . 1 . . . . 87 GLY C . 18589 1
915 . 1 1 87 87 GLY CA C 13 46.9225 0.017 . 1 . . . . 87 GLY CA . 18589 1
916 . 1 1 87 87 GLY N N 15 110.7694 0.169 . 1 . . . . 87 GLY N . 18589 1
917 . 1 1 88 88 ARG H H 1 7.9084 0.008 . 1 . . . . 88 ARG HN . 18589 1
918 . 1 1 88 88 ARG HA H 1 4.9031 0.005 . 1 . . . . 88 ARG HA . 18589 1
919 . 1 1 88 88 ARG HB2 H 1 1.2443 0.004 . 2 . . . . 88 ARG HB1|HB2 . 18589 1
920 . 1 1 88 88 ARG HB3 H 1 1.7876 0.005 . 2 . . . . 88 ARG HB2|HB1 . 18589 1
921 . 1 1 88 88 ARG HG2 H 1 1.4008 0.007 . 2 . . . . 88 ARG HG1|HG2 . 18589 1
922 . 1 1 88 88 ARG HG3 H 1 1.6562 0.005 . 2 . . . . 88 ARG HG2|HG1 . 18589 1
923 . 1 1 88 88 ARG HD2 H 1 2.9969 0.006 . 2 . . . . 88 ARG HD1|HD2 . 18589 1
924 . 1 1 88 88 ARG HD3 H 1 3.3194 0.004 . 2 . . . . 88 ARG HD2|HD1 . 18589 1
925 . 1 1 88 88 ARG C C 13 182.4137 0 . 1 . . . . 88 ARG C . 18589 1
926 . 1 1 88 88 ARG CA C 13 51.0864 0 . 1 . . . . 88 ARG CA . 18589 1
927 . 1 1 88 88 ARG CB C 13 33.8867 0.023 . 1 . . . . 88 ARG CB . 18589 1
928 . 1 1 88 88 ARG CG C 13 26.7055 0 . 1 . . . . 88 ARG CG . 18589 1
929 . 1 1 88 88 ARG CD C 13 43.269 0 . 1 . . . . 88 ARG CD . 18589 1
930 . 1 1 88 88 ARG N N 15 116.8841 0.14 . 1 . . . . 88 ARG N . 18589 1
931 . 1 1 90 90 GLU CA C 13 61.276 0 . 1 . . . . 90 GLU CA . 18589 1
932 . 1 1 91 91 SER H H 1 8.8071 0.011 . 1 . . . . 91 SER HN . 18589 1
933 . 1 1 91 91 SER HB2 H 1 4.2907 0.003 . 2 . . . . 91 SER HB1|HB2 . 18589 1
934 . 1 1 91 91 SER HB3 H 1 4.0019 0 . 2 . . . . 91 SER HB2|HB1 . 18589 1
935 . 1 1 91 91 SER C C 13 177.3292 0 . 1 . . . . 91 SER C . 18589 1
936 . 1 1 91 91 SER CA C 13 61.3951 0 . 1 . . . . 91 SER CA . 18589 1
937 . 1 1 91 91 SER N N 15 112.2491 0.109 . 1 . . . . 91 SER N . 18589 1
938 . 1 1 92 92 THR H H 1 7.3495 0.012 . 1 . . . . 92 THR HN . 18589 1
939 . 1 1 92 92 THR HA H 1 4.1589 0.016 . 1 . . . . 92 THR HA . 18589 1
940 . 1 1 92 92 THR HB H 1 4.222 0.002 . 1 . . . . 92 THR HB . 18589 1
941 . 1 1 92 92 THR HG21 H 1 1.2932 0.006 . 2 . . . . 92 THR HG2# . 18589 1
942 . 1 1 92 92 THR HG22 H 1 1.2932 0.006 . 2 . . . . 92 THR HG2# . 18589 1
943 . 1 1 92 92 THR HG23 H 1 1.2932 0.006 . 2 . . . . 92 THR HG2# . 18589 1
944 . 1 1 92 92 THR C C 13 175.4275 0.015 . 1 . . . . 92 THR C . 18589 1
945 . 1 1 92 92 THR CA C 13 66.0311 0.043 . 1 . . . . 92 THR CA . 18589 1
946 . 1 1 92 92 THR CB C 13 68.5197 0.11 . 1 . . . . 92 THR CB . 18589 1
947 . 1 1 92 92 THR CG2 C 13 22.8198 0 . 1 . . . . 92 THR CG2 . 18589 1
948 . 1 1 92 92 THR N N 15 119.5993 0.157 . 1 . . . . 92 THR N . 18589 1
949 . 1 1 93 93 ILE H H 1 7.4604 0.005 . 1 . . . . 93 ILE HN . 18589 1
950 . 1 1 93 93 ILE HA H 1 3.6703 0.008 . 1 . . . . 93 ILE HA . 18589 1
951 . 1 1 93 93 ILE HB H 1 2.2941 0.004 . 1 . . . . 93 ILE HB . 18589 1
952 . 1 1 93 93 ILE HG12 H 1 1.8108 0.005 . 2 . . . . 93 ILE HG12 . 18589 1
953 . 1 1 93 93 ILE HG13 H 1 0.9941 0.008 . 2 . . . . 93 ILE HG13 . 18589 1
954 . 1 1 93 93 ILE HG21 H 1 0.8186 0.006 . 2 . . . . 93 ILE HG2# . 18589 1
955 . 1 1 93 93 ILE HG22 H 1 0.8186 0.006 . 2 . . . . 93 ILE HG2# . 18589 1
956 . 1 1 93 93 ILE HG23 H 1 0.8186 0.006 . 2 . . . . 93 ILE HG2# . 18589 1
957 . 1 1 93 93 ILE HD11 H 1 0.4947 0.005 . 2 . . . . 93 ILE HD1# . 18589 1
958 . 1 1 93 93 ILE HD12 H 1 0.4947 0.005 . 2 . . . . 93 ILE HD1# . 18589 1
959 . 1 1 93 93 ILE HD13 H 1 0.4947 0.005 . 2 . . . . 93 ILE HD1# . 18589 1
960 . 1 1 93 93 ILE C C 13 177.5597 0.009 . 1 . . . . 93 ILE C . 18589 1
961 . 1 1 93 93 ILE CA C 13 61.7078 0.012 . 1 . . . . 93 ILE CA . 18589 1
962 . 1 1 93 93 ILE CB C 13 33.5547 0.052 . 1 . . . . 93 ILE CB . 18589 1
963 . 1 1 93 93 ILE CG1 C 13 26.393 0 . 1 . . . . 93 ILE CG1 . 18589 1
964 . 1 1 93 93 ILE CG2 C 13 18.2675 0 . 1 . . . . 93 ILE CG2 . 18589 1
965 . 1 1 93 93 ILE CD1 C 13 9.0689 0 . 1 . . . . 93 ILE CD1 . 18589 1
966 . 1 1 93 93 ILE N N 15 120.8474 0.143 . 1 . . . . 93 ILE N . 18589 1
967 . 1 1 94 94 TYR H H 1 8.6057 0.003 . 1 . . . . 94 TYR HN . 18589 1
968 . 1 1 94 94 TYR HA H 1 4.0692 0.004 . 1 . . . . 94 TYR HA . 18589 1
969 . 1 1 94 94 TYR HB2 H 1 3.074 0 . 2 . . . . 94 TYR HB1|HB2 . 18589 1
970 . 1 1 94 94 TYR HB3 H 1 2.9194 0.005 . 2 . . . . 94 TYR HB2|HB1 . 18589 1
971 . 1 1 94 94 TYR C C 13 178.4823 0 . 1 . . . . 94 TYR C . 18589 1
972 . 1 1 94 94 TYR CA C 13 63.2195 0.041 . 1 . . . . 94 TYR CA . 18589 1
973 . 1 1 94 94 TYR CB C 13 37.937 0.031 . 1 . . . . 94 TYR CB . 18589 1
974 . 1 1 94 94 TYR N N 15 118.9886 0.109 . 1 . . . . 94 TYR N . 18589 1
975 . 1 1 95 95 TYR H H 1 7.8286 0.012 . 1 . . . . 95 TYR HN . 18589 1
976 . 1 1 95 95 TYR HA H 1 4.2286 0.002 . 1 . . . . 95 TYR HA . 18589 1
977 . 1 1 95 95 TYR HB2 H 1 3.2118 0.002 . 2 . . . . 95 TYR HB1|HB2 . 18589 1
978 . 1 1 95 95 TYR HB3 H 1 3.2632 0.001 . 2 . . . . 95 TYR HB2|HB1 . 18589 1
979 . 1 1 95 95 TYR C C 13 177.3052 0.036 . 1 . . . . 95 TYR C . 18589 1
980 . 1 1 95 95 TYR CA C 13 61.3602 0.061 . 1 . . . . 95 TYR CA . 18589 1
981 . 1 1 95 95 TYR CB C 13 37.6437 0 . 1 . . . . 95 TYR CB . 18589 1
982 . 1 1 95 95 TYR N N 15 118.6124 0.124 . 1 . . . . 95 TYR N . 18589 1
983 . 1 1 96 96 ALA H H 1 8.1535 0.005 . 1 . . . . 96 ALA HN . 18589 1
984 . 1 1 96 96 ALA HA H 1 3.705 0.003 . 1 . . . . 96 ALA HA . 18589 1
985 . 1 1 96 96 ALA HB1 H 1 1.4899 0.001 . 2 . . . . 96 ALA HB# . 18589 1
986 . 1 1 96 96 ALA HB2 H 1 1.4899 0.001 . 2 . . . . 96 ALA HB# . 18589 1
987 . 1 1 96 96 ALA HB3 H 1 1.4899 0.001 . 2 . . . . 96 ALA HB# . 18589 1
988 . 1 1 96 96 ALA C C 13 178.8696 0.001 . 1 . . . . 96 ALA C . 18589 1
989 . 1 1 96 96 ALA CA C 13 54.8691 0.083 . 1 . . . . 96 ALA CA . 18589 1
990 . 1 1 96 96 ALA CB C 13 19.2592 0.058 . 1 . . . . 96 ALA CB . 18589 1
991 . 1 1 96 96 ALA N N 15 122.6105 0.137 . 1 . . . . 96 ALA N . 18589 1
992 . 1 1 97 97 LEU H H 1 8.3872 0.004 . 1 . . . . 97 LEU HN . 18589 1
993 . 1 1 97 97 LEU HA H 1 3.7118 0 . 1 . . . . 97 LEU HA . 18589 1
994 . 1 1 97 97 LEU HB2 H 1 1.7788 0 . 2 . . . . 97 LEU HB1|HB2 . 18589 1
995 . 1 1 97 97 LEU HB3 H 1 1.0997 0 . 2 . . . . 97 LEU HB2|HB1 . 18589 1
996 . 1 1 97 97 LEU HD21 H 1 0.4205 0 . 2 . . . . 97 LEU HD2#|HD1# . 18589 1
997 . 1 1 97 97 LEU HD22 H 1 0.4205 0 . 2 . . . . 97 LEU HD2#|HD1# . 18589 1
998 . 1 1 97 97 LEU HD23 H 1 0.4205 0 . 2 . . . . 97 LEU HD2#|HD1# . 18589 1
999 . 1 1 97 97 LEU C C 13 178.7947 0.012 . 1 . . . . 97 LEU C . 18589 1
1000 . 1 1 97 97 LEU CA C 13 58.1346 0.032 . 1 . . . . 97 LEU CA . 18589 1
1001 . 1 1 97 97 LEU CB C 13 40.8737 0.024 . 1 . . . . 97 LEU CB . 18589 1
1002 . 1 1 97 97 LEU N N 15 116.1268 0.113 . 1 . . . . 97 LEU N . 18589 1
1003 . 1 1 98 98 LYS H H 1 7.5557 0.01 . 1 . . . . 98 LYS HN . 18589 1
1004 . 1 1 98 98 LYS C C 13 180.5251 0.01 . 1 . . . . 98 LYS C . 18589 1
1005 . 1 1 98 98 LYS CA C 13 59.028 0.024 . 1 . . . . 98 LYS CA . 18589 1
1006 . 1 1 98 98 LYS CB C 13 31.7175 0 . 1 . . . . 98 LYS CB . 18589 1
1007 . 1 1 98 98 LYS N N 15 118.4938 0.201 . 1 . . . . 98 LYS N . 18589 1
1008 . 1 1 99 99 LYS H H 1 8.0376 0.002 . 1 . . . . 99 LYS HN . 18589 1
1009 . 1 1 99 99 LYS HA H 1 3.9049 0 . 1 . . . . 99 LYS HA . 18589 1
1010 . 1 1 99 99 LYS HB2 H 1 1.7834 0 . 2 . . . . 99 LYS HB1|HB2 . 18589 1
1011 . 1 1 99 99 LYS HB3 H 1 1.6129 0 . 2 . . . . 99 LYS HB2|HB1 . 18589 1
1012 . 1 1 99 99 LYS C C 13 178.7017 0.007 . 1 . . . . 99 LYS C . 18589 1
1013 . 1 1 99 99 LYS CA C 13 58.6317 0.01 . 1 . . . . 99 LYS CA . 18589 1
1014 . 1 1 99 99 LYS CB C 13 31.69 0.037 . 1 . . . . 99 LYS CB . 18589 1
1015 . 1 1 99 99 LYS N N 15 122.5104 0.111 . 1 . . . . 99 LYS N . 18589 1
1016 . 1 1 100 100 LEU H H 1 8.0611 0.005 . 1 . . . . 100 LEU HN . 18589 1
1017 . 1 1 100 100 LEU HA H 1 4.1539 0.003 . 1 . . . . 100 LEU HA . 18589 1
1018 . 1 1 100 100 LEU HB2 H 1 1.8037 0.009 . 2 . . . . 100 LEU HB1|HB2 . 18589 1
1019 . 1 1 100 100 LEU HB3 H 1 1.4691 0.006 . 2 . . . . 100 LEU HB2|HB1 . 18589 1
1020 . 1 1 100 100 LEU HD11 H 1 0.7511 0.001 . 2 . . . . 100 LEU HD1#|HD2# . 18589 1
1021 . 1 1 100 100 LEU HD12 H 1 0.7511 0.001 . 2 . . . . 100 LEU HD1#|HD2# . 18589 1
1022 . 1 1 100 100 LEU HD13 H 1 0.7511 0.001 . 2 . . . . 100 LEU HD1#|HD2# . 18589 1
1023 . 1 1 100 100 LEU HD21 H 1 0.893 0.004 . 2 . . . . 100 LEU HD2#|HD1# . 18589 1
1024 . 1 1 100 100 LEU HD22 H 1 0.893 0.004 . 2 . . . . 100 LEU HD2#|HD1# . 18589 1
1025 . 1 1 100 100 LEU HD23 H 1 0.893 0.004 . 2 . . . . 100 LEU HD2#|HD1# . 18589 1
1026 . 1 1 100 100 LEU C C 13 177.0441 0.011 . 1 . . . . 100 LEU C . 18589 1
1027 . 1 1 100 100 LEU CA C 13 55.2285 0.223 . 1 . . . . 100 LEU CA . 18589 1
1028 . 1 1 100 100 LEU CB C 13 43.6236 0.075 . 1 . . . . 100 LEU CB . 18589 1
1029 . 1 1 100 100 LEU N N 15 117.0316 0.133 . 1 . . . . 100 LEU N . 18589 1
1030 . 1 1 101 101 GLY H H 1 7.7889 0.005 . 1 . . . . 101 GLY HN . 18589 1
1031 . 1 1 101 101 GLY HA2 H 1 4.0009 0.003 . 2 . . . . 101 GLY HA1|HA2 . 18589 1
1032 . 1 1 101 101 GLY HA3 H 1 3.7768 0.002 . 2 . . . . 101 GLY HA2|HA1 . 18589 1
1033 . 1 1 101 101 GLY C C 13 174.4067 0 . 1 . . . . 101 GLY C . 18589 1
1034 . 1 1 101 101 GLY CA C 13 46.0572 0.153 . 1 . . . . 101 GLY CA . 18589 1
1035 . 1 1 101 101 GLY N N 15 108.0084 0.122 . 1 . . . . 101 GLY N . 18589 1
1036 . 1 1 102 102 LEU H H 1 7.7115 0.009 . 1 . . . . 102 LEU HN . 18589 1
1037 . 1 1 102 102 LEU HA H 1 4.3487 0 . 1 . . . . 102 LEU HA . 18589 1
1038 . 1 1 102 102 LEU C C 13 175.6482 0.031 . 1 . . . . 102 LEU C . 18589 1
1039 . 1 1 102 102 LEU CA C 13 53.9652 0.049 . 1 . . . . 102 LEU CA . 18589 1
1040 . 1 1 102 102 LEU CB C 13 41.7053 0.014 . 1 . . . . 102 LEU CB . 18589 1
1041 . 1 1 102 102 LEU N N 15 120.0336 0.198 . 1 . . . . 102 LEU N . 18589 1
1042 . 1 1 103 103 LYS H H 1 8.0488 0.008 . 1 . . . . 103 LYS HN . 18589 1
1043 . 1 1 103 103 LYS HA H 1 4.3045 0.003 . 1 . . . . 103 LYS HA . 18589 1
1044 . 1 1 103 103 LYS HG2 H 1 1.3535 0.002 . 2 . . . . 103 LYS HG1|HG2 . 18589 1
1045 . 1 1 103 103 LYS HG3 H 1 1.4463 0.002 . 2 . . . . 103 LYS HG2|HG1 . 18589 1
1046 . 1 1 103 103 LYS C C 13 176.1443 0.011 . 1 . . . . 103 LYS C . 18589 1
1047 . 1 1 103 103 LYS CA C 13 55.8407 0.033 . 1 . . . . 103 LYS CA . 18589 1
1048 . 1 1 103 103 LYS CB C 13 33.3555 0.005 . 1 . . . . 103 LYS CB . 18589 1
1049 . 1 1 103 103 LYS CG C 13 24.6753 0 . 1 . . . . 103 LYS CG . 18589 1
1050 . 1 1 103 103 LYS N N 15 120.846 0.174 . 1 . . . . 103 LYS N . 18589 1
1051 . 1 1 104 104 LEU H H 1 8.5365 0.011 . 1 . . . . 104 LEU HN . 18589 1
1052 . 1 1 104 104 LEU HA H 1 4.453 0.003 . 1 . . . . 104 LEU HA . 18589 1
1053 . 1 1 104 104 LEU HB2 H 1 1.6322 0.004 . 2 . . . . 104 LEU HB1|HB2 . 18589 1
1054 . 1 1 104 104 LEU HB3 H 1 1.5594 0.002 . 2 . . . . 104 LEU HB2|HB1 . 18589 1
1055 . 1 1 104 104 LEU HG H 1 1.6342 0.001 . 1 . . . . 104 LEU HG . 18589 1
1056 . 1 1 104 104 LEU HD11 H 1 0.8269 0.003 . 2 . . . . 104 LEU HD1#|HD2# . 18589 1
1057 . 1 1 104 104 LEU HD12 H 1 0.8269 0.003 . 2 . . . . 104 LEU HD1#|HD2# . 18589 1
1058 . 1 1 104 104 LEU HD13 H 1 0.8269 0.003 . 2 . . . . 104 LEU HD1#|HD2# . 18589 1
1059 . 1 1 104 104 LEU HD21 H 1 0.896 0.002 . 2 . . . . 104 LEU HD2#|HD1# . 18589 1
1060 . 1 1 104 104 LEU HD22 H 1 0.896 0.002 . 2 . . . . 104 LEU HD2#|HD1# . 18589 1
1061 . 1 1 104 104 LEU HD23 H 1 0.896 0.002 . 2 . . . . 104 LEU HD2#|HD1# . 18589 1
1062 . 1 1 104 104 LEU C C 13 176.8782 0.013 . 1 . . . . 104 LEU C . 18589 1
1063 . 1 1 104 104 LEU CA C 13 54.8632 0.028 . 1 . . . . 104 LEU CA . 18589 1
1064 . 1 1 104 104 LEU CB C 13 42.601 0.095 . 1 . . . . 104 LEU CB . 18589 1
1065 . 1 1 104 104 LEU CG C 13 27.5076 0 . 1 . . . . 104 LEU CG . 18589 1
1066 . 1 1 104 104 LEU CD1 C 13 23.8928 0 . 2 . . . . 104 LEU CD1|CD2 . 18589 1
1067 . 1 1 104 104 LEU CD2 C 13 25.1429 0 . 2 . . . . 104 LEU CD2|CD1 . 18589 1
1068 . 1 1 104 104 LEU N N 15 125.7934 0.13 . 1 . . . . 104 LEU N . 18589 1
1069 . 1 1 105 105 GLU H H 1 8.7306 0.015 . 1 . . . . 105 GLU HN . 18589 1
1070 . 1 1 105 105 GLU C C 13 176.0236 0 . 1 . . . . 105 GLU C . 18589 1
1071 . 1 1 105 105 GLU CA C 13 56.1088 0.034 . 1 . . . . 105 GLU CA . 18589 1
1072 . 1 1 105 105 GLU CB C 13 30.5757 0 . 1 . . . . 105 GLU CB . 18589 1
1073 . 1 1 105 105 GLU N N 15 121.547 0.134 . 1 . . . . 105 GLU N . 18589 1
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