Content for NMR-STAR saveframe, "assigned_chemical_shifts_2"
save_assigned_chemical_shifts_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2
_Assigned_chem_shift_list.Entry_ID 34869
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name .
_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 $chem_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' . . . 34869 2
2 '2D 1H-13C HSQC' . . . 34869 2
3 '2D 1H-13C HSQC' . . . 34869 2
4 '3D 1H-15N NOESY' . . . 34869 2
5 '3D 1H-13C NOESY' . . . 34869 2
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 3 3 MET HA H 1 4.456 0.012 . 1 . . . . A -1 MET HA . 34869 2
2 . 1 . 1 3 3 MET HB2 H 1 2.029 0.000 . 2 . . . . A -1 MET HB2 . 34869 2
3 . 1 . 1 3 3 MET HB3 H 1 2.089 0.002 . 2 . . . . A -1 MET HB3 . 34869 2
4 . 1 . 1 3 3 MET HG2 H 1 2.640 0.002 . 2 . . . . A -1 MET HG2 . 34869 2
5 . 1 . 1 3 3 MET HG3 H 1 2.579 0.002 . 2 . . . . A -1 MET HG3 . 34869 2
6 . 1 . 1 3 3 MET HE1 H 1 2.111 0.000 . 1 . . . . A -1 MET HE1 . 34869 2
7 . 1 . 1 3 3 MET HE2 H 1 2.111 0.000 . 1 . . . . A -1 MET HE2 . 34869 2
8 . 1 . 1 3 3 MET HE3 H 1 2.111 0.000 . 1 . . . . A -1 MET HE3 . 34869 2
9 . 1 . 1 3 3 MET CA C 13 55.418 0.060 . 1 . . . . A -1 MET CA . 34869 2
10 . 1 . 1 3 3 MET CB C 13 32.936 0.020 . 1 . . . . A -1 MET CB . 34869 2
11 . 1 . 1 3 3 MET CG C 13 31.998 0.003 . 1 . . . . A -1 MET CG . 34869 2
12 . 1 . 1 3 3 MET CE C 13 16.905 0.000 . 1 . . . . A -1 MET CE . 34869 2
13 . 1 . 1 4 4 ALA HA H 1 4.368 0.000 . 1 . . . . A 0 ALA HA . 34869 2
14 . 1 . 1 4 4 ALA HB1 H 1 1.412 0.000 . 1 . . . . A 0 ALA HB1 . 34869 2
15 . 1 . 1 4 4 ALA HB2 H 1 1.412 0.000 . 1 . . . . A 0 ALA HB2 . 34869 2
16 . 1 . 1 4 4 ALA HB3 H 1 1.412 0.000 . 1 . . . . A 0 ALA HB3 . 34869 2
17 . 1 . 1 4 4 ALA CA C 13 52.616 0.000 . 1 . . . . A 0 ALA CA . 34869 2
18 . 1 . 1 4 4 ALA CB C 13 19.070 0.000 . 1 . . . . A 0 ALA CB . 34869 2
19 . 1 . 1 5 5 THR HA H 1 4.286 0.003 . 1 . . . . A 1 THR HA . 34869 2
20 . 1 . 1 5 5 THR HB H 1 4.202 0.004 . 1 . . . . A 1 THR HB . 34869 2
21 . 1 . 1 5 5 THR HG21 H 1 1.213 0.001 . 1 . . . . A 1 THR HG21 . 34869 2
22 . 1 . 1 5 5 THR HG22 H 1 1.213 0.001 . 1 . . . . A 1 THR HG22 . 34869 2
23 . 1 . 1 5 5 THR HG23 H 1 1.213 0.001 . 1 . . . . A 1 THR HG23 . 34869 2
24 . 1 . 1 5 5 THR CA C 13 61.636 0.025 . 1 . . . . A 1 THR CA . 34869 2
25 . 1 . 1 5 5 THR CB C 13 69.721 0.011 . 1 . . . . A 1 THR CB . 34869 2
26 . 1 . 1 5 5 THR CG2 C 13 21.622 0.005 . 1 . . . . A 1 THR CG2 . 34869 2
27 . 1 . 1 6 6 ALA HA H 1 4.364 0.003 . 1 . . . . A 2 ALA HA . 34869 2
28 . 1 . 1 6 6 ALA HB1 H 1 1.394 0.007 . 1 . . . . A 2 ALA HB1 . 34869 2
29 . 1 . 1 6 6 ALA HB2 H 1 1.394 0.007 . 1 . . . . A 2 ALA HB2 . 34869 2
30 . 1 . 1 6 6 ALA HB3 H 1 1.394 0.007 . 1 . . . . A 2 ALA HB3 . 34869 2
31 . 1 . 1 6 6 ALA CA C 13 52.381 0.003 . 1 . . . . A 2 ALA CA . 34869 2
32 . 1 . 1 6 6 ALA CB C 13 19.147 0.140 . 1 . . . . A 2 ALA CB . 34869 2
33 . 1 . 1 7 7 VAL HA H 1 4.095 0.003 . 1 . . . . A 3 VAL HA . 34869 2
34 . 1 . 1 7 7 VAL HB H 1 2.057 0.007 . 1 . . . . A 3 VAL HB . 34869 2
35 . 1 . 1 7 7 VAL HG11 H 1 0.935 0.002 . 2 . . . . A 3 VAL HG11 . 34869 2
36 . 1 . 1 7 7 VAL HG12 H 1 0.935 0.002 . 2 . . . . A 3 VAL HG12 . 34869 2
37 . 1 . 1 7 7 VAL HG13 H 1 0.935 0.002 . 2 . . . . A 3 VAL HG13 . 34869 2
38 . 1 . 1 7 7 VAL HG21 H 1 0.933 0.002 . 2 . . . . A 3 VAL HG21 . 34869 2
39 . 1 . 1 7 7 VAL HG22 H 1 0.933 0.002 . 2 . . . . A 3 VAL HG22 . 34869 2
40 . 1 . 1 7 7 VAL HG23 H 1 0.933 0.002 . 2 . . . . A 3 VAL HG23 . 34869 2
41 . 1 . 1 7 7 VAL CA C 13 61.993 0.003 . 1 . . . . A 3 VAL CA . 34869 2
42 . 1 . 1 7 7 VAL CB C 13 32.672 0.113 . 1 . . . . A 3 VAL CB . 34869 2
43 . 1 . 1 7 7 VAL CG1 C 13 20.632 0.031 . 2 . . . . A 3 VAL CG1 . 34869 2
44 . 1 . 1 7 7 VAL CG2 C 13 21.085 0.095 . 2 . . . . A 3 VAL CG2 . 34869 2
45 . 1 . 1 8 8 GLN HA H 1 4.297 0.002 . 1 . . . . A 4 GLN HA . 34869 2
46 . 1 . 1 8 8 GLN HB2 H 1 1.960 0.011 . 2 . . . . A 4 GLN HB2 . 34869 2
47 . 1 . 1 8 8 GLN HB3 H 1 1.977 0.023 . 2 . . . . A 4 GLN HB3 . 34869 2
48 . 1 . 1 8 8 GLN HG2 H 1 2.326 0.009 . 1 . . . . A 4 GLN HG2 . 34869 2
49 . 1 . 1 8 8 GLN HG3 H 1 2.326 0.009 . 1 . . . . A 4 GLN HG3 . 34869 2
50 . 1 . 1 8 8 GLN CA C 13 55.707 0.006 . 1 . . . . A 4 GLN CA . 34869 2
51 . 1 . 1 8 8 GLN CB C 13 29.769 0.095 . 1 . . . . A 4 GLN CB . 34869 2
52 . 1 . 1 8 8 GLN CG C 13 33.907 0.061 . 1 . . . . A 4 GLN CG . 34869 2
53 . 1 . 1 9 9 ASN HA H 1 4.989 0.015 . 1 . . . . A 5 ASN HA . 34869 2
54 . 1 . 1 9 9 ASN HB2 H 1 2.867 0.000 . 2 . . . . A 5 ASN HB2 . 34869 2
55 . 1 . 1 9 9 ASN HB3 H 1 2.750 0.003 . 2 . . . . A 5 ASN HB3 . 34869 2
56 . 1 . 1 9 9 ASN CA C 13 50.978 0.000 . 1 . . . . A 5 ASN CA . 34869 2
57 . 1 . 1 9 9 ASN CB C 13 38.847 0.010 . 1 . . . . A 5 ASN CB . 34869 2
58 . 1 . 1 10 10 PRO HA H 1 4.479 0.000 . 1 . . . . A 6 PRO HA . 34869 2
59 . 1 . 1 10 10 PRO HB2 H 1 2.312 0.003 . 2 . . . . A 6 PRO HB2 . 34869 2
60 . 1 . 1 10 10 PRO HB3 H 1 1.979 0.000 . 2 . . . . A 6 PRO HB3 . 34869 2
61 . 1 . 1 10 10 PRO HG2 H 1 2.027 0.007 . 1 . . . . A 6 PRO HG2 . 34869 2
62 . 1 . 1 10 10 PRO HG3 H 1 2.027 0.007 . 1 . . . . A 6 PRO HG3 . 34869 2
63 . 1 . 1 10 10 PRO HD2 H 1 3.579 0.007 . 1 . . . . A 6 PRO HD2 . 34869 2
64 . 1 . 1 10 10 PRO HD3 H 1 3.579 0.007 . 1 . . . . A 6 PRO HD3 . 34869 2
65 . 1 . 1 10 10 PRO CA C 13 63.059 0.001 . 1 . . . . A 6 PRO CA . 34869 2
66 . 1 . 1 10 10 PRO CB C 13 32.065 0.020 . 1 . . . . A 6 PRO CB . 34869 2
67 . 1 . 1 10 10 PRO CG C 13 27.111 0.091 . 1 . . . . A 6 PRO CG . 34869 2
68 . 1 . 1 10 10 PRO CD C 13 49.678 0.012 . 1 . . . . A 6 PRO CD . 34869 2
69 . 1 . 1 11 11 LEU HA H 1 4.210 0.000 . 1 . . . . A 7 LEU HA . 34869 2
70 . 1 . 1 11 11 LEU HB2 H 1 1.821 0.003 . 2 . . . . A 7 LEU HB2 . 34869 2
71 . 1 . 1 11 11 LEU HB3 H 1 1.444 0.004 . 2 . . . . A 7 LEU HB3 . 34869 2
72 . 1 . 1 11 11 LEU HG H 1 1.684 0.005 . 1 . . . . A 7 LEU HG . 34869 2
73 . 1 . 1 11 11 LEU HD11 H 1 0.704 0.012 . 2 . . . . A 7 LEU HD11 . 34869 2
74 . 1 . 1 11 11 LEU HD12 H 1 0.704 0.012 . 2 . . . . A 7 LEU HD12 . 34869 2
75 . 1 . 1 11 11 LEU HD13 H 1 0.704 0.012 . 2 . . . . A 7 LEU HD13 . 34869 2
76 . 1 . 1 11 11 LEU HD21 H 1 0.792 0.015 . 2 . . . . A 7 LEU HD21 . 34869 2
77 . 1 . 1 11 11 LEU HD22 H 1 0.792 0.015 . 2 . . . . A 7 LEU HD22 . 34869 2
78 . 1 . 1 11 11 LEU HD23 H 1 0.792 0.015 . 2 . . . . A 7 LEU HD23 . 34869 2
79 . 1 . 1 11 11 LEU CA C 13 58.921 0.000 . 1 . . . . A 7 LEU CA . 34869 2
80 . 1 . 1 11 11 LEU CB C 13 41.516 0.039 . 1 . . . . A 7 LEU CB . 34869 2
81 . 1 . 1 11 11 LEU CG C 13 28.834 0.064 . 1 . . . . A 7 LEU CG . 34869 2
82 . 1 . 1 11 11 LEU CD1 C 13 24.885 0.070 . 2 . . . . A 7 LEU CD1 . 34869 2
83 . 1 . 1 11 11 LEU CD2 C 13 25.244 0.000 . 2 . . . . A 7 LEU CD2 . 34869 2
84 . 1 . 1 12 12 GLU HA H 1 3.616 0.006 . 1 . . . . A 8 GLU HA . 34869 2
85 . 1 . 1 12 12 GLU HB2 H 1 1.931 0.014 . 2 . . . . A 8 GLU HB2 . 34869 2
86 . 1 . 1 12 12 GLU HB3 H 1 2.251 0.011 . 2 . . . . A 8 GLU HB3 . 34869 2
87 . 1 . 1 12 12 GLU HG2 H 1 2.028 0.003 . 2 . . . . A 8 GLU HG2 . 34869 2
88 . 1 . 1 12 12 GLU HG3 H 1 2.299 0.004 . 2 . . . . A 8 GLU HG3 . 34869 2
89 . 1 . 1 12 12 GLU CA C 13 60.014 0.049 . 1 . . . . A 8 GLU CA . 34869 2
90 . 1 . 1 12 12 GLU CB C 13 29.886 0.037 . 1 . . . . A 8 GLU CB . 34869 2
91 . 1 . 1 12 12 GLU CG C 13 37.746 0.034 . 1 . . . . A 8 GLU CG . 34869 2
92 . 1 . 1 13 13 THR HA H 1 3.879 0.004 . 1 . . . . A 9 THR HA . 34869 2
93 . 1 . 1 13 13 THR HB H 1 4.275 0.006 . 1 . . . . A 9 THR HB . 34869 2
94 . 1 . 1 13 13 THR HG21 H 1 1.275 0.000 . 1 . . . . A 9 THR HG21 . 34869 2
95 . 1 . 1 13 13 THR HG22 H 1 1.275 0.000 . 1 . . . . A 9 THR HG22 . 34869 2
96 . 1 . 1 13 13 THR HG23 H 1 1.275 0.000 . 1 . . . . A 9 THR HG23 . 34869 2
97 . 1 . 1 13 13 THR CA C 13 66.736 0.014 . 1 . . . . A 9 THR CA . 34869 2
98 . 1 . 1 13 13 THR CB C 13 68.513 0.029 . 1 . . . . A 9 THR CB . 34869 2
99 . 1 . 1 13 13 THR CG2 C 13 22.097 0.000 . 1 . . . . A 9 THR CG2 . 34869 2
100 . 1 . 1 14 14 VAL HA H 1 3.804 0.004 . 1 . . . . A 10 VAL HA . 34869 2
101 . 1 . 1 14 14 VAL HB H 1 2.401 0.005 . 1 . . . . A 10 VAL HB . 34869 2
102 . 1 . 1 14 14 VAL HG11 H 1 1.197 0.009 . 2 . . . . A 10 VAL HG11 . 34869 2
103 . 1 . 1 14 14 VAL HG12 H 1 1.197 0.009 . 2 . . . . A 10 VAL HG12 . 34869 2
104 . 1 . 1 14 14 VAL HG13 H 1 1.197 0.009 . 2 . . . . A 10 VAL HG13 . 34869 2
105 . 1 . 1 14 14 VAL HG21 H 1 0.946 0.004 . 2 . . . . A 10 VAL HG21 . 34869 2
106 . 1 . 1 14 14 VAL HG22 H 1 0.946 0.004 . 2 . . . . A 10 VAL HG22 . 34869 2
107 . 1 . 1 14 14 VAL HG23 H 1 0.946 0.004 . 2 . . . . A 10 VAL HG23 . 34869 2
108 . 1 . 1 14 14 VAL CA C 13 66.280 0.038 . 1 . . . . A 10 VAL CA . 34869 2
109 . 1 . 1 14 14 VAL CB C 13 32.249 0.010 . 1 . . . . A 10 VAL CB . 34869 2
110 . 1 . 1 14 14 VAL CG1 C 13 23.647 0.017 . 2 . . . . A 10 VAL CG1 . 34869 2
111 . 1 . 1 14 14 VAL CG2 C 13 22.148 0.080 . 2 . . . . A 10 VAL CG2 . 34869 2
112 . 1 . 1 15 15 VAL HA H 1 3.643 0.014 . 1 . . . . A 11 VAL HA . 34869 2
113 . 1 . 1 15 15 VAL HB H 1 2.389 0.003 . 1 . . . . A 11 VAL HB . 34869 2
114 . 1 . 1 15 15 VAL HG11 H 1 1.297 0.007 . 2 . . . . A 11 VAL HG11 . 34869 2
115 . 1 . 1 15 15 VAL HG12 H 1 1.297 0.007 . 2 . . . . A 11 VAL HG12 . 34869 2
116 . 1 . 1 15 15 VAL HG13 H 1 1.297 0.007 . 2 . . . . A 11 VAL HG13 . 34869 2
117 . 1 . 1 15 15 VAL HG21 H 1 1.203 0.009 . 2 . . . . A 11 VAL HG21 . 34869 2
118 . 1 . 1 15 15 VAL HG22 H 1 1.203 0.009 . 2 . . . . A 11 VAL HG22 . 34869 2
119 . 1 . 1 15 15 VAL HG23 H 1 1.203 0.009 . 2 . . . . A 11 VAL HG23 . 34869 2
120 . 1 . 1 15 15 VAL CA C 13 67.279 0.041 . 1 . . . . A 11 VAL CA . 34869 2
121 . 1 . 1 15 15 VAL CB C 13 31.385 0.044 . 1 . . . . A 11 VAL CB . 34869 2
122 . 1 . 1 15 15 VAL CG1 C 13 23.523 0.018 . 2 . . . . A 11 VAL CG1 . 34869 2
123 . 1 . 1 15 15 VAL CG2 C 13 22.688 0.052 . 2 . . . . A 11 VAL CG2 . 34869 2
124 . 1 . 1 16 16 LEU HA H 1 4.217 0.003 . 1 . . . . A 12 LEU HA . 34869 2
125 . 1 . 1 16 16 LEU HB2 H 1 2.210 0.002 . 2 . . . . A 12 LEU HB2 . 34869 2
126 . 1 . 1 16 16 LEU HB3 H 1 1.691 0.003 . 2 . . . . A 12 LEU HB3 . 34869 2
127 . 1 . 1 16 16 LEU HG H 1 1.692 0.005 . 1 . . . . A 12 LEU HG . 34869 2
128 . 1 . 1 16 16 LEU HD11 H 1 1.141 0.003 . 2 . . . . A 12 LEU HD11 . 34869 2
129 . 1 . 1 16 16 LEU HD12 H 1 1.141 0.003 . 2 . . . . A 12 LEU HD12 . 34869 2
130 . 1 . 1 16 16 LEU HD13 H 1 1.141 0.003 . 2 . . . . A 12 LEU HD13 . 34869 2
131 . 1 . 1 16 16 LEU HD21 H 1 1.091 0.003 . 2 . . . . A 12 LEU HD21 . 34869 2
132 . 1 . 1 16 16 LEU HD22 H 1 1.091 0.003 . 2 . . . . A 12 LEU HD22 . 34869 2
133 . 1 . 1 16 16 LEU HD23 H 1 1.091 0.003 . 2 . . . . A 12 LEU HD23 . 34869 2
134 . 1 . 1 16 16 LEU CA C 13 58.725 0.021 . 1 . . . . A 12 LEU CA . 34869 2
135 . 1 . 1 16 16 LEU CB C 13 42.501 0.043 . 1 . . . . A 12 LEU CB . 34869 2
136 . 1 . 1 16 16 LEU CG C 13 27.303 0.013 . 1 . . . . A 12 LEU CG . 34869 2
137 . 1 . 1 16 16 LEU CD1 C 13 24.574 0.011 . 2 . . . . A 12 LEU CD1 . 34869 2
138 . 1 . 1 16 16 LEU CD2 C 13 25.980 0.023 . 2 . . . . A 12 LEU CD2 . 34869 2
139 . 1 . 1 17 17 GLN HA H 1 3.890 0.002 . 1 . . . . A 13 GLN HA . 34869 2
140 . 1 . 1 17 17 GLN HB2 H 1 2.266 0.010 . 2 . . . . A 13 GLN HB2 . 34869 2
141 . 1 . 1 17 17 GLN HB3 H 1 2.152 0.015 . 2 . . . . A 13 GLN HB3 . 34869 2
142 . 1 . 1 17 17 GLN HG2 H 1 2.535 0.000 . 2 . . . . A 13 GLN HG2 . 34869 2
143 . 1 . 1 17 17 GLN HG3 H 1 2.448 0.015 . 2 . . . . A 13 GLN HG3 . 34869 2
144 . 1 . 1 17 17 GLN CA C 13 58.729 0.011 . 1 . . . . A 13 GLN CA . 34869 2
145 . 1 . 1 17 17 GLN CB C 13 27.987 0.029 . 1 . . . . A 13 GLN CB . 34869 2
146 . 1 . 1 17 17 GLN CG C 13 33.886 0.021 . 1 . . . . A 13 GLN CG . 34869 2
147 . 1 . 1 18 18 ALA HA H 1 4.218 0.003 . 1 . . . . A 14 ALA HA . 34869 2
148 . 1 . 1 18 18 ALA HB1 H 1 1.430 0.007 . 1 . . . . A 14 ALA HB1 . 34869 2
149 . 1 . 1 18 18 ALA HB2 H 1 1.430 0.007 . 1 . . . . A 14 ALA HB2 . 34869 2
150 . 1 . 1 18 18 ALA HB3 H 1 1.430 0.007 . 1 . . . . A 14 ALA HB3 . 34869 2
151 . 1 . 1 18 18 ALA CA C 13 55.010 0.016 . 1 . . . . A 14 ALA CA . 34869 2
152 . 1 . 1 18 18 ALA CB C 13 17.383 0.015 . 1 . . . . A 14 ALA CB . 34869 2
153 . 1 . 1 19 19 TRP HA H 1 4.493 0.004 . 1 . . . . A 15 TRP HA . 34869 2
154 . 1 . 1 19 19 TRP HB2 H 1 3.221 0.014 . 2 . . . . A 15 TRP HB2 . 34869 2
155 . 1 . 1 19 19 TRP HB3 H 1 3.216 0.013 . 2 . . . . A 15 TRP HB3 . 34869 2
156 . 1 . 1 19 19 TRP HD1 H 1 5.715 0.007 . 1 . . . . A 15 TRP HD1 . 34869 2
157 . 1 . 1 19 19 TRP HE3 H 1 7.145 0.004 . 1 . . . . A 15 TRP HE3 . 34869 2
158 . 1 . 1 19 19 TRP HZ2 H 1 7.335 0.006 . 1 . . . . A 15 TRP HZ2 . 34869 2
159 . 1 . 1 19 19 TRP HZ3 H 1 6.523 0.003 . 1 . . . . A 15 TRP HZ3 . 34869 2
160 . 1 . 1 19 19 TRP HH2 H 1 6.935 0.005 . 1 . . . . A 15 TRP HH2 . 34869 2
161 . 1 . 1 19 19 TRP CA C 13 59.285 0.022 . 1 . . . . A 15 TRP CA . 34869 2
162 . 1 . 1 19 19 TRP CB C 13 29.560 0.020 . 1 . . . . A 15 TRP CB . 34869 2
163 . 1 . 1 19 19 TRP CD1 C 13 125.933 0.053 . 1 . . . . A 15 TRP CD1 . 34869 2
164 . 1 . 1 19 19 TRP CE3 C 13 121.243 0.021 . 1 . . . . A 15 TRP CE3 . 34869 2
165 . 1 . 1 19 19 TRP CZ2 C 13 114.598 0.032 . 1 . . . . A 15 TRP CZ2 . 34869 2
166 . 1 . 1 19 19 TRP CZ3 C 13 120.142 0.028 . 1 . . . . A 15 TRP CZ3 . 34869 2
167 . 1 . 1 19 19 TRP CH2 C 13 124.459 0.023 . 1 . . . . A 15 TRP CH2 . 34869 2
168 . 1 . 1 20 20 LYS HA H 1 3.424 0.002 . 1 . . . . A 16 LYS HA . 34869 2
169 . 1 . 1 20 20 LYS HB2 H 1 1.851 0.009 . 2 . . . . A 16 LYS HB2 . 34869 2
170 . 1 . 1 20 20 LYS HB3 H 1 1.850 0.006 . 2 . . . . A 16 LYS HB3 . 34869 2
171 . 1 . 1 20 20 LYS HG2 H 1 1.477 0.004 . 2 . . . . A 16 LYS HG2 . 34869 2
172 . 1 . 1 20 20 LYS HG3 H 1 1.831 0.008 . 2 . . . . A 16 LYS HG3 . 34869 2
173 . 1 . 1 20 20 LYS HD2 H 1 1.764 0.003 . 1 . . . . A 16 LYS HD2 . 34869 2
174 . 1 . 1 20 20 LYS HD3 H 1 1.764 0.003 . 1 . . . . A 16 LYS HD3 . 34869 2
175 . 1 . 1 20 20 LYS HE2 H 1 3.122 0.004 . 2 . . . . A 16 LYS HE2 . 34869 2
176 . 1 . 1 20 20 LYS HE3 H 1 2.968 0.004 . 2 . . . . A 16 LYS HE3 . 34869 2
177 . 1 . 1 20 20 LYS CA C 13 61.403 0.019 . 1 . . . . A 16 LYS CA . 34869 2
178 . 1 . 1 20 20 LYS CB C 13 32.303 0.015 . 1 . . . . A 16 LYS CB . 34869 2
179 . 1 . 1 20 20 LYS CG C 13 25.966 0.040 . 1 . . . . A 16 LYS CG . 34869 2
180 . 1 . 1 20 20 LYS CD C 13 30.054 0.024 . 1 . . . . A 16 LYS CD . 34869 2
181 . 1 . 1 20 20 LYS CE C 13 42.105 0.040 . 1 . . . . A 16 LYS CE . 34869 2
182 . 1 . 1 21 21 ASP HA H 1 4.195 0.003 . 1 . . . . A 17 ASP HA . 34869 2
183 . 1 . 1 21 21 ASP HB2 H 1 2.836 0.003 . 2 . . . . A 17 ASP HB2 . 34869 2
184 . 1 . 1 21 21 ASP HB3 H 1 2.661 0.004 . 2 . . . . A 17 ASP HB3 . 34869 2
185 . 1 . 1 21 21 ASP CA C 13 57.107 0.007 . 1 . . . . A 17 ASP CA . 34869 2
186 . 1 . 1 21 21 ASP CB C 13 41.286 0.043 . 1 . . . . A 17 ASP CB . 34869 2
187 . 1 . 1 22 22 ILE HA H 1 3.449 0.001 . 1 . . . . A 18 ILE HA . 34869 2
188 . 1 . 1 22 22 ILE HB H 1 1.357 0.002 . 1 . . . . A 18 ILE HB . 34869 2
189 . 1 . 1 22 22 ILE HG12 H 1 1.726 0.003 . 2 . . . . A 18 ILE HG12 . 34869 2
190 . 1 . 1 22 22 ILE HG13 H 1 0.931 0.002 . 2 . . . . A 18 ILE HG13 . 34869 2
191 . 1 . 1 22 22 ILE HG21 H 1 0.607 0.002 . 1 . . . . A 18 ILE HG21 . 34869 2
192 . 1 . 1 22 22 ILE HG22 H 1 0.607 0.002 . 1 . . . . A 18 ILE HG22 . 34869 2
193 . 1 . 1 22 22 ILE HG23 H 1 0.607 0.002 . 1 . . . . A 18 ILE HG23 . 34869 2
194 . 1 . 1 22 22 ILE HD11 H 1 0.731 0.005 . 1 . . . . A 18 ILE HD11 . 34869 2
195 . 1 . 1 22 22 ILE HD12 H 1 0.731 0.005 . 1 . . . . A 18 ILE HD12 . 34869 2
196 . 1 . 1 22 22 ILE HD13 H 1 0.731 0.005 . 1 . . . . A 18 ILE HD13 . 34869 2
197 . 1 . 1 22 22 ILE CA C 13 63.759 0.024 . 1 . . . . A 18 ILE CA . 34869 2
198 . 1 . 1 22 22 ILE CB C 13 39.709 0.025 . 1 . . . . A 18 ILE CB . 34869 2
199 . 1 . 1 22 22 ILE CG1 C 13 29.533 0.035 . 1 . . . . A 18 ILE CG1 . 34869 2
200 . 1 . 1 22 22 ILE CG2 C 13 17.113 0.015 . 1 . . . . A 18 ILE CG2 . 34869 2
201 . 1 . 1 22 22 ILE CD1 C 13 13.851 0.017 . 1 . . . . A 18 ILE CD1 . 34869 2
202 . 1 . 1 23 23 SER HA H 1 3.003 0.001 . 1 . . . . A 19 SER HA . 34869 2
203 . 1 . 1 23 23 SER HB2 H 1 3.058 0.001 . 2 . . . . A 19 SER HB2 . 34869 2
204 . 1 . 1 23 23 SER HB3 H 1 1.443 0.002 . 2 . . . . A 19 SER HB3 . 34869 2
205 . 1 . 1 23 23 SER CA C 13 59.155 0.007 . 1 . . . . A 19 SER CA . 34869 2
206 . 1 . 1 23 23 SER CB C 13 65.087 0.014 . 1 . . . . A 19 SER CB . 34869 2
207 . 1 . 1 24 24 GLY HA2 H 1 4.003 0.000 . 2 . . . . A 20 GLY HA2 . 34869 2
208 . 1 . 1 24 24 GLY HA3 H 1 3.729 0.005 . 2 . . . . A 20 GLY HA3 . 34869 2
209 . 1 . 1 24 24 GLY CA C 13 45.599 0.007 . 1 . . . . A 20 GLY CA . 34869 2
210 . 1 . 1 25 25 ALA HA H 1 4.366 0.002 . 1 . . . . A 21 ALA HA . 34869 2
211 . 1 . 1 25 25 ALA HB1 H 1 1.193 0.003 . 1 . . . . A 21 ALA HB1 . 34869 2
212 . 1 . 1 25 25 ALA HB2 H 1 1.193 0.003 . 1 . . . . A 21 ALA HB2 . 34869 2
213 . 1 . 1 25 25 ALA HB3 H 1 1.193 0.003 . 1 . . . . A 21 ALA HB3 . 34869 2
214 . 1 . 1 25 25 ALA CA C 13 51.784 0.006 . 1 . . . . A 21 ALA CA . 34869 2
215 . 1 . 1 25 25 ALA CB C 13 18.380 0.019 . 1 . . . . A 21 ALA CB . 34869 2
216 . 1 . 1 26 26 ASP HA H 1 4.531 0.002 . 1 . . . . A 22 ASP HA . 34869 2
217 . 1 . 1 26 26 ASP HB2 H 1 2.657 0.011 . 2 . . . . A 22 ASP HB2 . 34869 2
218 . 1 . 1 26 26 ASP HB3 H 1 2.654 0.012 . 2 . . . . A 22 ASP HB3 . 34869 2
219 . 1 . 1 26 26 ASP CA C 13 55.745 0.014 . 1 . . . . A 22 ASP CA . 34869 2
220 . 1 . 1 26 26 ASP CB C 13 42.041 0.038 . 1 . . . . A 22 ASP CB . 34869 2
221 . 1 . 1 27 27 ASP HA H 1 4.709 0.002 . 1 . . . . A 23 ASP HA . 34869 2
222 . 1 . 1 27 27 ASP HB2 H 1 2.749 0.017 . 2 . . . . A 23 ASP HB2 . 34869 2
223 . 1 . 1 27 27 ASP HB3 H 1 2.711 0.014 . 2 . . . . A 23 ASP HB3 . 34869 2
224 . 1 . 1 27 27 ASP CA C 13 53.201 0.021 . 1 . . . . A 23 ASP CA . 34869 2
225 . 1 . 1 27 27 ASP CB C 13 40.234 0.027 . 1 . . . . A 23 ASP CB . 34869 2
226 . 1 . 1 28 28 PHE HA H 1 4.470 0.003 . 1 . . . . A 24 PHE HA . 34869 2
227 . 1 . 1 28 28 PHE HB2 H 1 2.865 0.001 . 2 . . . . A 24 PHE HB2 . 34869 2
228 . 1 . 1 28 28 PHE HB3 H 1 3.182 0.004 . 2 . . . . A 24 PHE HB3 . 34869 2
229 . 1 . 1 28 28 PHE HD1 H 1 7.258 0.005 . 1 . . . . A 24 PHE HD1 . 34869 2
230 . 1 . 1 28 28 PHE HD2 H 1 7.258 0.005 . 1 . . . . A 24 PHE HD2 . 34869 2
231 . 1 . 1 28 28 PHE HE1 H 1 6.666 0.005 . 1 . . . . A 24 PHE HE1 . 34869 2
232 . 1 . 1 28 28 PHE HE2 H 1 6.666 0.005 . 1 . . . . A 24 PHE HE2 . 34869 2
233 . 1 . 1 28 28 PHE CA C 13 59.221 0.032 . 1 . . . . A 24 PHE CA . 34869 2
234 . 1 . 1 28 28 PHE CB C 13 41.885 0.013 . 1 . . . . A 24 PHE CB . 34869 2
235 . 1 . 1 28 28 PHE CD1 C 13 132.264 0.043 . 1 . . . . A 24 PHE CD1 . 34869 2
236 . 1 . 1 28 28 PHE CD2 C 13 132.264 0.043 . 1 . . . . A 24 PHE CD2 . 34869 2
237 . 1 . 1 28 28 PHE CE1 C 13 130.811 0.036 . 1 . . . . A 24 PHE CE1 . 34869 2
238 . 1 . 1 28 28 PHE CE2 C 13 130.811 0.036 . 1 . . . . A 24 PHE CE2 . 34869 2
239 . 1 . 1 29 29 THR HA H 1 4.939 0.003 . 1 . . . . A 25 THR HA . 34869 2
240 . 1 . 1 29 29 THR HB H 1 4.532 0.003 . 1 . . . . A 25 THR HB . 34869 2
241 . 1 . 1 29 29 THR HG21 H 1 1.197 0.003 . 1 . . . . A 25 THR HG21 . 34869 2
242 . 1 . 1 29 29 THR HG22 H 1 1.197 0.003 . 1 . . . . A 25 THR HG22 . 34869 2
243 . 1 . 1 29 29 THR HG23 H 1 1.197 0.003 . 1 . . . . A 25 THR HG23 . 34869 2
244 . 1 . 1 29 29 THR CA C 13 60.226 0.018 . 1 . . . . A 25 THR CA . 34869 2
245 . 1 . 1 29 29 THR CB C 13 71.628 0.017 . 1 . . . . A 25 THR CB . 34869 2
246 . 1 . 1 29 29 THR CG2 C 13 20.872 0.009 . 1 . . . . A 25 THR CG2 . 34869 2
247 . 1 . 1 30 30 THR HA H 1 3.920 0.004 . 1 . . . . A 26 THR HA . 34869 2
248 . 1 . 1 30 30 THR HB H 1 4.367 0.002 . 1 . . . . A 26 THR HB . 34869 2
249 . 1 . 1 30 30 THR HG21 H 1 1.380 0.005 . 1 . . . . A 26 THR HG21 . 34869 2
250 . 1 . 1 30 30 THR HG22 H 1 1.380 0.005 . 1 . . . . A 26 THR HG22 . 34869 2
251 . 1 . 1 30 30 THR HG23 H 1 1.380 0.005 . 1 . . . . A 26 THR HG23 . 34869 2
252 . 1 . 1 30 30 THR CA C 13 64.434 0.015 . 1 . . . . A 26 THR CA . 34869 2
253 . 1 . 1 30 30 THR CB C 13 68.396 0.006 . 1 . . . . A 26 THR CB . 34869 2
254 . 1 . 1 30 30 THR CG2 C 13 23.687 0.016 . 1 . . . . A 26 THR CG2 . 34869 2
255 . 1 . 1 31 31 THR HA H 1 4.463 0.003 . 1 . . . . A 27 THR HA . 34869 2
256 . 1 . 1 31 31 THR HB H 1 4.380 0.002 . 1 . . . . A 27 THR HB . 34869 2
257 . 1 . 1 31 31 THR HG21 H 1 1.024 0.006 . 1 . . . . A 27 THR HG21 . 34869 2
258 . 1 . 1 31 31 THR HG22 H 1 1.024 0.006 . 1 . . . . A 27 THR HG22 . 34869 2
259 . 1 . 1 31 31 THR HG23 H 1 1.024 0.006 . 1 . . . . A 27 THR HG23 . 34869 2
260 . 1 . 1 31 31 THR CA C 13 60.380 0.021 . 1 . . . . A 27 THR CA . 34869 2
261 . 1 . 1 31 31 THR CB C 13 69.171 0.007 . 1 . . . . A 27 THR CB . 34869 2
262 . 1 . 1 31 31 THR CG2 C 13 21.291 0.036 . 1 . . . . A 27 THR CG2 . 34869 2
263 . 1 . 1 32 32 ASP HA H 1 4.365 0.002 . 1 . . . . A 28 ASP HA . 34869 2
264 . 1 . 1 32 32 ASP HB2 H 1 1.263 0.002 . 2 . . . . A 28 ASP HB2 . 34869 2
265 . 1 . 1 32 32 ASP HB3 H 1 1.780 0.005 . 2 . . . . A 28 ASP HB3 . 34869 2
266 . 1 . 1 32 32 ASP CA C 13 54.285 0.006 . 1 . . . . A 28 ASP CA . 34869 2
267 . 1 . 1 32 32 ASP CB C 13 41.941 0.034 . 1 . . . . A 28 ASP CB . 34869 2
268 . 1 . 1 33 33 SER HA H 1 4.661 0.003 . 1 . . . . A 29 SER HA . 34869 2
269 . 1 . 1 33 33 SER HB2 H 1 3.992 0.010 . 2 . . . . A 29 SER HB2 . 34869 2
270 . 1 . 1 33 33 SER HB3 H 1 3.856 0.011 . 2 . . . . A 29 SER HB3 . 34869 2
271 . 1 . 1 33 33 SER CA C 13 56.656 0.010 . 1 . . . . A 29 SER CA . 34869 2
272 . 1 . 1 33 33 SER CB C 13 63.748 0.019 . 1 . . . . A 29 SER CB . 34869 2
273 . 1 . 1 34 34 PHE HA H 1 4.259 0.002 . 1 . . . . A 30 PHE HA . 34869 2
274 . 1 . 1 34 34 PHE HB2 H 1 2.579 0.004 . 2 . . . . A 30 PHE HB2 . 34869 2
275 . 1 . 1 34 34 PHE HB3 H 1 2.376 0.005 . 2 . . . . A 30 PHE HB3 . 34869 2
276 . 1 . 1 34 34 PHE HD1 H 1 5.855 0.005 . 3 . . . . A 30 PHE HD1 . 34869 2
277 . 1 . 1 34 34 PHE HD2 H 1 6.966 0.008 . 3 . . . . A 30 PHE HD2 . 34869 2
278 . 1 . 1 34 34 PHE HE1 H 1 6.650 0.004 . 3 . . . . A 30 PHE HE1 . 34869 2
279 . 1 . 1 34 34 PHE HE2 H 1 6.520 0.004 . 3 . . . . A 30 PHE HE2 . 34869 2
280 . 1 . 1 34 34 PHE HZ H 1 7.219 0.008 . 1 . . . . A 30 PHE HZ . 34869 2
281 . 1 . 1 34 34 PHE CA C 13 60.167 0.008 . 1 . . . . A 30 PHE CA . 34869 2
282 . 1 . 1 34 34 PHE CB C 13 38.970 0.024 . 1 . . . . A 30 PHE CB . 34869 2
283 . 1 . 1 34 34 PHE CD1 C 13 130.93703 0.02043 . 3 . . . . A 30 PHE CD1 . 34869 2
284 . 1 . 1 34 34 PHE CD2 C 13 131.29393 0.01835 . 3 . . . . A 30 PHE CD2 . 34869 2
285 . 1 . 1 34 34 PHE CE1 C 13 128.11305 0.03380 . 3 . . . . A 30 PHE CE1 . 34869 2
286 . 1 . 1 34 34 PHE CE2 C 13 129.90043 0.02663 . 3 . . . . A 30 PHE CE2 . 34869 2
287 . 1 . 1 34 34 PHE CZ C 13 129.392 0.048 . 1 . . . . A 30 PHE CZ . 34869 2
288 . 1 . 1 35 35 LEU HA H 1 4.339 0.001 . 1 . . . . A 31 LEU HA . 34869 2
289 . 1 . 1 35 35 LEU HB2 H 1 1.679 0.011 . 2 . . . . A 31 LEU HB2 . 34869 2
290 . 1 . 1 35 35 LEU HB3 H 1 1.681 0.010 . 2 . . . . A 31 LEU HB3 . 34869 2
291 . 1 . 1 35 35 LEU HG H 1 1.691 0.004 . 1 . . . . A 31 LEU HG . 34869 2
292 . 1 . 1 35 35 LEU HD11 H 1 0.923 0.004 . 2 . . . . A 31 LEU HD11 . 34869 2
293 . 1 . 1 35 35 LEU HD12 H 1 0.923 0.004 . 2 . . . . A 31 LEU HD12 . 34869 2
294 . 1 . 1 35 35 LEU HD13 H 1 0.923 0.004 . 2 . . . . A 31 LEU HD13 . 34869 2
295 . 1 . 1 35 35 LEU HD21 H 1 0.779 0.004 . 2 . . . . A 31 LEU HD21 . 34869 2
296 . 1 . 1 35 35 LEU HD22 H 1 0.779 0.004 . 2 . . . . A 31 LEU HD22 . 34869 2
297 . 1 . 1 35 35 LEU HD23 H 1 0.779 0.004 . 2 . . . . A 31 LEU HD23 . 34869 2
298 . 1 . 1 35 35 LEU CA C 13 56.601 0.013 . 1 . . . . A 31 LEU CA . 34869 2
299 . 1 . 1 35 35 LEU CB C 13 41.940 0.033 . 1 . . . . A 31 LEU CB . 34869 2
300 . 1 . 1 35 35 LEU CG C 13 27.431 0.064 . 1 . . . . A 31 LEU CG . 34869 2
301 . 1 . 1 35 35 LEU CD1 C 13 24.949 0.034 . 2 . . . . A 31 LEU CD1 . 34869 2
302 . 1 . 1 35 35 LEU CD2 C 13 24.271 0.019 . 2 . . . . A 31 LEU CD2 . 34869 2
303 . 1 . 1 36 36 GLY HA2 H 1 4.095 0.000 . 2 . . . . A 32 GLY HA2 . 34869 2
304 . 1 . 1 36 36 GLY HA3 H 1 4.018 0.000 . 2 . . . . A 32 GLY HA3 . 34869 2
305 . 1 . 1 36 36 GLY CA C 13 45.794 0.002 . 1 . . . . A 32 GLY CA . 34869 2
306 . 1 . 1 37 37 HIS HA H 1 4.848 0.002 . 1 . . . . A 33 HIS HA . 34869 2
307 . 1 . 1 37 37 HIS HB2 H 1 3.402 0.001 . 2 . . . . A 33 HIS HB2 . 34869 2
308 . 1 . 1 37 37 HIS HB3 H 1 3.680 0.004 . 2 . . . . A 33 HIS HB3 . 34869 2
309 . 1 . 1 37 37 HIS HD2 H 1 7.379 0.004 . 1 . . . . A 33 HIS HD2 . 34869 2
310 . 1 . 1 37 37 HIS HE1 H 1 8.250 0.002 . 1 . . . . A 33 HIS HE1 . 34869 2
311 . 1 . 1 37 37 HIS CA C 13 56.270 0.008 . 1 . . . . A 33 HIS CA . 34869 2
312 . 1 . 1 37 37 HIS CB C 13 30.165 0.013 . 1 . . . . A 33 HIS CB . 34869 2
313 . 1 . 1 37 37 HIS CD2 C 13 120.293 0.014 . 1 . . . . A 33 HIS CD2 . 34869 2
314 . 1 . 1 37 37 HIS CE1 C 13 137.650 0.000 . 1 . . . . A 33 HIS CE1 . 34869 2
315 . 1 . 1 38 38 GLY HA2 H 1 3.984 0.000 . 2 . . . . A 34 GLY HA2 . 34869 2
316 . 1 . 1 38 38 GLY HA3 H 1 4.203 0.000 . 2 . . . . A 34 GLY HA3 . 34869 2
317 . 1 . 1 38 38 GLY CA C 13 45.655 0.012 . 1 . . . . A 34 GLY CA . 34869 2
318 . 1 . 1 39 39 GLY HA2 H 1 4.251 0.000 . 2 . . . . A 35 GLY HA2 . 34869 2
319 . 1 . 1 39 39 GLY HA3 H 1 3.961 0.000 . 2 . . . . A 35 GLY HA3 . 34869 2
320 . 1 . 1 39 39 GLY CA C 13 45.672 0.043 . 1 . . . . A 35 GLY CA . 34869 2
321 . 1 . 1 40 40 ASN HA H 1 4.636 0.002 . 1 . . . . A 36 ASN HA . 34869 2
322 . 1 . 1 40 40 ASN HB2 H 1 2.514 0.002 . 2 . . . . A 36 ASN HB2 . 34869 2
323 . 1 . 1 40 40 ASN HB3 H 1 2.765 0.003 . 2 . . . . A 36 ASN HB3 . 34869 2
324 . 1 . 1 40 40 ASN CA C 13 52.286 0.027 . 1 . . . . A 36 ASN CA . 34869 2
325 . 1 . 1 40 40 ASN CB C 13 39.115 0.020 . 1 . . . . A 36 ASN CB . 34869 2
326 . 1 . 1 41 41 WP9 H14 H 1 7.685 0.000 . 1 . . . . A 37 WP9 H14 . 34869 2
327 . 1 . 1 41 41 WP9 H15 H 1 7.698 0.000 . 1 . . . . A 37 WP9 H15 . 34869 2
328 . 1 . 1 41 41 WP9 H32 H 1 3.996 0.002 . 1 . . . . A 37 WP9 H32 . 34869 2
329 . 1 . 1 41 41 WP9 H281 H 1 3.748 0.003 . 2 . . . . A 37 WP9 H281 . 34869 2
330 . 1 . 1 41 41 WP9 H282 H 1 3.323 0.002 . 2 . . . . A 37 WP9 H282 . 34869 2
331 . 1 . 1 41 41 WP9 H301 H 1 0.939 0.003 . 1 . . . . A 37 WP9 H301 . 34869 2
332 . 1 . 1 41 41 WP9 H302 H 1 0.939 0.003 . 1 . . . . A 37 WP9 H302 . 34869 2
333 . 1 . 1 41 41 WP9 H303 H 1 0.939 0.003 . 1 . . . . A 37 WP9 H303 . 34869 2
334 . 1 . 1 41 41 WP9 H311 H 1 0.820 0.003 . 1 . . . . A 37 WP9 H311 . 34869 2
335 . 1 . 1 41 41 WP9 H312 H 1 0.820 0.003 . 1 . . . . A 37 WP9 H312 . 34869 2
336 . 1 . 1 41 41 WP9 H313 H 1 0.820 0.003 . 1 . . . . A 37 WP9 H313 . 34869 2
337 . 1 . 1 41 41 WP9 H371 H 1 3.420 0.003 . 1 . . . . A 37 WP9 H371 . 34869 2
338 . 1 . 1 41 41 WP9 H372 H 1 3.420 0.003 . 1 . . . . A 37 WP9 H372 . 34869 2
339 . 1 . 1 41 41 WP9 H381 H 1 2.396 0.003 . 1 . . . . A 37 WP9 H381 . 34869 2
340 . 1 . 1 41 41 WP9 H382 H 1 2.396 0.003 . 1 . . . . A 37 WP9 H382 . 34869 2
341 . 1 . 1 41 41 WP9 H421 H 1 3.307 0.009 . 1 . . . . A 37 WP9 H421 . 34869 2
342 . 1 . 1 41 41 WP9 H422 H 1 3.307 0.009 . 1 . . . . A 37 WP9 H422 . 34869 2
343 . 1 . 1 41 41 WP9 H431 H 1 2.982 0.002 . 1 . . . . A 37 WP9 H431 . 34869 2
344 . 1 . 1 41 41 WP9 H432 H 1 2.982 0.002 . 1 . . . . A 37 WP9 H432 . 34869 2
345 . 1 . 1 41 41 WP9 C14 C 13 132.575 0.000 . 1 . . . . A 37 WP9 C14 . 34869 2
346 . 1 . 1 41 41 WP9 C15 C 13 133.599 0.000 . 1 . . . . A 37 WP9 C15 . 34869 2
347 . 1 . 1 41 41 WP9 C28 C 13 74.054 0.009 . 1 . . . . A 37 WP9 C28 . 34869 2
348 . 1 . 1 41 41 WP9 C30 C 13 23.869 0.027 . 1 . . . . A 37 WP9 C30 . 34869 2
349 . 1 . 1 41 41 WP9 C31 C 13 21.499 0.028 . 1 . . . . A 37 WP9 C31 . 34869 2
350 . 1 . 1 41 41 WP9 C32 C 13 76.631 0.017 . 1 . . . . A 37 WP9 C32 . 34869 2
351 . 1 . 1 41 41 WP9 C37 C 13 38.091 0.014 . 1 . . . . A 37 WP9 C37 . 34869 2
352 . 1 . 1 41 41 WP9 C38 C 13 37.874 0.012 . 1 . . . . A 37 WP9 C38 . 34869 2
353 . 1 . 1 41 41 WP9 C42 C 13 41.631 0.018 . 1 . . . . A 37 WP9 C42 . 34869 2
354 . 1 . 1 41 41 WP9 C43 C 13 30.410 0.008 . 1 . . . . A 37 WP9 C43 . 34869 2
355 . 1 . 1 41 41 WP9 CA C 13 60.173 0.021 . 1 . . . . A 37 WP9 CA . 34869 2
356 . 1 . 1 41 41 WP9 CB C 13 65.671 0.008 . 1 . . . . A 37 WP9 CB . 34869 2
357 . 1 . 1 41 41 WP9 HA H 1 3.810 0.004 . 1 . . . . A 37 WP9 HA . 34869 2
358 . 1 . 1 41 41 WP9 HB1 H 1 4.099 0.002 . 1 . . . . A 37 WP9 HB1 . 34869 2
359 . 1 . 1 41 41 WP9 HB2 H 1 4.099 0.002 . 1 . . . . A 37 WP9 HB2 . 34869 2
360 . 1 . 1 42 42 LEU HA H 1 4.156 0.005 . 1 . . . . A 38 LEU HA . 34869 2
361 . 1 . 1 42 42 LEU HB2 H 1 1.582 0.008 . 2 . . . . A 38 LEU HB2 . 34869 2
362 . 1 . 1 42 42 LEU HB3 H 1 1.477 0.006 . 2 . . . . A 38 LEU HB3 . 34869 2
363 . 1 . 1 42 42 LEU HG H 1 1.589 0.008 . 1 . . . . A 38 LEU HG . 34869 2
364 . 1 . 1 42 42 LEU HD11 H 1 0.889 0.009 . 2 . . . . A 38 LEU HD11 . 34869 2
365 . 1 . 1 42 42 LEU HD12 H 1 0.889 0.009 . 2 . . . . A 38 LEU HD12 . 34869 2
366 . 1 . 1 42 42 LEU HD13 H 1 0.889 0.009 . 2 . . . . A 38 LEU HD13 . 34869 2
367 . 1 . 1 42 42 LEU HD21 H 1 0.877 0.016 . 2 . . . . A 38 LEU HD21 . 34869 2
368 . 1 . 1 42 42 LEU HD22 H 1 0.877 0.016 . 2 . . . . A 38 LEU HD22 . 34869 2
369 . 1 . 1 42 42 LEU HD23 H 1 0.877 0.016 . 2 . . . . A 38 LEU HD23 . 34869 2
370 . 1 . 1 42 42 LEU CA C 13 57.687 0.007 . 1 . . . . A 38 LEU CA . 34869 2
371 . 1 . 1 42 42 LEU CB C 13 41.059 0.020 . 1 . . . . A 38 LEU CB . 34869 2
372 . 1 . 1 42 42 LEU CG C 13 27.064 0.016 . 1 . . . . A 38 LEU CG . 34869 2
373 . 1 . 1 42 42 LEU CD1 C 13 24.092 0.030 . 2 . . . . A 38 LEU CD1 . 34869 2
374 . 1 . 1 42 42 LEU CD2 C 13 24.098 0.032 . 2 . . . . A 38 LEU CD2 . 34869 2
375 . 1 . 1 43 43 HIS HA H 1 4.492 0.003 . 1 . . . . A 39 HIS HA . 34869 2
376 . 1 . 1 43 43 HIS HB2 H 1 2.987 0.003 . 2 . . . . A 39 HIS HB2 . 34869 2
377 . 1 . 1 43 43 HIS HB3 H 1 3.243 0.002 . 2 . . . . A 39 HIS HB3 . 34869 2
378 . 1 . 1 43 43 HIS HD2 H 1 6.778 0.004 . 1 . . . . A 39 HIS HD2 . 34869 2
379 . 1 . 1 43 43 HIS HE1 H 1 7.829 0.002 . 1 . . . . A 39 HIS HE1 . 34869 2
380 . 1 . 1 43 43 HIS CA C 13 57.372 0.031 . 1 . . . . A 39 HIS CA . 34869 2
381 . 1 . 1 43 43 HIS CB C 13 31.235 0.023 . 1 . . . . A 39 HIS CB . 34869 2
382 . 1 . 1 43 43 HIS CD2 C 13 117.178 0.021 . 1 . . . . A 39 HIS CD2 . 34869 2
383 . 1 . 1 43 43 HIS CE1 C 13 138.212 0.000 . 1 . . . . A 39 HIS CE1 . 34869 2
384 . 1 . 1 44 44 PHE HA H 1 4.384 0.008 . 1 . . . . A 40 PHE HA . 34869 2
385 . 1 . 1 44 44 PHE HB2 H 1 3.424 0.003 . 2 . . . . A 40 PHE HB2 . 34869 2
386 . 1 . 1 44 44 PHE HB3 H 1 2.973 0.004 . 2 . . . . A 40 PHE HB3 . 34869 2
387 . 1 . 1 44 44 PHE HD1 H 1 6.991 0.003 . 1 . . . . A 40 PHE HD1 . 34869 2
388 . 1 . 1 44 44 PHE HD2 H 1 6.991 0.003 . 1 . . . . A 40 PHE HD2 . 34869 2
389 . 1 . 1 44 44 PHE HE1 H 1 6.976 0.009 . 1 . . . . A 40 PHE HE1 . 34869 2
390 . 1 . 1 44 44 PHE HE2 H 1 6.976 0.009 . 1 . . . . A 40 PHE HE2 . 34869 2
391 . 1 . 1 44 44 PHE HZ H 1 7.136 0.008 . 1 . . . . A 40 PHE HZ . 34869 2
392 . 1 . 1 44 44 PHE CA C 13 59.897 0.018 . 1 . . . . A 40 PHE CA . 34869 2
393 . 1 . 1 44 44 PHE CB C 13 37.860 0.034 . 1 . . . . A 40 PHE CB . 34869 2
394 . 1 . 1 44 44 PHE CD1 C 13 130.338 0.023 . 1 . . . . A 40 PHE CD1 . 34869 2
395 . 1 . 1 44 44 PHE CD2 C 13 130.338 0.023 . 1 . . . . A 40 PHE CD2 . 34869 2
396 . 1 . 1 44 44 PHE CE1 C 13 131.204 0.048 . 1 . . . . A 40 PHE CE1 . 34869 2
397 . 1 . 1 44 44 PHE CE2 C 13 131.204 0.048 . 1 . . . . A 40 PHE CE2 . 34869 2
398 . 1 . 1 44 44 PHE CZ C 13 129.477 0.022 . 1 . . . . A 40 PHE CZ . 34869 2
399 . 1 . 1 45 45 VAL HA H 1 3.840 0.004 . 1 . . . . A 41 VAL HA . 34869 2
400 . 1 . 1 45 45 VAL HB H 1 2.348 0.012 . 1 . . . . A 41 VAL HB . 34869 2
401 . 1 . 1 45 45 VAL HG11 H 1 1.040 0.004 . 2 . . . . A 41 VAL HG11 . 34869 2
402 . 1 . 1 45 45 VAL HG12 H 1 1.040 0.004 . 2 . . . . A 41 VAL HG12 . 34869 2
403 . 1 . 1 45 45 VAL HG13 H 1 1.040 0.004 . 2 . . . . A 41 VAL HG13 . 34869 2
404 . 1 . 1 45 45 VAL HG21 H 1 1.213 0.002 . 2 . . . . A 41 VAL HG21 . 34869 2
405 . 1 . 1 45 45 VAL HG22 H 1 1.213 0.002 . 2 . . . . A 41 VAL HG22 . 34869 2
406 . 1 . 1 45 45 VAL HG23 H 1 1.213 0.002 . 2 . . . . A 41 VAL HG23 . 34869 2
407 . 1 . 1 45 45 VAL CA C 13 65.663 0.015 . 1 . . . . A 41 VAL CA . 34869 2
408 . 1 . 1 45 45 VAL CB C 13 32.120 0.018 . 1 . . . . A 41 VAL CB . 34869 2
409 . 1 . 1 45 45 VAL CG1 C 13 20.896 0.058 . 2 . . . . A 41 VAL CG1 . 34869 2
410 . 1 . 1 45 45 VAL CG2 C 13 22.685 0.015 . 2 . . . . A 41 VAL CG2 . 34869 2
411 . 1 . 1 46 46 GLN HA H 1 4.133 0.009 . 1 . . . . A 42 GLN HA . 34869 2
412 . 1 . 1 46 46 GLN HB2 H 1 2.310 0.006 . 2 . . . . A 42 GLN HB2 . 34869 2
413 . 1 . 1 46 46 GLN HB3 H 1 2.028 0.004 . 2 . . . . A 42 GLN HB3 . 34869 2
414 . 1 . 1 46 46 GLN HG2 H 1 2.413 0.009 . 2 . . . . A 42 GLN HG2 . 34869 2
415 . 1 . 1 46 46 GLN HG3 H 1 2.604 0.003 . 2 . . . . A 42 GLN HG3 . 34869 2
416 . 1 . 1 46 46 GLN CA C 13 58.702 0.037 . 1 . . . . A 42 GLN CA . 34869 2
417 . 1 . 1 46 46 GLN CB C 13 29.004 0.052 . 1 . . . . A 42 GLN CB . 34869 2
418 . 1 . 1 46 46 GLN CG C 13 34.434 0.016 . 1 . . . . A 42 GLN CG . 34869 2
419 . 1 . 1 47 47 LEU HA H 1 3.959 0.005 . 1 . . . . A 43 LEU HA . 34869 2
420 . 1 . 1 47 47 LEU HB2 H 1 2.015 0.006 . 2 . . . . A 43 LEU HB2 . 34869 2
421 . 1 . 1 47 47 LEU HB3 H 1 1.682 0.006 . 2 . . . . A 43 LEU HB3 . 34869 2
422 . 1 . 1 47 47 LEU HG H 1 1.371 0.002 . 1 . . . . A 43 LEU HG . 34869 2
423 . 1 . 1 47 47 LEU HD11 H 1 0.986 0.004 . 2 . . . . A 43 LEU HD11 . 34869 2
424 . 1 . 1 47 47 LEU HD12 H 1 0.986 0.004 . 2 . . . . A 43 LEU HD12 . 34869 2
425 . 1 . 1 47 47 LEU HD13 H 1 0.986 0.004 . 2 . . . . A 43 LEU HD13 . 34869 2
426 . 1 . 1 47 47 LEU HD21 H 1 0.290 0.003 . 2 . . . . A 43 LEU HD21 . 34869 2
427 . 1 . 1 47 47 LEU HD22 H 1 0.290 0.003 . 2 . . . . A 43 LEU HD22 . 34869 2
428 . 1 . 1 47 47 LEU HD23 H 1 0.290 0.003 . 2 . . . . A 43 LEU HD23 . 34869 2
429 . 1 . 1 47 47 LEU CA C 13 58.394 0.031 . 1 . . . . A 43 LEU CA . 34869 2
430 . 1 . 1 47 47 LEU CB C 13 41.689 0.058 . 1 . . . . A 43 LEU CB . 34869 2
431 . 1 . 1 47 47 LEU CG C 13 26.914 0.014 . 1 . . . . A 43 LEU CG . 34869 2
432 . 1 . 1 47 47 LEU CD1 C 13 23.484 0.042 . 2 . . . . A 43 LEU CD1 . 34869 2
433 . 1 . 1 47 47 LEU CD2 C 13 25.692 0.016 . 2 . . . . A 43 LEU CD2 . 34869 2
434 . 1 . 1 48 48 ALA HA H 1 3.684 0.004 . 1 . . . . A 44 ALA HA . 34869 2
435 . 1 . 1 48 48 ALA HB1 H 1 1.375 0.003 . 1 . . . . A 44 ALA HB1 . 34869 2
436 . 1 . 1 48 48 ALA HB2 H 1 1.375 0.003 . 1 . . . . A 44 ALA HB2 . 34869 2
437 . 1 . 1 48 48 ALA HB3 H 1 1.375 0.003 . 1 . . . . A 44 ALA HB3 . 34869 2
438 . 1 . 1 48 48 ALA CA C 13 56.128 0.021 . 1 . . . . A 44 ALA CA . 34869 2
439 . 1 . 1 48 48 ALA CB C 13 17.287 0.026 . 1 . . . . A 44 ALA CB . 34869 2
440 . 1 . 1 49 49 SER HA H 1 4.288 0.004 . 1 . . . . A 45 SER HA . 34869 2
441 . 1 . 1 49 49 SER HB2 H 1 4.019 0.014 . 2 . . . . A 45 SER HB2 . 34869 2
442 . 1 . 1 49 49 SER HB3 H 1 4.015 0.012 . 2 . . . . A 45 SER HB3 . 34869 2
443 . 1 . 1 49 49 SER CA C 13 61.243 0.048 . 1 . . . . A 45 SER CA . 34869 2
444 . 1 . 1 49 49 SER CB C 13 62.985 0.028 . 1 . . . . A 45 SER CB . 34869 2
445 . 1 . 1 50 50 ARG HA H 1 4.114 0.015 . 1 . . . . A 46 ARG HA . 34869 2
446 . 1 . 1 50 50 ARG HB2 H 1 1.905 0.008 . 2 . . . . A 46 ARG HB2 . 34869 2
447 . 1 . 1 50 50 ARG HB3 H 1 2.137 0.004 . 2 . . . . A 46 ARG HB3 . 34869 2
448 . 1 . 1 50 50 ARG HG2 H 1 1.756 0.008 . 1 . . . . A 46 ARG HG2 . 34869 2
449 . 1 . 1 50 50 ARG HG3 H 1 1.757 0.007 . 1 . . . . A 46 ARG HG3 . 34869 2
450 . 1 . 1 50 50 ARG HD2 H 1 3.135 0.007 . 2 . . . . A 46 ARG HD2 . 34869 2
451 . 1 . 1 50 50 ARG HD3 H 1 3.300 0.009 . 2 . . . . A 46 ARG HD3 . 34869 2
452 . 1 . 1 50 50 ARG CA C 13 59.001 0.001 . 1 . . . . A 46 ARG CA . 34869 2
453 . 1 . 1 50 50 ARG CB C 13 30.028 0.000 . 1 . . . . A 46 ARG CB . 34869 2
454 . 1 . 1 50 50 ARG CG C 13 26.775 0.053 . 1 . . . . A 46 ARG CG . 34869 2
455 . 1 . 1 50 50 ARG CD C 13 42.813 0.045 . 1 . . . . A 46 ARG CD . 34869 2
456 . 1 . 1 51 51 LEU HA H 1 4.071 0.011 . 1 . . . . A 47 LEU HA . 34869 2
457 . 1 . 1 51 51 LEU HB2 H 1 2.115 0.003 . 2 . . . . A 47 LEU HB2 . 34869 2
458 . 1 . 1 51 51 LEU HB3 H 1 1.511 0.005 . 2 . . . . A 47 LEU HB3 . 34869 2
459 . 1 . 1 51 51 LEU HG H 1 2.329 0.004 . 1 . . . . A 47 LEU HG . 34869 2
460 . 1 . 1 51 51 LEU HD11 H 1 0.960 0.006 . 1 . . . . A 47 LEU HD11 . 34869 2
461 . 1 . 1 51 51 LEU HD12 H 1 0.960 0.006 . 1 . . . . A 47 LEU HD12 . 34869 2
462 . 1 . 1 51 51 LEU HD13 H 1 0.960 0.006 . 1 . . . . A 47 LEU HD13 . 34869 2
463 . 1 . 1 51 51 LEU HD21 H 1 0.960 0.006 . 1 . . . . A 47 LEU HD21 . 34869 2
464 . 1 . 1 51 51 LEU HD22 H 1 0.960 0.006 . 1 . . . . A 47 LEU HD22 . 34869 2
465 . 1 . 1 51 51 LEU HD23 H 1 0.960 0.006 . 1 . . . . A 47 LEU HD23 . 34869 2
466 . 1 . 1 51 51 LEU CA C 13 58.228 0.002 . 1 . . . . A 47 LEU CA . 34869 2
467 . 1 . 1 51 51 LEU CB C 13 41.054 0.024 . 1 . . . . A 47 LEU CB . 34869 2
468 . 1 . 1 51 51 LEU CG C 13 26.430 0.011 . 1 . . . . A 47 LEU CG . 34869 2
469 . 1 . 1 51 51 LEU CD1 C 13 27.325 0.046 . 1 . . . . A 47 LEU CD1 . 34869 2
470 . 1 . 1 51 51 LEU CD2 C 13 27.325 0.046 . 1 . . . . A 47 LEU CD2 . 34869 2
471 . 1 . 1 52 52 GLN HA H 1 4.701 0.002 . 1 . . . . A 48 GLN HA . 34869 2
472 . 1 . 1 52 52 GLN HB2 H 1 2.287 0.004 . 2 . . . . A 48 GLN HB2 . 34869 2
473 . 1 . 1 52 52 GLN HB3 H 1 2.536 0.001 . 2 . . . . A 48 GLN HB3 . 34869 2
474 . 1 . 1 52 52 GLN HG2 H 1 2.384 0.005 . 2 . . . . A 48 GLN HG2 . 34869 2
475 . 1 . 1 52 52 GLN HG3 H 1 2.768 0.002 . 2 . . . . A 48 GLN HG3 . 34869 2
476 . 1 . 1 52 52 GLN CA C 13 59.304 0.015 . 1 . . . . A 48 GLN CA . 34869 2
477 . 1 . 1 52 52 GLN CB C 13 28.580 0.087 . 1 . . . . A 48 GLN CB . 34869 2
478 . 1 . 1 52 52 GLN CG C 13 33.499 0.018 . 1 . . . . A 48 GLN CG . 34869 2
479 . 1 . 1 53 53 LYS HA H 1 4.110 0.004 . 1 . . . . A 49 LYS HA . 34869 2
480 . 1 . 1 53 53 LYS HB2 H 1 2.024 0.008 . 1 . . . . A 49 LYS HB2 . 34869 2
481 . 1 . 1 53 53 LYS HB3 H 1 2.024 0.008 . 1 . . . . A 49 LYS HB3 . 34869 2
482 . 1 . 1 53 53 LYS HG2 H 1 1.551 0.002 . 1 . . . . A 49 LYS HG2 . 34869 2
483 . 1 . 1 53 53 LYS HG3 H 1 1.552 0.002 . 1 . . . . A 49 LYS HG3 . 34869 2
484 . 1 . 1 53 53 LYS HD2 H 1 1.723 0.010 . 2 . . . . A 49 LYS HD2 . 34869 2
485 . 1 . 1 53 53 LYS HD3 H 1 1.721 0.011 . 2 . . . . A 49 LYS HD3 . 34869 2
486 . 1 . 1 53 53 LYS HE2 H 1 2.981 0.011 . 2 . . . . A 49 LYS HE2 . 34869 2
487 . 1 . 1 53 53 LYS HE3 H 1 2.971 0.011 . 2 . . . . A 49 LYS HE3 . 34869 2
488 . 1 . 1 53 53 LYS CA C 13 58.848 0.075 . 1 . . . . A 49 LYS CA . 34869 2
489 . 1 . 1 53 53 LYS CB C 13 32.315 0.022 . 1 . . . . A 49 LYS CB . 34869 2
490 . 1 . 1 53 53 LYS CG C 13 25.111 0.002 . 1 . . . . A 49 LYS CG . 34869 2
491 . 1 . 1 53 53 LYS CD C 13 28.853 0.029 . 1 . . . . A 49 LYS CD . 34869 2
492 . 1 . 1 53 53 LYS CE C 13 41.936 0.030 . 1 . . . . A 49 LYS CE . 34869 2
493 . 1 . 1 54 54 ILE HA H 1 3.592 0.006 . 1 . . . . A 50 ILE HA . 34869 2
494 . 1 . 1 54 54 ILE HB H 1 1.218 0.007 . 1 . . . . A 50 ILE HB . 34869 2
495 . 1 . 1 54 54 ILE HG12 H 1 0.881 0.000 . 1 . . . . A 50 ILE HG12 . 34869 2
496 . 1 . 1 54 54 ILE HG21 H 1 0.055 0.002 . 1 . . . . A 50 ILE HG21 . 34869 2
497 . 1 . 1 54 54 ILE HG22 H 1 0.055 0.002 . 1 . . . . A 50 ILE HG22 . 34869 2
498 . 1 . 1 54 54 ILE HG23 H 1 0.055 0.002 . 1 . . . . A 50 ILE HG23 . 34869 2
499 . 1 . 1 54 54 ILE HD11 H 1 0.615 0.004 . 1 . . . . A 50 ILE HD11 . 34869 2
500 . 1 . 1 54 54 ILE HD12 H 1 0.615 0.004 . 1 . . . . A 50 ILE HD12 . 34869 2
501 . 1 . 1 54 54 ILE HD13 H 1 0.615 0.004 . 1 . . . . A 50 ILE HD13 . 34869 2
502 . 1 . 1 54 54 ILE CA C 13 65.223 0.045 . 1 . . . . A 50 ILE CA . 34869 2
503 . 1 . 1 54 54 ILE CB C 13 39.570 0.032 . 1 . . . . A 50 ILE CB . 34869 2
504 . 1 . 1 54 54 ILE CG1 C 13 28.432 0.078 . 1 . . . . A 50 ILE CG1 . 34869 2
505 . 1 . 1 54 54 ILE CG2 C 13 16.220 0.000 . 1 . . . . A 50 ILE CG2 . 34869 2
506 . 1 . 1 54 54 ILE CD1 C 13 14.037 0.007 . 1 . . . . A 50 ILE CD1 . 34869 2
507 . 1 . 1 55 55 PHE HA H 1 4.762 0.001 . 1 . . . . A 51 PHE HA . 34869 2
508 . 1 . 1 55 55 PHE HB2 H 1 3.153 0.006 . 2 . . . . A 51 PHE HB2 . 34869 2
509 . 1 . 1 55 55 PHE HB3 H 1 2.916 0.004 . 2 . . . . A 51 PHE HB3 . 34869 2
510 . 1 . 1 55 55 PHE HD1 H 1 7.440 0.012 . 1 . . . . A 51 PHE HD1 . 34869 2
511 . 1 . 1 55 55 PHE HD2 H 1 7.440 0.012 . 1 . . . . A 51 PHE HD2 . 34869 2
512 . 1 . 1 55 55 PHE HE1 H 1 7.228 0.007 . 1 . . . . A 51 PHE HE1 . 34869 2
513 . 1 . 1 55 55 PHE HE2 H 1 7.228 0.007 . 1 . . . . A 51 PHE HE2 . 34869 2
514 . 1 . 1 55 55 PHE CA C 13 58.841 0.019 . 1 . . . . A 51 PHE CA . 34869 2
515 . 1 . 1 55 55 PHE CB C 13 40.472 0.013 . 1 . . . . A 51 PHE CB . 34869 2
516 . 1 . 1 55 55 PHE CD1 C 13 131.656 0.000 . 1 . . . . A 51 PHE CD1 . 34869 2
517 . 1 . 1 55 55 PHE CD2 C 13 131.656 0.000 . 1 . . . . A 51 PHE CD2 . 34869 2
518 . 1 . 1 55 55 PHE CE1 C 13 131.082 0.014 . 1 . . . . A 51 PHE CE1 . 34869 2
519 . 1 . 1 55 55 PHE CE2 C 13 131.082 0.014 . 1 . . . . A 51 PHE CE2 . 34869 2
520 . 1 . 1 56 56 GLY HA2 H 1 4.027 0.000 . 1 . . . . A 52 GLY HA2 . 34869 2
521 . 1 . 1 56 56 GLY HA3 H 1 4.027 0.000 . 1 . . . . A 52 GLY HA3 . 34869 2
522 . 1 . 1 56 56 GLY CA C 13 46.842 0.000 . 1 . . . . A 52 GLY CA . 34869 2
523 . 1 . 1 57 57 VAL HA H 1 4.495 0.002 . 1 . . . . A 53 VAL HA . 34869 2
524 . 1 . 1 57 57 VAL HB H 1 1.973 0.003 . 1 . . . . A 53 VAL HB . 34869 2
525 . 1 . 1 57 57 VAL HG11 H 1 0.675 0.006 . 2 . . . . A 53 VAL HG11 . 34869 2
526 . 1 . 1 57 57 VAL HG12 H 1 0.675 0.006 . 2 . . . . A 53 VAL HG12 . 34869 2
527 . 1 . 1 57 57 VAL HG13 H 1 0.675 0.006 . 2 . . . . A 53 VAL HG13 . 34869 2
528 . 1 . 1 57 57 VAL HG21 H 1 0.780 0.003 . 2 . . . . A 53 VAL HG21 . 34869 2
529 . 1 . 1 57 57 VAL HG22 H 1 0.780 0.003 . 2 . . . . A 53 VAL HG22 . 34869 2
530 . 1 . 1 57 57 VAL HG23 H 1 0.780 0.003 . 2 . . . . A 53 VAL HG23 . 34869 2
531 . 1 . 1 57 57 VAL CA C 13 58.098 0.012 . 1 . . . . A 53 VAL CA . 34869 2
532 . 1 . 1 57 57 VAL CB C 13 34.805 0.025 . 1 . . . . A 53 VAL CB . 34869 2
533 . 1 . 1 57 57 VAL CG1 C 13 19.122 0.022 . 2 . . . . A 53 VAL CG1 . 34869 2
534 . 1 . 1 57 57 VAL CG2 C 13 21.531 0.049 . 2 . . . . A 53 VAL CG2 . 34869 2
535 . 1 . 1 58 58 GLU HA H 1 4.098 0.003 . 1 . . . . A 54 GLU HA . 34869 2
536 . 1 . 1 58 58 GLU HB2 H 1 1.954 0.017 . 2 . . . . A 54 GLU HB2 . 34869 2
537 . 1 . 1 58 58 GLU HB3 H 1 1.964 0.013 . 2 . . . . A 54 GLU HB3 . 34869 2
538 . 1 . 1 58 58 GLU HG2 H 1 2.230 0.022 . 2 . . . . A 54 GLU HG2 . 34869 2
539 . 1 . 1 58 58 GLU HG3 H 1 2.224 0.008 . 2 . . . . A 54 GLU HG3 . 34869 2
540 . 1 . 1 58 58 GLU CA C 13 57.271 0.031 . 1 . . . . A 54 GLU CA . 34869 2
541 . 1 . 1 58 58 GLU CB C 13 29.608 0.038 . 1 . . . . A 54 GLU CB . 34869 2
542 . 1 . 1 58 58 GLU CG C 13 36.683 0.026 . 1 . . . . A 54 GLU CG . 34869 2
543 . 1 . 1 59 59 VAL HA H 1 4.569 0.003 . 1 . . . . A 55 VAL HA . 34869 2
544 . 1 . 1 59 59 VAL HB H 1 2.387 0.005 . 1 . . . . A 55 VAL HB . 34869 2
545 . 1 . 1 59 59 VAL HG11 H 1 1.008 0.013 . 2 . . . . A 55 VAL HG11 . 34869 2
546 . 1 . 1 59 59 VAL HG12 H 1 1.008 0.013 . 2 . . . . A 55 VAL HG12 . 34869 2
547 . 1 . 1 59 59 VAL HG13 H 1 1.008 0.013 . 2 . . . . A 55 VAL HG13 . 34869 2
548 . 1 . 1 59 59 VAL HG21 H 1 0.979 0.004 . 2 . . . . A 55 VAL HG21 . 34869 2
549 . 1 . 1 59 59 VAL HG22 H 1 0.979 0.004 . 2 . . . . A 55 VAL HG22 . 34869 2
550 . 1 . 1 59 59 VAL HG23 H 1 0.979 0.004 . 2 . . . . A 55 VAL HG23 . 34869 2
551 . 1 . 1 59 59 VAL CA C 13 61.864 0.019 . 1 . . . . A 55 VAL CA . 34869 2
552 . 1 . 1 59 59 VAL CB C 13 34.349 0.010 . 1 . . . . A 55 VAL CB . 34869 2
553 . 1 . 1 59 59 VAL CG1 C 13 21.955 0.022 . 2 . . . . A 55 VAL CG1 . 34869 2
554 . 1 . 1 59 59 VAL CG2 C 13 21.077 0.007 . 2 . . . . A 55 VAL CG2 . 34869 2
555 . 1 . 1 60 60 SER HA H 1 5.044 0.003 . 1 . . . . A 56 SER HA . 34869 2
556 . 1 . 1 60 60 SER HB2 H 1 3.976 0.002 . 2 . . . . A 56 SER HB2 . 34869 2
557 . 1 . 1 60 60 SER HB3 H 1 4.342 0.002 . 2 . . . . A 56 SER HB3 . 34869 2
558 . 1 . 1 60 60 SER CA C 13 55.974 0.016 . 1 . . . . A 56 SER CA . 34869 2
559 . 1 . 1 60 60 SER CB C 13 67.065 0.010 . 1 . . . . A 56 SER CB . 34869 2
560 . 1 . 1 61 61 THR HA H 1 3.619 0.004 . 1 . . . . A 57 THR HA . 34869 2
561 . 1 . 1 61 61 THR HB H 1 4.121 0.003 . 1 . . . . A 57 THR HB . 34869 2
562 . 1 . 1 61 61 THR HG21 H 1 1.269 0.003 . 1 . . . . A 57 THR HG21 . 34869 2
563 . 1 . 1 61 61 THR HG22 H 1 1.269 0.003 . 1 . . . . A 57 THR HG22 . 34869 2
564 . 1 . 1 61 61 THR HG23 H 1 1.269 0.003 . 1 . . . . A 57 THR HG23 . 34869 2
565 . 1 . 1 61 61 THR CA C 13 66.812 0.050 . 1 . . . . A 57 THR CA . 34869 2
566 . 1 . 1 61 61 THR CB C 13 67.859 0.016 . 1 . . . . A 57 THR CB . 34869 2
567 . 1 . 1 61 61 THR CG2 C 13 23.504 0.034 . 1 . . . . A 57 THR CG2 . 34869 2
568 . 1 . 1 62 62 GLU HA H 1 3.985 0.004 . 1 . . . . A 58 GLU HA . 34869 2
569 . 1 . 1 62 62 GLU HB2 H 1 2.004 0.007 . 2 . . . . A 58 GLU HB2 . 34869 2
570 . 1 . 1 62 62 GLU HB3 H 1 1.944 0.011 . 2 . . . . A 58 GLU HB3 . 34869 2
571 . 1 . 1 62 62 GLU HG2 H 1 2.286 0.008 . 2 . . . . A 58 GLU HG2 . 34869 2
572 . 1 . 1 62 62 GLU HG3 H 1 2.289 0.007 . 2 . . . . A 58 GLU HG3 . 34869 2
573 . 1 . 1 62 62 GLU CA C 13 60.045 0.050 . 1 . . . . A 58 GLU CA . 34869 2
574 . 1 . 1 62 62 GLU CB C 13 29.057 0.011 . 1 . . . . A 58 GLU CB . 34869 2
575 . 1 . 1 62 62 GLU CG C 13 36.941 0.033 . 1 . . . . A 58 GLU CG . 34869 2
576 . 1 . 1 63 63 ASP HA H 1 4.121 0.003 . 1 . . . . A 59 ASP HA . 34869 2
577 . 1 . 1 63 63 ASP HB2 H 1 1.773 0.004 . 2 . . . . A 59 ASP HB2 . 34869 2
578 . 1 . 1 63 63 ASP HB3 H 1 2.977 0.009 . 2 . . . . A 59 ASP HB3 . 34869 2
579 . 1 . 1 63 63 ASP CA C 13 57.728 0.025 . 1 . . . . A 59 ASP CA . 34869 2
580 . 1 . 1 63 63 ASP CB C 13 41.137 0.034 . 1 . . . . A 59 ASP CB . 34869 2
581 . 1 . 1 64 64 VAL H H 1 7.300 0.000 . 1 . . . . A 60 VAL H . 34869 2
582 . 1 . 1 64 64 VAL HA H 1 3.325 0.002 . 1 . . . . A 60 VAL HA . 34869 2
583 . 1 . 1 64 64 VAL HB H 1 1.918 0.017 . 1 . . . . A 60 VAL HB . 34869 2
584 . 1 . 1 64 64 VAL HG11 H 1 0.774 0.010 . 2 . . . . A 60 VAL HG11 . 34869 2
585 . 1 . 1 64 64 VAL HG12 H 1 0.774 0.010 . 2 . . . . A 60 VAL HG12 . 34869 2
586 . 1 . 1 64 64 VAL HG13 H 1 0.774 0.010 . 2 . . . . A 60 VAL HG13 . 34869 2
587 . 1 . 1 64 64 VAL HG21 H 1 -0.026 0.002 . 2 . . . . A 60 VAL HG21 . 34869 2
588 . 1 . 1 64 64 VAL HG22 H 1 -0.026 0.002 . 2 . . . . A 60 VAL HG22 . 34869 2
589 . 1 . 1 64 64 VAL HG23 H 1 -0.026 0.002 . 2 . . . . A 60 VAL HG23 . 34869 2
590 . 1 . 1 64 64 VAL CA C 13 65.975 0.012 . 1 . . . . A 60 VAL CA . 34869 2
591 . 1 . 1 64 64 VAL CB C 13 30.949 0.067 . 1 . . . . A 60 VAL CB . 34869 2
592 . 1 . 1 64 64 VAL CG1 C 13 21.659 0.054 . 2 . . . . A 60 VAL CG1 . 34869 2
593 . 1 . 1 64 64 VAL CG2 C 13 21.806 0.013 . 2 . . . . A 60 VAL CG2 . 34869 2
594 . 1 . 1 65 65 PHE HA H 1 4.098 0.004 . 1 . . . . A 61 PHE HA . 34869 2
595 . 1 . 1 65 65 PHE HB2 H 1 2.929 0.002 . 1 . . . . A 61 PHE HB2 . 34869 2
596 . 1 . 1 65 65 PHE HB3 H 1 2.929 0.002 . 1 . . . . A 61 PHE HB3 . 34869 2
597 . 1 . 1 65 65 PHE HD1 H 1 7.043 0.016 . 1 . . . . A 61 PHE HD1 . 34869 2
598 . 1 . 1 65 65 PHE HD2 H 1 7.043 0.016 . 1 . . . . A 61 PHE HD2 . 34869 2
599 . 1 . 1 65 65 PHE CA C 13 60.551 0.049 . 1 . . . . A 61 PHE CA . 34869 2
600 . 1 . 1 65 65 PHE CB C 13 39.052 0.024 . 1 . . . . A 61 PHE CB . 34869 2
601 . 1 . 1 65 65 PHE CD1 C 13 131.304 0.068 . 1 . . . . A 61 PHE CD1 . 34869 2
602 . 1 . 1 65 65 PHE CD2 C 13 131.304 0.068 . 1 . . . . A 61 PHE CD2 . 34869 2
603 . 1 . 1 66 66 ARG HA H 1 3.834 0.002 . 1 . . . . A 62 ARG HA . 34869 2
604 . 1 . 1 66 66 ARG HB2 H 1 1.288 0.003 . 2 . . . . A 62 ARG HB2 . 34869 2
605 . 1 . 1 66 66 ARG HB3 H 1 1.545 0.002 . 2 . . . . A 62 ARG HB3 . 34869 2
606 . 1 . 1 66 66 ARG HG2 H 1 1.215 0.003 . 2 . . . . A 62 ARG HG2 . 34869 2
607 . 1 . 1 66 66 ARG HG3 H 1 1.479 0.002 . 2 . . . . A 62 ARG HG3 . 34869 2
608 . 1 . 1 66 66 ARG HD2 H 1 3.091 0.013 . 2 . . . . A 62 ARG HD2 . 34869 2
609 . 1 . 1 66 66 ARG HD3 H 1 3.011 0.011 . 2 . . . . A 62 ARG HD3 . 34869 2
610 . 1 . 1 66 66 ARG CA C 13 58.026 0.026 . 1 . . . . A 62 ARG CA . 34869 2
611 . 1 . 1 66 66 ARG CB C 13 30.925 0.008 . 1 . . . . A 62 ARG CB . 34869 2
612 . 1 . 1 66 66 ARG CG C 13 28.101 0.019 . 1 . . . . A 62 ARG CG . 34869 2
613 . 1 . 1 66 66 ARG CD C 13 43.017 0.018 . 1 . . . . A 62 ARG CD . 34869 2
614 . 1 . 1 67 67 HIS HA H 1 4.721 0.003 . 1 . . . . A 63 HIS HA . 34869 2
615 . 1 . 1 67 67 HIS HB2 H 1 3.053 0.005 . 2 . . . . A 63 HIS HB2 . 34869 2
616 . 1 . 1 67 67 HIS HB3 H 1 2.541 0.002 . 2 . . . . A 63 HIS HB3 . 34869 2
617 . 1 . 1 67 67 HIS HD2 H 1 6.707 0.004 . 1 . . . . A 63 HIS HD2 . 34869 2
618 . 1 . 1 67 67 HIS HE1 H 1 7.942 0.002 . 1 . . . . A 63 HIS HE1 . 34869 2
619 . 1 . 1 67 67 HIS CA C 13 54.480 0.020 . 1 . . . . A 63 HIS CA . 34869 2
620 . 1 . 1 67 67 HIS CB C 13 28.006 0.027 . 1 . . . . A 63 HIS CB . 34869 2
621 . 1 . 1 67 67 HIS CD2 C 13 121.627 0.011 . 1 . . . . A 63 HIS CD2 . 34869 2
622 . 1 . 1 67 67 HIS CE1 C 13 137.499 0.000 . 1 . . . . A 63 HIS CE1 . 34869 2
623 . 1 . 1 68 68 GLY HA2 H 1 4.410 0.004 . 2 . . . . A 64 GLY HA2 . 34869 2
624 . 1 . 1 68 68 GLY HA3 H 1 3.679 0.004 . 2 . . . . A 64 GLY HA3 . 34869 2
625 . 1 . 1 68 68 GLY CA C 13 49.352 0.028 . 1 . . . . A 64 GLY CA . 34869 2
626 . 1 . 1 69 69 THR HA H 1 3.787 0.002 . 1 . . . . A 65 THR HA . 34869 2
627 . 1 . 1 69 69 THR HB H 1 4.134 0.002 . 1 . . . . A 65 THR HB . 34869 2
628 . 1 . 1 69 69 THR HG21 H 1 0.816 0.001 . 1 . . . . A 65 THR HG21 . 34869 2
629 . 1 . 1 69 69 THR HG22 H 1 0.816 0.001 . 1 . . . . A 65 THR HG22 . 34869 2
630 . 1 . 1 69 69 THR HG23 H 1 0.816 0.001 . 1 . . . . A 65 THR HG23 . 34869 2
631 . 1 . 1 69 69 THR CA C 13 58.215 0.009 . 1 . . . . A 65 THR CA . 34869 2
632 . 1 . 1 69 69 THR CB C 13 73.208 0.004 . 1 . . . . A 65 THR CB . 34869 2
633 . 1 . 1 69 69 THR CG2 C 13 21.493 0.021 . 1 . . . . A 65 THR CG2 . 34869 2
634 . 1 . 1 70 70 VAL HA H 1 3.589 0.008 . 1 . . . . A 66 VAL HA . 34869 2
635 . 1 . 1 70 70 VAL HB H 1 2.296 0.002 . 1 . . . . A 66 VAL HB . 34869 2
636 . 1 . 1 70 70 VAL HG11 H 1 1.336 0.015 . 2 . . . . A 66 VAL HG11 . 34869 2
637 . 1 . 1 70 70 VAL HG12 H 1 1.336 0.015 . 2 . . . . A 66 VAL HG12 . 34869 2
638 . 1 . 1 70 70 VAL HG13 H 1 1.336 0.015 . 2 . . . . A 66 VAL HG13 . 34869 2
639 . 1 . 1 70 70 VAL HG21 H 1 1.120 0.006 . 2 . . . . A 66 VAL HG21 . 34869 2
640 . 1 . 1 70 70 VAL HG22 H 1 1.120 0.006 . 2 . . . . A 66 VAL HG22 . 34869 2
641 . 1 . 1 70 70 VAL HG23 H 1 1.120 0.006 . 2 . . . . A 66 VAL HG23 . 34869 2
642 . 1 . 1 70 70 VAL CA C 13 67.471 0.018 . 1 . . . . A 66 VAL CA . 34869 2
643 . 1 . 1 70 70 VAL CB C 13 30.627 0.009 . 1 . . . . A 66 VAL CB . 34869 2
644 . 1 . 1 70 70 VAL CG1 C 13 23.632 0.016 . 2 . . . . A 66 VAL CG1 . 34869 2
645 . 1 . 1 70 70 VAL CG2 C 13 22.864 0.020 . 2 . . . . A 66 VAL CG2 . 34869 2
646 . 1 . 1 71 71 GLU HA H 1 3.931 0.003 . 1 . . . . A 67 GLU HA . 34869 2
647 . 1 . 1 71 71 GLU HB2 H 1 1.976 0.021 . 2 . . . . A 67 GLU HB2 . 34869 2
648 . 1 . 1 71 71 GLU HB3 H 1 1.916 0.023 . 2 . . . . A 67 GLU HB3 . 34869 2
649 . 1 . 1 71 71 GLU HG2 H 1 2.100 0.003 . 2 . . . . A 67 GLU HG2 . 34869 2
650 . 1 . 1 71 71 GLU HG3 H 1 2.363 0.003 . 2 . . . . A 67 GLU HG3 . 34869 2
651 . 1 . 1 71 71 GLU CA C 13 59.841 0.018 . 1 . . . . A 67 GLU CA . 34869 2
652 . 1 . 1 71 71 GLU CB C 13 30.207 0.050 . 1 . . . . A 67 GLU CB . 34869 2
653 . 1 . 1 71 71 GLU CG C 13 36.091 0.026 . 1 . . . . A 67 GLU CG . 34869 2
654 . 1 . 1 72 72 GLN HA H 1 4.079 0.004 . 1 . . . . A 68 GLN HA . 34869 2
655 . 1 . 1 72 72 GLN HB2 H 1 2.312 0.008 . 2 . . . . A 68 GLN HB2 . 34869 2
656 . 1 . 1 72 72 GLN HB3 H 1 1.899 0.007 . 2 . . . . A 68 GLN HB3 . 34869 2
657 . 1 . 1 72 72 GLN HG2 H 1 2.460 0.001 . 1 . . . . A 68 GLN HG2 . 34869 2
658 . 1 . 1 72 72 GLN HG3 H 1 2.460 0.001 . 1 . . . . A 68 GLN HG3 . 34869 2
659 . 1 . 1 72 72 GLN CA C 13 58.725 0.101 . 1 . . . . A 68 GLN CA . 34869 2
660 . 1 . 1 72 72 GLN CB C 13 29.636 0.029 . 1 . . . . A 68 GLN CB . 34869 2
661 . 1 . 1 72 72 GLN CG C 13 34.875 0.016 . 1 . . . . A 68 GLN CG . 34869 2
662 . 1 . 1 73 73 LEU HA H 1 4.246 0.004 . 1 . . . . A 69 LEU HA . 34869 2
663 . 1 . 1 73 73 LEU HB2 H 1 1.983 0.005 . 2 . . . . A 69 LEU HB2 . 34869 2
664 . 1 . 1 73 73 LEU HB3 H 1 2.412 0.008 . 2 . . . . A 69 LEU HB3 . 34869 2
665 . 1 . 1 73 73 LEU HG H 1 1.716 0.017 . 1 . . . . A 69 LEU HG . 34869 2
666 . 1 . 1 73 73 LEU HD11 H 1 0.882 0.002 . 2 . . . . A 69 LEU HD11 . 34869 2
667 . 1 . 1 73 73 LEU HD12 H 1 0.882 0.002 . 2 . . . . A 69 LEU HD12 . 34869 2
668 . 1 . 1 73 73 LEU HD13 H 1 0.882 0.002 . 2 . . . . A 69 LEU HD13 . 34869 2
669 . 1 . 1 73 73 LEU HD21 H 1 0.975 0.004 . 2 . . . . A 69 LEU HD21 . 34869 2
670 . 1 . 1 73 73 LEU HD22 H 1 0.975 0.004 . 2 . . . . A 69 LEU HD22 . 34869 2
671 . 1 . 1 73 73 LEU HD23 H 1 0.975 0.004 . 2 . . . . A 69 LEU HD23 . 34869 2
672 . 1 . 1 73 73 LEU CA C 13 57.710 0.019 . 1 . . . . A 69 LEU CA . 34869 2
673 . 1 . 1 73 73 LEU CB C 13 41.494 0.038 . 1 . . . . A 69 LEU CB . 34869 2
674 . 1 . 1 73 73 LEU CG C 13 27.246 0.008 . 1 . . . . A 69 LEU CG . 34869 2
675 . 1 . 1 73 73 LEU CD1 C 13 28.411 0.031 . 2 . . . . A 69 LEU CD1 . 34869 2
676 . 1 . 1 73 73 LEU CD2 C 13 23.025 0.094 . 2 . . . . A 69 LEU CD2 . 34869 2
677 . 1 . 1 74 74 ALA HA H 1 3.788 0.003 . 1 . . . . A 70 ALA HA . 34869 2
678 . 1 . 1 74 74 ALA HB1 H 1 1.415 0.004 . 1 . . . . A 70 ALA HB1 . 34869 2
679 . 1 . 1 74 74 ALA HB2 H 1 1.415 0.004 . 1 . . . . A 70 ALA HB2 . 34869 2
680 . 1 . 1 74 74 ALA HB3 H 1 1.415 0.004 . 1 . . . . A 70 ALA HB3 . 34869 2
681 . 1 . 1 74 74 ALA CA C 13 55.559 0.020 . 1 . . . . A 70 ALA CA . 34869 2
682 . 1 . 1 74 74 ALA CB C 13 18.540 0.066 . 1 . . . . A 70 ALA CB . 34869 2
683 . 1 . 1 75 75 ARG HA H 1 4.089 0.003 . 1 . . . . A 71 ARG HA . 34869 2
684 . 1 . 1 75 75 ARG HB2 H 1 1.952 0.001 . 1 . . . . A 71 ARG HB2 . 34869 2
685 . 1 . 1 75 75 ARG HB3 H 1 1.952 0.002 . 1 . . . . A 71 ARG HB3 . 34869 2
686 . 1 . 1 75 75 ARG HG2 H 1 1.754 0.015 . 2 . . . . A 71 ARG HG2 . 34869 2
687 . 1 . 1 75 75 ARG HG3 H 1 1.700 0.018 . 2 . . . . A 71 ARG HG3 . 34869 2
688 . 1 . 1 75 75 ARG HD2 H 1 3.251 0.003 . 2 . . . . A 71 ARG HD2 . 34869 2
689 . 1 . 1 75 75 ARG HD3 H 1 3.252 0.003 . 2 . . . . A 71 ARG HD3 . 34869 2
690 . 1 . 1 75 75 ARG CA C 13 59.010 0.032 . 1 . . . . A 71 ARG CA . 34869 2
691 . 1 . 1 75 75 ARG CB C 13 29.765 0.002 . 1 . . . . A 71 ARG CB . 34869 2
692 . 1 . 1 75 75 ARG CG C 13 27.154 0.036 . 1 . . . . A 71 ARG CG . 34869 2
693 . 1 . 1 75 75 ARG CD C 13 43.342 0.011 . 1 . . . . A 71 ARG CD . 34869 2
694 . 1 . 1 76 76 PHE HA H 1 4.144 0.005 . 1 . . . . A 72 PHE HA . 34869 2
695 . 1 . 1 76 76 PHE HB2 H 1 3.082 0.002 . 2 . . . . A 72 PHE HB2 . 34869 2
696 . 1 . 1 76 76 PHE HB3 H 1 2.318 0.002 . 2 . . . . A 72 PHE HB3 . 34869 2
697 . 1 . 1 76 76 PHE HD1 H 1 6.890 0.007 . 1 . . . . A 72 PHE HD1 . 34869 2
698 . 1 . 1 76 76 PHE HD2 H 1 6.890 0.007 . 1 . . . . A 72 PHE HD2 . 34869 2
699 . 1 . 1 76 76 PHE HE1 H 1 7.301 0.006 . 1 . . . . A 72 PHE HE1 . 34869 2
700 . 1 . 1 76 76 PHE HE2 H 1 7.301 0.006 . 1 . . . . A 72 PHE HE2 . 34869 2
701 . 1 . 1 76 76 PHE HZ H 1 7.357 0.002 . 1 . . . . A 72 PHE HZ . 34869 2
702 . 1 . 1 76 76 PHE CA C 13 60.748 0.026 . 1 . . . . A 72 PHE CA . 34869 2
703 . 1 . 1 76 76 PHE CB C 13 38.002 0.017 . 1 . . . . A 72 PHE CB . 34869 2
704 . 1 . 1 76 76 PHE CD1 C 13 131.092 0.030 . 1 . . . . A 72 PHE CD1 . 34869 2
705 . 1 . 1 76 76 PHE CD2 C 13 131.092 0.030 . 1 . . . . A 72 PHE CD2 . 34869 2
706 . 1 . 1 76 76 PHE CE1 C 13 131.022 0.033 . 1 . . . . A 72 PHE CE1 . 34869 2
707 . 1 . 1 76 76 PHE CE2 C 13 131.022 0.033 . 1 . . . . A 72 PHE CE2 . 34869 2
708 . 1 . 1 76 76 PHE CZ C 13 131.049 0.000 . 1 . . . . A 72 PHE CZ . 34869 2
709 . 1 . 1 77 77 VAL HA H 1 2.913 0.002 . 1 . . . . A 73 VAL HA . 34869 2
710 . 1 . 1 77 77 VAL HB H 1 1.845 0.010 . 1 . . . . A 73 VAL HB . 34869 2
711 . 1 . 1 77 77 VAL HG11 H 1 0.057 0.003 . 2 . . . . A 73 VAL HG11 . 34869 2
712 . 1 . 1 77 77 VAL HG12 H 1 0.057 0.003 . 2 . . . . A 73 VAL HG12 . 34869 2
713 . 1 . 1 77 77 VAL HG13 H 1 0.057 0.003 . 2 . . . . A 73 VAL HG13 . 34869 2
714 . 1 . 1 77 77 VAL HG21 H 1 0.780 0.005 . 2 . . . . A 73 VAL HG21 . 34869 2
715 . 1 . 1 77 77 VAL HG22 H 1 0.780 0.005 . 2 . . . . A 73 VAL HG22 . 34869 2
716 . 1 . 1 77 77 VAL HG23 H 1 0.780 0.005 . 2 . . . . A 73 VAL HG23 . 34869 2
717 . 1 . 1 77 77 VAL CA C 13 67.113 0.016 . 1 . . . . A 73 VAL CA . 34869 2
718 . 1 . 1 77 77 VAL CB C 13 30.837 0.005 . 1 . . . . A 73 VAL CB . 34869 2
719 . 1 . 1 77 77 VAL CG1 C 13 20.246 0.038 . 2 . . . . A 73 VAL CG1 . 34869 2
720 . 1 . 1 77 77 VAL CG2 C 13 21.848 0.047 . 2 . . . . A 73 VAL CG2 . 34869 2
721 . 1 . 1 78 78 GLU HA H 1 3.636 0.005 . 1 . . . . A 74 GLU HA . 34869 2
722 . 1 . 1 78 78 GLU HB2 H 1 2.071 0.010 . 2 . . . . A 74 GLU HB2 . 34869 2
723 . 1 . 1 78 78 GLU HB3 H 1 2.080 0.012 . 2 . . . . A 74 GLU HB3 . 34869 2
724 . 1 . 1 78 78 GLU HG2 H 1 2.138 0.012 . 2 . . . . A 74 GLU HG2 . 34869 2
725 . 1 . 1 78 78 GLU HG3 H 1 2.228 0.011 . 2 . . . . A 74 GLU HG3 . 34869 2
726 . 1 . 1 78 78 GLU CA C 13 59.808 0.047 . 1 . . . . A 74 GLU CA . 34869 2
727 . 1 . 1 78 78 GLU CB C 13 29.880 0.035 . 1 . . . . A 74 GLU CB . 34869 2
728 . 1 . 1 78 78 GLU CG C 13 36.453 0.026 . 1 . . . . A 74 GLU CG . 34869 2
729 . 1 . 1 79 79 GLN HA H 1 4.062 0.003 . 1 . . . . A 75 GLN HA . 34869 2
730 . 1 . 1 79 79 GLN HB2 H 1 2.045 0.027 . 2 . . . . A 75 GLN HB2 . 34869 2
731 . 1 . 1 79 79 GLN HB3 H 1 2.090 0.002 . 2 . . . . A 75 GLN HB3 . 34869 2
732 . 1 . 1 79 79 GLN HG2 H 1 2.522 0.004 . 2 . . . . A 75 GLN HG2 . 34869 2
733 . 1 . 1 79 79 GLN HG3 H 1 2.387 0.010 . 2 . . . . A 75 GLN HG3 . 34869 2
734 . 1 . 1 79 79 GLN CA C 13 58.104 0.044 . 1 . . . . A 75 GLN CA . 34869 2
735 . 1 . 1 79 79 GLN CB C 13 28.296 0.017 . 1 . . . . A 75 GLN CB . 34869 2
736 . 1 . 1 79 79 GLN CG C 13 34.144 0.059 . 1 . . . . A 75 GLN CG . 34869 2
737 . 1 . 1 80 80 SER HA H 1 4.087 0.002 . 1 . . . . A 76 SER HA . 34869 2
738 . 1 . 1 80 80 SER HB2 H 1 3.596 0.034 . 2 . . . . A 76 SER HB2 . 34869 2
739 . 1 . 1 80 80 SER HB3 H 1 3.554 0.024 . 2 . . . . A 76 SER HB3 . 34869 2
740 . 1 . 1 80 80 SER CA C 13 60.831 0.007 . 1 . . . . A 76 SER CA . 34869 2
741 . 1 . 1 80 80 SER CB C 13 62.877 0.036 . 1 . . . . A 76 SER CB . 34869 2
742 . 1 . 1 81 81 ARG HA H 1 4.110 0.004 . 1 . . . . A 77 ARG HA . 34869 2
743 . 1 . 1 81 81 ARG HB2 H 1 1.864 0.022 . 2 . . . . A 77 ARG HB2 . 34869 2
744 . 1 . 1 81 81 ARG HB3 H 1 1.876 0.019 . 2 . . . . A 77 ARG HB3 . 34869 2
745 . 1 . 1 81 81 ARG HG2 H 1 1.663 0.015 . 2 . . . . A 77 ARG HG2 . 34869 2
746 . 1 . 1 81 81 ARG HG3 H 1 1.768 0.007 . 2 . . . . A 77 ARG HG3 . 34869 2
747 . 1 . 1 81 81 ARG HD2 H 1 3.167 0.006 . 2 . . . . A 77 ARG HD2 . 34869 2
748 . 1 . 1 81 81 ARG HD3 H 1 3.064 0.002 . 2 . . . . A 77 ARG HD3 . 34869 2
749 . 1 . 1 81 81 ARG CA C 13 57.517 0.049 . 1 . . . . A 77 ARG CA . 34869 2
750 . 1 . 1 81 81 ARG CB C 13 30.696 0.073 . 1 . . . . A 77 ARG CB . 34869 2
751 . 1 . 1 81 81 ARG CG C 13 26.770 0.043 . 1 . . . . A 77 ARG CG . 34869 2
752 . 1 . 1 81 81 ARG CD C 13 44.097 0.015 . 1 . . . . A 77 ARG CD . 34869 2
753 . 1 . 1 82 82 ASP HA H 1 4.647 0.005 . 1 . . . . A 78 ASP HA . 34869 2
754 . 1 . 1 82 82 ASP HB2 H 1 2.809 0.003 . 2 . . . . A 78 ASP HB2 . 34869 2
755 . 1 . 1 82 82 ASP HB3 H 1 2.703 0.002 . 2 . . . . A 78 ASP HB3 . 34869 2
756 . 1 . 1 82 82 ASP CA C 13 55.159 0.028 . 1 . . . . A 78 ASP CA . 34869 2
757 . 1 . 1 82 82 ASP CB C 13 41.022 0.012 . 1 . . . . A 78 ASP CB . 34869 2
758 . 1 . 1 83 83 THR HA H 1 4.281 0.001 . 1 . . . . A 79 THR HA . 34869 2
759 . 1 . 1 83 83 THR HB H 1 4.341 0.002 . 1 . . . . A 79 THR HB . 34869 2
760 . 1 . 1 83 83 THR HG21 H 1 1.267 0.005 . 1 . . . . A 79 THR HG21 . 34869 2
761 . 1 . 1 83 83 THR HG22 H 1 1.267 0.005 . 1 . . . . A 79 THR HG22 . 34869 2
762 . 1 . 1 83 83 THR HG23 H 1 1.267 0.005 . 1 . . . . A 79 THR HG23 . 34869 2
763 . 1 . 1 83 83 THR CA C 13 62.899 0.005 . 1 . . . . A 79 THR CA . 34869 2
764 . 1 . 1 83 83 THR CB C 13 69.481 0.007 . 1 . . . . A 79 THR CB . 34869 2
765 . 1 . 1 83 83 THR CG2 C 13 21.610 0.033 . 1 . . . . A 79 THR CG2 . 34869 2
766 . 1 . 1 84 84 GLY HA2 H 1 3.986 0.003 . 1 . . . . A 80 GLY HA2 . 34869 2
767 . 1 . 1 84 84 GLY HA3 H 1 3.986 0.003 . 1 . . . . A 80 GLY HA3 . 34869 2
768 . 1 . 1 84 84 GLY CA C 13 45.559 0.007 . 1 . . . . A 80 GLY CA . 34869 2
769 . 1 . 1 85 85 ARG HA H 1 4.339 0.002 . 1 . . . . A 81 ARG HA . 34869 2
770 . 1 . 1 85 85 ARG HB2 H 1 1.849 0.016 . 2 . . . . A 81 ARG HB2 . 34869 2
771 . 1 . 1 85 85 ARG HB3 H 1 1.808 0.028 . 2 . . . . A 81 ARG HB3 . 34869 2
772 . 1 . 1 85 85 ARG HG2 H 1 1.623 0.015 . 2 . . . . A 81 ARG HG2 . 34869 2
773 . 1 . 1 85 85 ARG HG3 H 1 1.634 0.015 . 2 . . . . A 81 ARG HG3 . 34869 2
774 . 1 . 1 85 85 ARG HD2 H 1 3.220 0.001 . 1 . . . . A 81 ARG HD2 . 34869 2
775 . 1 . 1 85 85 ARG HD3 H 1 3.220 0.001 . 1 . . . . A 81 ARG HD3 . 34869 2
776 . 1 . 1 85 85 ARG CA C 13 55.944 0.029 . 1 . . . . A 81 ARG CA . 34869 2
777 . 1 . 1 85 85 ARG CB C 13 30.863 0.020 . 1 . . . . A 81 ARG CB . 34869 2
778 . 1 . 1 85 85 ARG CG C 13 27.173 0.048 . 1 . . . . A 81 ARG CG . 34869 2
779 . 1 . 1 85 85 ARG CD C 13 43.276 0.011 . 1 . . . . A 81 ARG CD . 34869 2
780 . 1 . 1 86 86 ASN HA H 1 4.994 0.006 . 1 . . . . A 82 ASN HA . 34869 2
781 . 1 . 1 86 86 ASN HB2 H 1 2.876 0.015 . 2 . . . . A 82 ASN HB2 . 34869 2
782 . 1 . 1 86 86 ASN HB3 H 1 2.742 0.004 . 2 . . . . A 82 ASN HB3 . 34869 2
783 . 1 . 1 86 86 ASN CA C 13 51.168 0.035 . 1 . . . . A 82 ASN CA . 34869 2
784 . 1 . 1 86 86 ASN CB C 13 38.849 0.037 . 1 . . . . A 82 ASN CB . 34869 2
785 . 1 . 1 87 87 PRO HA H 1 4.420 0.002 . 1 . . . . A 83 PRO HA . 34869 2
786 . 1 . 1 87 87 PRO HB2 H 1 2.305 0.017 . 2 . . . . A 83 PRO HB2 . 34869 2
787 . 1 . 1 87 87 PRO HB3 H 1 1.975 0.024 . 2 . . . . A 83 PRO HB3 . 34869 2
788 . 1 . 1 87 87 PRO HG2 H 1 2.028 0.003 . 1 . . . . A 83 PRO HG2 . 34869 2
789 . 1 . 1 87 87 PRO HG3 H 1 2.028 0.003 . 1 . . . . A 83 PRO HG3 . 34869 2
790 . 1 . 1 87 87 PRO HD2 H 1 3.810 0.019 . 2 . . . . A 83 PRO HD2 . 34869 2
791 . 1 . 1 87 87 PRO HD3 H 1 3.777 0.017 . 2 . . . . A 83 PRO HD3 . 34869 2
792 . 1 . 1 87 87 PRO CA C 13 63.611 0.011 . 1 . . . . A 83 PRO CA . 34869 2
793 . 1 . 1 87 87 PRO CB C 13 32.038 0.023 . 1 . . . . A 83 PRO CB . 34869 2
794 . 1 . 1 87 87 PRO CG C 13 27.247 0.035 . 1 . . . . A 83 PRO CG . 34869 2
795 . 1 . 1 87 87 PRO CD C 13 50.800 0.010 . 1 . . . . A 83 PRO CD . 34869 2
796 . 1 . 1 88 88 ALA HA H 1 4.310 0.000 . 1 . . . . A 84 ALA HA . 34869 2
797 . 1 . 1 88 88 ALA HB1 H 1 1.401 0.000 . 1 . . . . A 84 ALA HB1 . 34869 2
798 . 1 . 1 88 88 ALA HB2 H 1 1.401 0.000 . 1 . . . . A 84 ALA HB2 . 34869 2
799 . 1 . 1 88 88 ALA HB3 H 1 1.401 0.000 . 1 . . . . A 84 ALA HB3 . 34869 2
800 . 1 . 1 88 88 ALA CA C 13 52.366 0.000 . 1 . . . . A 84 ALA CA . 34869 2
801 . 1 . 1 88 88 ALA CB C 13 18.986 0.000 . 1 . . . . A 84 ALA CB . 34869 2
802 . 1 . 1 89 89 ALA HA H 1 4.373 0.000 . 1 . . . . A 85 ALA HA . 34869 2
803 . 1 . 1 89 89 ALA HB1 H 1 1.418 0.003 . 1 . . . . A 85 ALA HB1 . 34869 2
804 . 1 . 1 89 89 ALA HB2 H 1 1.418 0.003 . 1 . . . . A 85 ALA HB2 . 34869 2
805 . 1 . 1 89 89 ALA HB3 H 1 1.418 0.003 . 1 . . . . A 85 ALA HB3 . 34869 2
806 . 1 . 1 89 89 ALA CA C 13 52.303 0.000 . 1 . . . . A 85 ALA CA . 34869 2
807 . 1 . 1 89 89 ALA CB C 13 19.217 0.000 . 1 . . . . A 85 ALA CB . 34869 2
808 . 1 . 1 90 90 GLN HA H 1 4.428 0.006 . 1 . . . . A 86 GLN HA . 34869 2
809 . 1 . 1 90 90 GLN HB2 H 1 2.180 0.009 . 2 . . . . A 86 GLN HB2 . 34869 2
810 . 1 . 1 90 90 GLN HB3 H 1 2.033 0.000 . 2 . . . . A 86 GLN HB3 . 34869 2
811 . 1 . 1 90 90 GLN HG2 H 1 2.406 0.000 . 2 . . . . A 86 GLN HG2 . 34869 2
812 . 1 . 1 90 90 GLN HG3 H 1 2.402 0.003 . 2 . . . . A 86 GLN HG3 . 34869 2
813 . 1 . 1 90 90 GLN CA C 13 55.632 0.064 . 1 . . . . A 86 GLN CA . 34869 2
814 . 1 . 1 90 90 GLN CB C 13 29.517 0.030 . 1 . . . . A 86 GLN CB . 34869 2
815 . 1 . 1 90 90 GLN CG C 13 33.837 0.000 . 1 . . . . A 86 GLN CG . 34869 2
816 . 1 . 1 91 91 THR HA H 1 4.368 0.001 . 1 . . . . A 87 THR HA . 34869 2
817 . 1 . 1 91 91 THR HB H 1 4.261 0.002 . 1 . . . . A 87 THR HB . 34869 2
818 . 1 . 1 91 91 THR HG21 H 1 1.213 0.000 . 1 . . . . A 87 THR HG21 . 34869 2
819 . 1 . 1 91 91 THR HG22 H 1 1.213 0.000 . 1 . . . . A 87 THR HG22 . 34869 2
820 . 1 . 1 91 91 THR HG23 H 1 1.213 0.000 . 1 . . . . A 87 THR HG23 . 34869 2
821 . 1 . 1 91 91 THR CA C 13 61.730 0.004 . 1 . . . . A 87 THR CA . 34869 2
822 . 1 . 1 91 91 THR CB C 13 69.828 0.001 . 1 . . . . A 87 THR CB . 34869 2
823 . 1 . 1 91 91 THR CG2 C 13 21.349 0.000 . 1 . . . . A 87 THR CG2 . 34869 2
824 . 1 . 1 92 92 GLN HA H 1 4.199 0.001 . 1 . . . . A 88 GLN HA . 34869 2
825 . 1 . 1 92 92 GLN HB2 H 1 2.140 0.003 . 2 . . . . A 88 GLN HB2 . 34869 2
826 . 1 . 1 92 92 GLN HB3 H 1 1.951 0.000 . 2 . . . . A 88 GLN HB3 . 34869 2
827 . 1 . 1 92 92 GLN HG2 H 1 2.313 0.003 . 2 . . . . A 88 GLN HG2 . 34869 2
828 . 1 . 1 92 92 GLN HG3 H 1 2.318 0.000 . 2 . . . . A 88 GLN HG3 . 34869 2
829 . 1 . 1 92 92 GLN CA C 13 57.375 0.001 . 1 . . . . A 88 GLN CA . 34869 2
830 . 1 . 1 92 92 GLN CB C 13 30.402 0.031 . 1 . . . . A 88 GLN CB . 34869 2
831 . 1 . 1 92 92 GLN CG C 13 34.316 0.000 . 1 . . . . A 88 GLN CG . 34869 2
stop_
save_