Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
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 19439
_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' . . . 19439 1
2 CBCANH . . . 19439 1
3 '2D 1H-1H NOESY' . . . 19439 1
4 '2D 1H-1H TOCSY' . . . 19439 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 13 13 GLY CA C 13 45.267 0.000 . 1 . . . A 58 GLY CA . 19439 1
2 . 1 1 14 14 ALA H H 1 7.894 0.033 . 1 . . . A 59 ALA H . 19439 1
3 . 1 1 14 14 ALA HA H 1 4.232 0.000 . 1 . . . A 59 ALA HA . 19439 1
4 . 1 1 14 14 ALA HB1 H 1 1.218 0.001 . 1 . . . A 59 ALA HB1 . 19439 1
5 . 1 1 14 14 ALA HB2 H 1 1.218 0.001 . 1 . . . A 59 ALA HB2 . 19439 1
6 . 1 1 14 14 ALA HB3 H 1 1.218 0.001 . 1 . . . A 59 ALA HB3 . 19439 1
7 . 1 1 14 14 ALA CA C 13 52.274 0.055 . 1 . . . A 59 ALA CA . 19439 1
8 . 1 1 14 14 ALA CB C 13 19.623 0.002 . 1 . . . A 59 ALA CB . 19439 1
9 . 1 1 14 14 ALA N N 15 123.310 0.005 . 1 . . . A 59 ALA N . 19439 1
10 . 1 1 15 15 LEU H H 1 8.046 0.023 . 1 . . . A 60 LEU H . 19439 1
11 . 1 1 15 15 LEU HA H 1 4.364 0.002 . 1 . . . A 60 LEU HA . 19439 1
12 . 1 1 15 15 LEU HB2 H 1 1.486 0.004 . 2 . . . A 60 LEU HB2 . 19439 1
13 . 1 1 15 15 LEU HB3 H 1 1.422 0.004 . 2 . . . A 60 LEU HB3 . 19439 1
14 . 1 1 15 15 LEU HG H 1 1.252 0.003 . 1 . . . A 60 LEU HG . 19439 1
15 . 1 1 15 15 LEU HD11 H 1 0.793 0.001 . 2 . . . A 60 LEU HD11 . 19439 1
16 . 1 1 15 15 LEU HD12 H 1 0.793 0.001 . 2 . . . A 60 LEU HD12 . 19439 1
17 . 1 1 15 15 LEU HD13 H 1 0.793 0.001 . 2 . . . A 60 LEU HD13 . 19439 1
18 . 1 1 15 15 LEU HD21 H 1 0.746 0.003 . 2 . . . A 60 LEU HD21 . 19439 1
19 . 1 1 15 15 LEU HD22 H 1 0.746 0.003 . 2 . . . A 60 LEU HD22 . 19439 1
20 . 1 1 15 15 LEU HD23 H 1 0.746 0.003 . 2 . . . A 60 LEU HD23 . 19439 1
21 . 1 1 15 15 LEU CA C 13 54.130 0.015 . 1 . . . A 60 LEU CA . 19439 1
22 . 1 1 15 15 LEU CB C 13 43.209 0.017 . 1 . . . A 60 LEU CB . 19439 1
23 . 1 1 15 15 LEU N N 15 120.936 0.003 . 1 . . . A 60 LEU N . 19439 1
24 . 1 1 16 16 ALA H H 1 8.338 0.012 . 1 . . . A 61 ALA H . 19439 1
25 . 1 1 16 16 ALA HA H 1 4.364 0.003 . 1 . . . A 61 ALA HA . 19439 1
26 . 1 1 16 16 ALA HB1 H 1 1.212 0.001 . 1 . . . A 61 ALA HB1 . 19439 1
27 . 1 1 16 16 ALA HB2 H 1 1.212 0.001 . 1 . . . A 61 ALA HB2 . 19439 1
28 . 1 1 16 16 ALA HB3 H 1 1.212 0.001 . 1 . . . A 61 ALA HB3 . 19439 1
29 . 1 1 16 16 ALA CA C 13 51.176 0.006 . 1 . . . A 61 ALA CA . 19439 1
30 . 1 1 16 16 ALA CB C 13 20.172 0.037 . 1 . . . A 61 ALA CB . 19439 1
31 . 1 1 16 16 ALA N N 15 125.460 0.003 . 1 . . . A 61 ALA N . 19439 1
32 . 1 1 17 17 ALA H H 1 8.487 0.030 . 1 . . . A 62 ALA H . 19439 1
33 . 1 1 17 17 ALA HA H 1 4.394 0.002 . 1 . . . A 62 ALA HA . 19439 1
34 . 1 1 17 17 ALA HB1 H 1 1.215 0.002 . 1 . . . A 62 ALA HB1 . 19439 1
35 . 1 1 17 17 ALA HB2 H 1 1.215 0.002 . 1 . . . A 62 ALA HB2 . 19439 1
36 . 1 1 17 17 ALA HB3 H 1 1.215 0.002 . 1 . . . A 62 ALA HB3 . 19439 1
37 . 1 1 17 17 ALA CA C 13 51.888 0.000 . 1 . . . A 62 ALA CA . 19439 1
38 . 1 1 17 17 ALA CB C 13 18.806 0.017 . 1 . . . A 62 ALA CB . 19439 1
39 . 1 1 17 17 ALA N N 15 127.765 0.033 . 1 . . . A 62 ALA N . 19439 1
40 . 1 1 18 18 LEU H H 1 7.927 0.020 . 1 . . . A 63 LEU H . 19439 1
41 . 1 1 18 18 LEU HA H 1 4.828 0.003 . 1 . . . A 63 LEU HA . 19439 1
42 . 1 1 18 18 LEU HB2 H 1 1.495 0.002 . 2 . . . A 63 LEU HB2 . 19439 1
43 . 1 1 18 18 LEU HB3 H 1 1.431 0.003 . 2 . . . A 63 LEU HB3 . 19439 1
44 . 1 1 18 18 LEU HG H 1 1.496 0.000 . 1 . . . A 63 LEU HG . 19439 1
45 . 1 1 18 18 LEU HD11 H 1 0.752 0.002 . 2 . . . A 63 LEU HD11 . 19439 1
46 . 1 1 18 18 LEU HD12 H 1 0.752 0.002 . 2 . . . A 63 LEU HD12 . 19439 1
47 . 1 1 18 18 LEU HD13 H 1 0.752 0.002 . 2 . . . A 63 LEU HD13 . 19439 1
48 . 1 1 18 18 LEU HD21 H 1 0.475 0.001 . 2 . . . A 63 LEU HD21 . 19439 1
49 . 1 1 18 18 LEU HD22 H 1 0.475 0.001 . 2 . . . A 63 LEU HD22 . 19439 1
50 . 1 1 18 18 LEU HD23 H 1 0.475 0.001 . 2 . . . A 63 LEU HD23 . 19439 1
51 . 1 1 18 18 LEU CA C 13 51.852 0.047 . 1 . . . A 63 LEU CA . 19439 1
52 . 1 1 18 18 LEU CB C 13 44.081 0.008 . 1 . . . A 63 LEU CB . 19439 1
53 . 1 1 18 18 LEU N N 15 120.199 0.003 . 1 . . . A 63 LEU N . 19439 1
54 . 1 1 19 19 HIS H H 1 8.477 0.029 . 1 . . . A 64 HIS H . 19439 1
55 . 1 1 19 19 HIS HA H 1 4.114 0.004 . 1 . . . A 64 HIS HA . 19439 1
56 . 1 1 19 19 HIS HB2 H 1 3.138 0.004 . 2 . . . A 64 HIS HB2 . 19439 1
57 . 1 1 19 19 HIS HB3 H 1 2.623 0.002 . 2 . . . A 64 HIS HB3 . 19439 1
58 . 1 1 19 19 HIS HD2 H 1 6.549 0.000 . 1 . . . A 64 HIS HD2 . 19439 1
59 . 1 1 19 19 HIS HE1 H 1 7.366 0.001 . 1 . . . A 64 HIS HE1 . 19439 1
60 . 1 1 19 19 HIS CA C 13 58.038 0.000 . 1 . . . A 64 HIS CA . 19439 1
61 . 1 1 19 19 HIS CB C 13 31.228 0.000 . 1 . . . A 64 HIS CB . 19439 1
62 . 1 1 19 19 HIS N N 15 122.277 0.003 . 1 . . . A 64 HIS N . 19439 1
63 . 1 1 20 20 ALA HA H 1 4.339 0.003 . 1 . . . A 65 ALA HA . 19439 1
64 . 1 1 20 20 ALA HB1 H 1 1.439 0.001 . 1 . . . A 65 ALA HB1 . 19439 1
65 . 1 1 20 20 ALA HB2 H 1 1.439 0.001 . 1 . . . A 65 ALA HB2 . 19439 1
66 . 1 1 20 20 ALA HB3 H 1 1.439 0.001 . 1 . . . A 65 ALA HB3 . 19439 1
67 . 1 1 20 20 ALA CA C 13 53.281 0.000 . 1 . . . A 65 ALA CA . 19439 1
68 . 1 1 20 20 ALA CB C 13 20.276 0.000 . 1 . . . A 65 ALA CB . 19439 1
69 . 1 1 21 21 GLU H H 1 7.759 0.028 . 1 . . . A 66 GLU H . 19439 1
70 . 1 1 21 21 GLU HA H 1 4.619 0.002 . 1 . . . A 66 GLU HA . 19439 1
71 . 1 1 21 21 GLU HB2 H 1 1.921 0.001 . 2 . . . A 66 GLU HB2 . 19439 1
72 . 1 1 21 21 GLU HB3 H 1 1.921 0.001 . 2 . . . A 66 GLU HB3 . 19439 1
73 . 1 1 21 21 GLU HG2 H 1 2.085 0.022 . 2 . . . A 66 GLU HG2 . 19439 1
74 . 1 1 21 21 GLU HG3 H 1 2.085 0.022 . 2 . . . A 66 GLU HG3 . 19439 1
75 . 1 1 21 21 GLU CA C 13 54.727 0.000 . 1 . . . A 66 GLU CA . 19439 1
76 . 1 1 21 21 GLU CB C 13 32.894 0.000 . 1 . . . A 66 GLU CB . 19439 1
77 . 1 1 21 21 GLU N N 15 113.868 0.005 . 1 . . . A 66 GLU N . 19439 1
78 . 1 1 22 22 GLY HA2 H 1 4.416 0.000 . 2 . . . A 67 GLY HA2 . 19439 1
79 . 1 1 22 22 GLY HA3 H 1 3.799 0.004 . 2 . . . A 67 GLY HA3 . 19439 1
80 . 1 1 23 23 PRO HA H 1 4.219 0.002 . 1 . . . A 68 PRO HA . 19439 1
81 . 1 1 23 23 PRO HB2 H 1 2.268 0.001 . 2 . . . A 68 PRO HB2 . 19439 1
82 . 1 1 23 23 PRO HB3 H 1 1.745 0.001 . 2 . . . A 68 PRO HB3 . 19439 1
83 . 1 1 23 23 PRO HG2 H 1 1.938 0.001 . 2 . . . A 68 PRO HG2 . 19439 1
84 . 1 1 23 23 PRO HG3 H 1 1.860 0.002 . 2 . . . A 68 PRO HG3 . 19439 1
85 . 1 1 23 23 PRO HD2 H 1 3.479 0.001 . 2 . . . A 68 PRO HD2 . 19439 1
86 . 1 1 23 23 PRO HD3 H 1 3.689 0.011 . 2 . . . A 68 PRO HD3 . 19439 1
87 . 1 1 23 23 PRO CA C 13 64.664 0.000 . 1 . . . A 68 PRO CA . 19439 1
88 . 1 1 23 23 PRO CB C 13 32.066 0.000 . 1 . . . A 68 PRO CB . 19439 1
89 . 1 1 24 24 LEU H H 1 8.439 0.020 . 1 . . . A 69 LEU H . 19439 1
90 . 1 1 24 24 LEU HA H 1 4.182 0.002 . 1 . . . A 69 LEU HA . 19439 1
91 . 1 1 24 24 LEU HB2 H 1 1.097 0.002 . 2 . . . A 69 LEU HB2 . 19439 1
92 . 1 1 24 24 LEU HB3 H 1 0.945 0.002 . 2 . . . A 69 LEU HB3 . 19439 1
93 . 1 1 24 24 LEU HD11 H 1 0.458 0.001 . 2 . . . A 69 LEU HD11 . 19439 1
94 . 1 1 24 24 LEU HD12 H 1 0.458 0.001 . 2 . . . A 69 LEU HD12 . 19439 1
95 . 1 1 24 24 LEU HD13 H 1 0.458 0.001 . 2 . . . A 69 LEU HD13 . 19439 1
96 . 1 1 24 24 LEU HD21 H 1 0.377 0.002 . 2 . . . A 69 LEU HD21 . 19439 1
97 . 1 1 24 24 LEU HD22 H 1 0.377 0.002 . 2 . . . A 69 LEU HD22 . 19439 1
98 . 1 1 24 24 LEU HD23 H 1 0.377 0.002 . 2 . . . A 69 LEU HD23 . 19439 1
99 . 1 1 24 24 LEU CA C 13 52.430 0.107 . 1 . . . A 69 LEU CA . 19439 1
100 . 1 1 24 24 LEU CB C 13 40.907 0.037 . 1 . . . A 69 LEU CB . 19439 1
101 . 1 1 24 24 LEU N N 15 117.262 0.042 . 1 . . . A 69 LEU N . 19439 1
102 . 1 1 25 25 ALA H H 1 7.113 0.031 . 1 . . . A 70 ALA H . 19439 1
103 . 1 1 25 25 ALA HA H 1 3.411 0.002 . 1 . . . A 70 ALA HA . 19439 1
104 . 1 1 25 25 ALA HB1 H 1 1.125 0.002 . 1 . . . A 70 ALA HB1 . 19439 1
105 . 1 1 25 25 ALA HB2 H 1 1.125 0.002 . 1 . . . A 70 ALA HB2 . 19439 1
106 . 1 1 25 25 ALA HB3 H 1 1.125 0.002 . 1 . . . A 70 ALA HB3 . 19439 1
107 . 1 1 25 25 ALA CA C 13 53.685 0.036 . 1 . . . A 70 ALA CA . 19439 1
108 . 1 1 25 25 ALA CB C 13 17.914 0.005 . 1 . . . A 70 ALA CB . 19439 1
109 . 1 1 25 25 ALA N N 15 120.426 0.010 . 1 . . . A 70 ALA N . 19439 1
110 . 1 1 26 26 GLY H H 1 8.856 0.023 . 1 . . . A 71 GLY H . 19439 1
111 . 1 1 26 26 GLY HA2 H 1 4.184 0.003 . 2 . . . A 71 GLY HA2 . 19439 1
112 . 1 1 26 26 GLY HA3 H 1 3.577 0.003 . 2 . . . A 71 GLY HA3 . 19439 1
113 . 1 1 26 26 GLY CA C 13 45.215 0.035 . 1 . . . A 71 GLY CA . 19439 1
114 . 1 1 26 26 GLY N N 15 108.911 0.006 . 1 . . . A 71 GLY N . 19439 1
115 . 1 1 27 27 LEU H H 1 8.136 0.026 . 1 . . . A 72 LEU H . 19439 1
116 . 1 1 27 27 LEU HA H 1 4.769 0.002 . 1 . . . A 72 LEU HA . 19439 1
117 . 1 1 27 27 LEU HB2 H 1 1.929 0.004 . 2 . . . A 72 LEU HB2 . 19439 1
118 . 1 1 27 27 LEU HB3 H 1 1.044 0.006 . 2 . . . A 72 LEU HB3 . 19439 1
119 . 1 1 27 27 LEU HG H 1 1.388 0.001 . 1 . . . A 72 LEU HG . 19439 1
120 . 1 1 27 27 LEU HD11 H 1 0.592 0.001 . 2 . . . A 72 LEU HD11 . 19439 1
121 . 1 1 27 27 LEU HD12 H 1 0.592 0.001 . 2 . . . A 72 LEU HD12 . 19439 1
122 . 1 1 27 27 LEU HD13 H 1 0.592 0.001 . 2 . . . A 72 LEU HD13 . 19439 1
123 . 1 1 27 27 LEU HD21 H 1 0.591 0.001 . 2 . . . A 72 LEU HD21 . 19439 1
124 . 1 1 27 27 LEU HD22 H 1 0.591 0.001 . 2 . . . A 72 LEU HD22 . 19439 1
125 . 1 1 27 27 LEU HD23 H 1 0.591 0.001 . 2 . . . A 72 LEU HD23 . 19439 1
126 . 1 1 27 27 LEU CA C 13 51.972 0.000 . 1 . . . A 72 LEU CA . 19439 1
127 . 1 1 27 27 LEU CB C 13 41.255 0.000 . 1 . . . A 72 LEU CB . 19439 1
128 . 1 1 27 27 LEU N N 15 120.000 0.003 . 1 . . . A 72 LEU N . 19439 1
129 . 1 1 28 28 PRO HA H 1 4.739 0.009 . 1 . . . A 73 PRO HA . 19439 1
130 . 1 1 28 28 PRO HB2 H 1 1.811 0.002 . 2 . . . A 73 PRO HB2 . 19439 1
131 . 1 1 28 28 PRO HB3 H 1 1.548 0.003 . 2 . . . A 73 PRO HB3 . 19439 1
132 . 1 1 28 28 PRO HG2 H 1 1.297 0.003 . 2 . . . A 73 PRO HG2 . 19439 1
133 . 1 1 28 28 PRO HG3 H 1 0.659 0.001 . 2 . . . A 73 PRO HG3 . 19439 1
134 . 1 1 28 28 PRO HD2 H 1 3.378 0.001 . 2 . . . A 73 PRO HD2 . 19439 1
135 . 1 1 28 28 PRO HD3 H 1 3.182 0.001 . 2 . . . A 73 PRO HD3 . 19439 1
136 . 1 1 28 28 PRO CA C 13 61.456 0.000 . 1 . . . A 73 PRO CA . 19439 1
137 . 1 1 28 28 PRO CB C 13 31.245 0.000 . 1 . . . A 73 PRO CB . 19439 1
138 . 1 1 29 29 VAL H H 1 7.710 0.026 . 1 . . . A 74 VAL H . 19439 1
139 . 1 1 29 29 VAL HA H 1 3.446 0.004 . 1 . . . A 74 VAL HA . 19439 1
140 . 1 1 29 29 VAL HB H 1 1.839 0.001 . 1 . . . A 74 VAL HB . 19439 1
141 . 1 1 29 29 VAL HG11 H 1 0.708 0.002 . 2 . . . A 74 VAL HG11 . 19439 1
142 . 1 1 29 29 VAL HG12 H 1 0.708 0.002 . 2 . . . A 74 VAL HG12 . 19439 1
143 . 1 1 29 29 VAL HG13 H 1 0.708 0.002 . 2 . . . A 74 VAL HG13 . 19439 1
144 . 1 1 29 29 VAL HG21 H 1 -0.031 0.003 . 2 . . . A 74 VAL HG21 . 19439 1
145 . 1 1 29 29 VAL HG22 H 1 -0.031 0.003 . 2 . . . A 74 VAL HG22 . 19439 1
146 . 1 1 29 29 VAL HG23 H 1 -0.031 0.003 . 2 . . . A 74 VAL HG23 . 19439 1
147 . 1 1 29 29 VAL CA C 13 65.744 0.045 . 1 . . . A 74 VAL CA . 19439 1
148 . 1 1 29 29 VAL CB C 13 31.236 0.000 . 1 . . . A 74 VAL CB . 19439 1
149 . 1 1 29 29 VAL N N 15 121.723 0.007 . 1 . . . A 74 VAL N . 19439 1
150 . 1 1 30 30 THR H H 1 8.710 0.020 . 1 . . . A 75 THR H . 19439 1
151 . 1 1 30 30 THR HA H 1 4.937 0.000 . 1 . . . A 75 THR HA . 19439 1
152 . 1 1 30 30 THR HB H 1 4.622 0.002 . 1 . . . A 75 THR HB . 19439 1
153 . 1 1 30 30 THR HG21 H 1 1.186 0.004 . 1 . . . A 75 THR HG21 . 19439 1
154 . 1 1 30 30 THR HG22 H 1 1.186 0.004 . 1 . . . A 75 THR HG22 . 19439 1
155 . 1 1 30 30 THR HG23 H 1 1.186 0.004 . 1 . . . A 75 THR HG23 . 19439 1
156 . 1 1 30 30 THR CA C 13 59.892 0.000 . 1 . . . A 75 THR CA . 19439 1
157 . 1 1 30 30 THR CB C 13 73.700 0.000 . 1 . . . A 75 THR CB . 19439 1
158 . 1 1 30 30 THR N N 15 108.893 0.008 . 1 . . . A 75 THR N . 19439 1
159 . 1 1 31 31 ARG H H 1 8.447 0.000 . 1 . . . A 76 ARG H . 19439 1
160 . 1 1 31 31 ARG HA H 1 3.873 0.002 . 1 . . . A 76 ARG HA . 19439 1
161 . 1 1 31 31 ARG HB2 H 1 1.982 0.000 . 2 . . . A 76 ARG HB2 . 19439 1
162 . 1 1 31 31 ARG HB3 H 1 1.982 0.000 . 2 . . . A 76 ARG HB3 . 19439 1
163 . 1 1 32 32 SER H H 1 8.105 0.005 . 1 . . . A 77 SER H . 19439 1
164 . 1 1 32 32 SER HA H 1 4.061 0.001 . 1 . . . A 77 SER HA . 19439 1
165 . 1 1 32 32 SER HB2 H 1 3.779 0.004 . 2 . . . A 77 SER HB2 . 19439 1
166 . 1 1 32 32 SER HB3 H 1 3.779 0.004 . 2 . . . A 77 SER HB3 . 19439 1
167 . 1 1 32 32 SER CA C 13 60.467 0.000 . 1 . . . A 77 SER CA . 19439 1
168 . 1 1 32 32 SER CB C 13 62.449 0.000 . 1 . . . A 77 SER CB . 19439 1
169 . 1 1 32 32 SER N N 15 114.482 0.038 . 1 . . . A 77 SER N . 19439 1
170 . 1 1 33 33 ASP H H 1 7.300 0.030 . 1 . . . A 78 ASP H . 19439 1
171 . 1 1 33 33 ASP HA H 1 4.333 0.004 . 1 . . . A 78 ASP HA . 19439 1
172 . 1 1 33 33 ASP HB2 H 1 2.940 0.003 . 2 . . . A 78 ASP HB2 . 19439 1
173 . 1 1 33 33 ASP HB3 H 1 2.639 0.003 . 2 . . . A 78 ASP HB3 . 19439 1
174 . 1 1 33 33 ASP CA C 13 58.020 0.060 . 1 . . . A 78 ASP CA . 19439 1
175 . 1 1 33 33 ASP CB C 13 43.252 0.013 . 1 . . . A 78 ASP CB . 19439 1
176 . 1 1 33 33 ASP N N 15 120.538 0.007 . 1 . . . A 78 ASP N . 19439 1
177 . 1 1 34 34 ALA H H 1 7.767 0.028 . 1 . . . A 79 ALA H . 19439 1
178 . 1 1 34 34 ALA HA H 1 3.672 0.001 . 1 . . . A 79 ALA HA . 19439 1
179 . 1 1 34 34 ALA HB1 H 1 1.347 0.002 . 1 . . . A 79 ALA HB1 . 19439 1
180 . 1 1 34 34 ALA HB2 H 1 1.347 0.002 . 1 . . . A 79 ALA HB2 . 19439 1
181 . 1 1 34 34 ALA HB3 H 1 1.347 0.002 . 1 . . . A 79 ALA HB3 . 19439 1
182 . 1 1 34 34 ALA CA C 13 54.886 0.001 . 1 . . . A 79 ALA CA . 19439 1
183 . 1 1 34 34 ALA CB C 13 19.628 0.003 . 1 . . . A 79 ALA CB . 19439 1
184 . 1 1 34 34 ALA N N 15 120.614 0.012 . 1 . . . A 79 ALA N . 19439 1
185 . 1 1 35 35 ARG H H 1 7.981 0.029 . 1 . . . A 80 ARG H . 19439 1
186 . 1 1 35 35 ARG HA H 1 3.732 0.003 . 1 . . . A 80 ARG HA . 19439 1
187 . 1 1 35 35 ARG HB2 H 1 1.992 0.003 . 2 . . . A 80 ARG HB2 . 19439 1
188 . 1 1 35 35 ARG HB3 H 1 1.992 0.003 . 2 . . . A 80 ARG HB3 . 19439 1
189 . 1 1 35 35 ARG HG2 H 1 1.458 0.001 . 2 . . . A 80 ARG HG2 . 19439 1
190 . 1 1 35 35 ARG HG3 H 1 1.458 0.001 . 2 . . . A 80 ARG HG3 . 19439 1
191 . 1 1 35 35 ARG CA C 13 61.441 0.036 . 1 . . . A 80 ARG CA . 19439 1
192 . 1 1 35 35 ARG CB C 13 30.266 0.026 . 1 . . . A 80 ARG CB . 19439 1
193 . 1 1 35 35 ARG N N 15 116.203 0.006 . 1 . . . A 80 ARG N . 19439 1
194 . 1 1 36 36 VAL H H 1 7.338 0.030 . 1 . . . A 81 VAL H . 19439 1
195 . 1 1 36 36 VAL HA H 1 3.582 0.001 . 1 . . . A 81 VAL HA . 19439 1
196 . 1 1 36 36 VAL HB H 1 2.218 0.003 . 1 . . . A 81 VAL HB . 19439 1
197 . 1 1 36 36 VAL HG11 H 1 0.951 0.002 . 2 . . . A 81 VAL HG11 . 19439 1
198 . 1 1 36 36 VAL HG12 H 1 0.951 0.002 . 2 . . . A 81 VAL HG12 . 19439 1
199 . 1 1 36 36 VAL HG13 H 1 0.951 0.002 . 2 . . . A 81 VAL HG13 . 19439 1
200 . 1 1 36 36 VAL HG21 H 1 0.844 0.004 . 2 . . . A 81 VAL HG21 . 19439 1
201 . 1 1 36 36 VAL HG22 H 1 0.844 0.004 . 2 . . . A 81 VAL HG22 . 19439 1
202 . 1 1 36 36 VAL HG23 H 1 0.844 0.004 . 2 . . . A 81 VAL HG23 . 19439 1
203 . 1 1 36 36 VAL CA C 13 66.909 0.022 . 1 . . . A 81 VAL CA . 19439 1
204 . 1 1 36 36 VAL CB C 13 31.668 0.000 . 1 . . . A 81 VAL CB . 19439 1
205 . 1 1 36 36 VAL N N 15 119.192 0.008 . 1 . . . A 81 VAL N . 19439 1
206 . 1 1 37 37 LEU H H 1 7.599 0.024 . 1 . . . A 82 LEU H . 19439 1
207 . 1 1 37 37 LEU HA H 1 4.044 0.001 . 1 . . . A 82 LEU HA . 19439 1
208 . 1 1 37 37 LEU HB2 H 1 2.060 0.005 . 2 . . . A 82 LEU HB2 . 19439 1
209 . 1 1 37 37 LEU HB3 H 1 1.570 0.005 . 2 . . . A 82 LEU HB3 . 19439 1
210 . 1 1 37 37 LEU HG H 1 1.744 0.001 . 1 . . . A 82 LEU HG . 19439 1
211 . 1 1 37 37 LEU HD11 H 1 0.952 0.003 . 2 . . . A 82 LEU HD11 . 19439 1
212 . 1 1 37 37 LEU HD12 H 1 0.952 0.003 . 2 . . . A 82 LEU HD12 . 19439 1
213 . 1 1 37 37 LEU HD13 H 1 0.952 0.003 . 2 . . . A 82 LEU HD13 . 19439 1
214 . 1 1 37 37 LEU HD21 H 1 0.743 0.002 . 2 . . . A 82 LEU HD21 . 19439 1
215 . 1 1 37 37 LEU HD22 H 1 0.743 0.002 . 2 . . . A 82 LEU HD22 . 19439 1
216 . 1 1 37 37 LEU HD23 H 1 0.743 0.002 . 2 . . . A 82 LEU HD23 . 19439 1
217 . 1 1 37 37 LEU CA C 13 58.356 0.024 . 1 . . . A 82 LEU CA . 19439 1
218 . 1 1 37 37 LEU CB C 13 41.627 0.000 . 1 . . . A 82 LEU CB . 19439 1
219 . 1 1 37 37 LEU N N 15 118.722 0.006 . 1 . . . A 82 LEU N . 19439 1
220 . 1 1 38 38 ILE H H 1 8.546 0.025 . 1 . . . A 83 ILE H . 19439 1
221 . 1 1 38 38 ILE HA H 1 3.642 0.001 . 1 . . . A 83 ILE HA . 19439 1
222 . 1 1 38 38 ILE HB H 1 1.826 0.002 . 1 . . . A 83 ILE HB . 19439 1
223 . 1 1 38 38 ILE HG12 H 1 2.044 0.001 . 2 . . . A 83 ILE HG12 . 19439 1
224 . 1 1 38 38 ILE HG13 H 1 1.055 0.003 . 2 . . . A 83 ILE HG13 . 19439 1
225 . 1 1 38 38 ILE HG21 H 1 0.890 0.009 . 1 . . . A 83 ILE HG21 . 19439 1
226 . 1 1 38 38 ILE HG22 H 1 0.890 0.009 . 1 . . . A 83 ILE HG22 . 19439 1
227 . 1 1 38 38 ILE HG23 H 1 0.890 0.009 . 1 . . . A 83 ILE HG23 . 19439 1
228 . 1 1 38 38 ILE HD11 H 1 0.803 0.003 . 1 . . . A 83 ILE HD11 . 19439 1
229 . 1 1 38 38 ILE HD12 H 1 0.803 0.003 . 1 . . . A 83 ILE HD12 . 19439 1
230 . 1 1 38 38 ILE HD13 H 1 0.803 0.003 . 1 . . . A 83 ILE HD13 . 19439 1
231 . 1 1 38 38 ILE CA C 13 65.669 0.032 . 1 . . . A 83 ILE CA . 19439 1
232 . 1 1 38 38 ILE CB C 13 38.579 0.000 . 1 . . . A 83 ILE CB . 19439 1
233 . 1 1 38 38 ILE N N 15 120.893 0.008 . 1 . . . A 83 ILE N . 19439 1
234 . 1 1 39 39 PHE H H 1 8.622 0.022 . 1 . . . A 84 PHE H . 19439 1
235 . 1 1 39 39 PHE HA H 1 4.084 0.002 . 1 . . . A 84 PHE HA . 19439 1
236 . 1 1 39 39 PHE HB2 H 1 3.286 0.003 . 2 . . . A 84 PHE HB2 . 19439 1
237 . 1 1 39 39 PHE HB3 H 1 3.221 0.001 . 2 . . . A 84 PHE HB3 . 19439 1
238 . 1 1 39 39 PHE HD1 H 1 7.207 0.002 . 3 . . . A 84 PHE HD1 . 19439 1
239 . 1 1 39 39 PHE HD2 H 1 7.207 0.002 . 3 . . . A 84 PHE HD2 . 19439 1
240 . 1 1 39 39 PHE HE1 H 1 7.287 0.001 . 3 . . . A 84 PHE HE1 . 19439 1
241 . 1 1 39 39 PHE HE2 H 1 7.287 0.001 . 3 . . . A 84 PHE HE2 . 19439 1
242 . 1 1 39 39 PHE HZ H 1 7.335 0.002 . 1 . . . A 84 PHE HZ . 19439 1
243 . 1 1 39 39 PHE CA C 13 62.593 0.033 . 1 . . . A 84 PHE CA . 19439 1
244 . 1 1 39 39 PHE CB C 13 39.211 0.057 . 1 . . . A 84 PHE CB . 19439 1
245 . 1 1 39 39 PHE N N 15 123.343 0.007 . 1 . . . A 84 PHE N . 19439 1
246 . 1 1 40 40 ASN H H 1 8.834 0.021 . 1 . . . A 85 ASN H . 19439 1
247 . 1 1 40 40 ASN HA H 1 4.426 0.003 . 1 . . . A 85 ASN HA . 19439 1
248 . 1 1 40 40 ASN HB2 H 1 2.970 0.004 . 2 . . . A 85 ASN HB2 . 19439 1
249 . 1 1 40 40 ASN HB3 H 1 2.812 0.025 . 2 . . . A 85 ASN HB3 . 19439 1
250 . 1 1 40 40 ASN CA C 13 56.045 0.041 . 1 . . . A 85 ASN CA . 19439 1
251 . 1 1 40 40 ASN CB C 13 37.785 0.011 . 1 . . . A 85 ASN CB . 19439 1
252 . 1 1 40 40 ASN N N 15 118.037 0.003 . 1 . . . A 85 ASN N . 19439 1
253 . 1 1 41 41 GLU H H 1 8.105 0.033 . 1 . . . A 86 GLU H . 19439 1
254 . 1 1 41 41 GLU HA H 1 4.052 0.003 . 1 . . . A 86 GLU HA . 19439 1
255 . 1 1 41 41 GLU HB2 H 1 2.198 0.001 . 2 . . . A 86 GLU HB2 . 19439 1
256 . 1 1 41 41 GLU HB3 H 1 2.119 0.000 . 2 . . . A 86 GLU HB3 . 19439 1
257 . 1 1 41 41 GLU HG2 H 1 2.358 0.001 . 2 . . . A 86 GLU HG2 . 19439 1
258 . 1 1 41 41 GLU HG3 H 1 2.358 0.001 . 2 . . . A 86 GLU HG3 . 19439 1
259 . 1 1 41 41 GLU CA C 13 59.328 0.047 . 1 . . . A 86 GLU CA . 19439 1
260 . 1 1 41 41 GLU CB C 13 30.253 0.024 . 1 . . . A 86 GLU CB . 19439 1
261 . 1 1 41 41 GLU N N 15 121.098 0.006 . 1 . . . A 86 GLU N . 19439 1
262 . 1 1 42 42 TRP H H 1 8.099 0.036 . 1 . . . A 87 TRP H . 19439 1
263 . 1 1 42 42 TRP HA H 1 4.006 0.003 . 1 . . . A 87 TRP HA . 19439 1
264 . 1 1 42 42 TRP HB2 H 1 3.168 0.002 . 2 . . . A 87 TRP HB2 . 19439 1
265 . 1 1 42 42 TRP HB3 H 1 3.417 0.002 . 2 . . . A 87 TRP HB3 . 19439 1
266 . 1 1 42 42 TRP HD1 H 1 6.727 0.001 . 1 . . . A 87 TRP HD1 . 19439 1
267 . 1 1 42 42 TRP HE1 H 1 9.414 0.018 . 1 . . . A 87 TRP HE1 . 19439 1
268 . 1 1 42 42 TRP HE3 H 1 6.917 0.001 . 1 . . . A 87 TRP HE3 . 19439 1
269 . 1 1 42 42 TRP HZ2 H 1 7.375 0.005 . 1 . . . A 87 TRP HZ2 . 19439 1
270 . 1 1 42 42 TRP HH2 H 1 7.092 0.002 . 1 . . . A 87 TRP HH2 . 19439 1
271 . 1 1 42 42 TRP CA C 13 61.545 0.063 . 1 . . . A 87 TRP CA . 19439 1
272 . 1 1 42 42 TRP CB C 13 27.943 0.050 . 1 . . . A 87 TRP CB . 19439 1
273 . 1 1 42 42 TRP N N 15 122.584 0.024 . 1 . . . A 87 TRP N . 19439 1
274 . 1 1 42 42 TRP NE1 N 15 128.483 0.000 . 1 . . . A 87 TRP NE1 . 19439 1
275 . 1 1 43 43 GLU H H 1 8.440 0.025 . 1 . . . A 88 GLU H . 19439 1
276 . 1 1 43 43 GLU HA H 1 2.919 0.002 . 1 . . . A 88 GLU HA . 19439 1
277 . 1 1 43 43 GLU HB2 H 1 1.843 0.002 . 2 . . . A 88 GLU HB2 . 19439 1
278 . 1 1 43 43 GLU HB3 H 1 1.735 0.001 . 2 . . . A 88 GLU HB3 . 19439 1
279 . 1 1 43 43 GLU HG2 H 1 1.995 0.001 . 2 . . . A 88 GLU HG2 . 19439 1
280 . 1 1 43 43 GLU HG3 H 1 1.806 0.004 . 2 . . . A 88 GLU HG3 . 19439 1
281 . 1 1 43 43 GLU CA C 13 59.804 0.010 . 1 . . . A 88 GLU CA . 19439 1
282 . 1 1 43 43 GLU CB C 13 29.546 0.000 . 1 . . . A 88 GLU CB . 19439 1
283 . 1 1 43 43 GLU N N 15 117.357 0.046 . 1 . . . A 88 GLU N . 19439 1
284 . 1 1 44 44 GLU H H 1 7.244 0.030 . 1 . . . A 89 GLU H . 19439 1
285 . 1 1 44 44 GLU HA H 1 3.995 0.000 . 1 . . . A 89 GLU HA . 19439 1
286 . 1 1 44 44 GLU HB2 H 1 1.999 0.005 . 2 . . . A 89 GLU HB2 . 19439 1
287 . 1 1 44 44 GLU HB3 H 1 1.999 0.005 . 2 . . . A 89 GLU HB3 . 19439 1
288 . 1 1 44 44 GLU HG2 H 1 2.186 0.002 . 2 . . . A 89 GLU HG2 . 19439 1
289 . 1 1 44 44 GLU HG3 H 1 2.186 0.002 . 2 . . . A 89 GLU HG3 . 19439 1
290 . 1 1 44 44 GLU CA C 13 58.329 0.000 . 1 . . . A 89 GLU CA . 19439 1
291 . 1 1 44 44 GLU CB C 13 29.649 0.080 . 1 . . . A 89 GLU CB . 19439 1
292 . 1 1 44 44 GLU N N 15 116.109 0.007 . 1 . . . A 89 GLU N . 19439 1
293 . 1 1 45 45 ARG H H 1 8.368 0.020 . 1 . . . A 90 ARG H . 19439 1
294 . 1 1 45 45 ARG HA H 1 3.920 0.003 . 1 . . . A 90 ARG HA . 19439 1
295 . 1 1 45 45 ARG HB2 H 1 1.841 0.003 . 2 . . . A 90 ARG HB2 . 19439 1
296 . 1 1 45 45 ARG HB3 H 1 1.770 0.001 . 2 . . . A 90 ARG HB3 . 19439 1
297 . 1 1 45 45 ARG HG2 H 1 1.630 0.002 . 2 . . . A 90 ARG HG2 . 19439 1
298 . 1 1 45 45 ARG HG3 H 1 1.598 0.004 . 2 . . . A 90 ARG HG3 . 19439 1
299 . 1 1 45 45 ARG CA C 13 58.683 0.036 . 1 . . . A 90 ARG CA . 19439 1
300 . 1 1 45 45 ARG CB C 13 30.659 0.000 . 1 . . . A 90 ARG CB . 19439 1
301 . 1 1 45 45 ARG N N 15 120.512 0.006 . 1 . . . A 90 ARG N . 19439 1
302 . 1 1 46 46 LYS H H 1 8.491 0.020 . 1 . . . A 91 LYS H . 19439 1
303 . 1 1 46 46 LYS HA H 1 3.964 0.001 . 1 . . . A 91 LYS HA . 19439 1
304 . 1 1 46 46 LYS HB2 H 1 1.226 0.004 . 2 . . . A 91 LYS HB2 . 19439 1
305 . 1 1 46 46 LYS HB3 H 1 0.753 0.006 . 2 . . . A 91 LYS HB3 . 19439 1
306 . 1 1 46 46 LYS CA C 13 57.278 0.085 . 1 . . . A 91 LYS CA . 19439 1
307 . 1 1 46 46 LYS CB C 13 30.582 0.020 . 1 . . . A 91 LYS CB . 19439 1
308 . 1 1 46 46 LYS N N 15 120.024 0.004 . 1 . . . A 91 LYS N . 19439 1
309 . 1 1 47 47 LYS H H 1 6.933 0.031 . 1 . . . A 92 LYS H . 19439 1
310 . 1 1 47 47 LYS HA H 1 3.796 0.012 . 1 . . . A 92 LYS HA . 19439 1
311 . 1 1 47 47 LYS HB2 H 1 1.729 0.002 . 2 . . . A 92 LYS HB2 . 19439 1
312 . 1 1 47 47 LYS HB3 H 1 1.682 0.002 . 2 . . . A 92 LYS HB3 . 19439 1
313 . 1 1 47 47 LYS HG2 H 1 1.236 0.000 . 2 . . . A 92 LYS HG2 . 19439 1
314 . 1 1 47 47 LYS HG3 H 1 1.236 0.000 . 2 . . . A 92 LYS HG3 . 19439 1
315 . 1 1 47 47 LYS HD2 H 1 1.490 0.001 . 2 . . . A 92 LYS HD2 . 19439 1
316 . 1 1 47 47 LYS HD3 H 1 1.490 0.001 . 2 . . . A 92 LYS HD3 . 19439 1
317 . 1 1 47 47 LYS CA C 13 58.976 0.000 . 1 . . . A 92 LYS CA . 19439 1
318 . 1 1 47 47 LYS CB C 13 32.188 0.002 . 1 . . . A 92 LYS CB . 19439 1
319 . 1 1 47 47 LYS N N 15 118.192 0.006 . 1 . . . A 92 LYS N . 19439 1
320 . 1 1 48 48 SER H H 1 7.282 0.064 . 1 . . . A 93 SER H . 19439 1
321 . 1 1 48 48 SER HA H 1 4.484 0.000 . 1 . . . A 93 SER HA . 19439 1
322 . 1 1 48 48 SER HB2 H 1 3.964 0.000 . 2 . . . A 93 SER HB2 . 19439 1
323 . 1 1 48 48 SER HB3 H 1 3.964 0.000 . 2 . . . A 93 SER HB3 . 19439 1
324 . 1 1 48 48 SER CA C 13 58.386 0.041 . 1 . . . A 93 SER CA . 19439 1
325 . 1 1 48 48 SER CB C 13 64.173 0.009 . 1 . . . A 93 SER CB . 19439 1
326 . 1 1 48 48 SER N N 15 110.447 0.005 . 1 . . . A 93 SER N . 19439 1
327 . 1 1 49 49 ASP H H 1 7.303 0.039 . 1 . . . A 94 ASP H . 19439 1
328 . 1 1 49 49 ASP HA H 1 4.872 0.003 . 1 . . . A 94 ASP HA . 19439 1
329 . 1 1 49 49 ASP HB2 H 1 2.393 0.009 . 2 . . . A 94 ASP HB2 . 19439 1
330 . 1 1 49 49 ASP HB3 H 1 2.346 0.003 . 2 . . . A 94 ASP HB3 . 19439 1
331 . 1 1 49 49 ASP CA C 13 51.157 0.000 . 1 . . . A 94 ASP CA . 19439 1
332 . 1 1 49 49 ASP CB C 13 41.256 0.000 . 1 . . . A 94 ASP CB . 19439 1
333 . 1 1 49 49 ASP N N 15 120.163 0.019 . 1 . . . A 94 ASP N . 19439 1
334 . 1 1 50 50 PRO HB2 H 1 1.040 0.001 . 2 . . . A 95 PRO HB2 . 19439 1
335 . 1 1 50 50 PRO HB3 H 1 1.935 0.001 . 2 . . . A 95 PRO HB3 . 19439 1
336 . 1 1 50 50 PRO HG2 H 1 1.286 0.002 . 2 . . . A 95 PRO HG2 . 19439 1
337 . 1 1 50 50 PRO HG3 H 1 1.643 0.003 . 2 . . . A 95 PRO HG3 . 19439 1
338 . 1 1 50 50 PRO HD2 H 1 3.581 0.002 . 2 . . . A 95 PRO HD2 . 19439 1
339 . 1 1 50 50 PRO HD3 H 1 3.296 0.002 . 2 . . . A 95 PRO HD3 . 19439 1
340 . 1 1 50 50 PRO CA C 13 63.871 0.000 . 1 . . . A 95 PRO CA . 19439 1
341 . 1 1 50 50 PRO CB C 13 31.497 0.000 . 1 . . . A 95 PRO CB . 19439 1
342 . 1 1 51 51 TRP H H 1 7.484 0.023 . 1 . . . A 96 TRP H . 19439 1
343 . 1 1 51 51 TRP HA H 1 4.637 0.001 . 1 . . . A 96 TRP HA . 19439 1
344 . 1 1 51 51 TRP HB2 H 1 3.427 0.003 . 2 . . . A 96 TRP HB2 . 19439 1
345 . 1 1 51 51 TRP HB3 H 1 3.163 0.002 . 2 . . . A 96 TRP HB3 . 19439 1
346 . 1 1 51 51 TRP HD1 H 1 7.231 0.001 . 1 . . . A 96 TRP HD1 . 19439 1
347 . 1 1 51 51 TRP HE1 H 1 10.131 0.027 . 1 . . . A 96 TRP HE1 . 19439 1
348 . 1 1 51 51 TRP HE3 H 1 7.628 0.002 . 1 . . . A 96 TRP HE3 . 19439 1
349 . 1 1 51 51 TRP HZ2 H 1 7.420 0.005 . 1 . . . A 96 TRP HZ2 . 19439 1
350 . 1 1 51 51 TRP HZ3 H 1 7.119 0.001 . 1 . . . A 96 TRP HZ3 . 19439 1
351 . 1 1 51 51 TRP HH2 H 1 7.172 0.002 . 1 . . . A 96 TRP HH2 . 19439 1
352 . 1 1 51 51 TRP CA C 13 56.061 0.000 . 1 . . . A 96 TRP CA . 19439 1
353 . 1 1 51 51 TRP CB C 13 28.605 0.000 . 1 . . . A 96 TRP CB . 19439 1
354 . 1 1 51 51 TRP N N 15 117.486 0.010 . 1 . . . A 96 TRP N . 19439 1
355 . 1 1 51 51 TRP NE1 N 15 129.099 0.000 . 1 . . . A 96 TRP NE1 . 19439 1
356 . 1 1 52 52 LEU H H 1 7.137 0.025 . 1 . . . A 97 LEU H . 19439 1
357 . 1 1 52 52 LEU HA H 1 4.098 0.002 . 1 . . . A 97 LEU HA . 19439 1
358 . 1 1 52 52 LEU HB2 H 1 1.481 0.002 . 2 . . . A 97 LEU HB2 . 19439 1
359 . 1 1 52 52 LEU HB3 H 1 1.587 0.005 . 2 . . . A 97 LEU HB3 . 19439 1
360 . 1 1 52 52 LEU HD11 H 1 0.842 0.001 . 2 . . . A 97 LEU HD11 . 19439 1
361 . 1 1 52 52 LEU HD12 H 1 0.842 0.001 . 2 . . . A 97 LEU HD12 . 19439 1
362 . 1 1 52 52 LEU HD13 H 1 0.842 0.001 . 2 . . . A 97 LEU HD13 . 19439 1
363 . 1 1 52 52 LEU HD21 H 1 0.947 0.002 . 2 . . . A 97 LEU HD21 . 19439 1
364 . 1 1 52 52 LEU HD22 H 1 0.947 0.002 . 2 . . . A 97 LEU HD22 . 19439 1
365 . 1 1 52 52 LEU HD23 H 1 0.947 0.002 . 2 . . . A 97 LEU HD23 . 19439 1
366 . 1 1 52 52 LEU CA C 13 56.024 0.000 . 1 . . . A 97 LEU CA . 19439 1
367 . 1 1 52 52 LEU CB C 13 42.893 0.059 . 1 . . . A 97 LEU CB . 19439 1
368 . 1 1 52 52 LEU N N 15 123.510 0.009 . 1 . . . A 97 LEU N . 19439 1
369 . 1 1 53 53 ARG H H 1 8.825 0.017 . 1 . . . A 98 ARG H . 19439 1
370 . 1 1 53 53 ARG HA H 1 4.486 0.001 . 1 . . . A 98 ARG HA . 19439 1
371 . 1 1 53 53 ARG HB2 H 1 1.720 0.000 . 2 . . . A 98 ARG HB2 . 19439 1
372 . 1 1 53 53 ARG HB3 H 1 1.720 0.000 . 2 . . . A 98 ARG HB3 . 19439 1
373 . 1 1 53 53 ARG HG2 H 1 1.560 0.000 . 2 . . . A 98 ARG HG2 . 19439 1
374 . 1 1 53 53 ARG HG3 H 1 1.560 0.000 . 2 . . . A 98 ARG HG3 . 19439 1
375 . 1 1 53 53 ARG CA C 13 55.622 0.021 . 1 . . . A 98 ARG CA . 19439 1
376 . 1 1 53 53 ARG CB C 13 31.229 0.002 . 1 . . . A 98 ARG CB . 19439 1
377 . 1 1 53 53 ARG N N 15 129.724 0.004 . 1 . . . A 98 ARG N . 19439 1
378 . 1 1 54 54 LEU H H 1 8.236 0.023 . 1 . . . A 99 LEU H . 19439 1
379 . 1 1 54 54 LEU HA H 1 3.586 0.001 . 1 . . . A 99 LEU HA . 19439 1
380 . 1 1 54 54 LEU HB2 H 1 -1.009 0.003 . 2 . . . A 99 LEU HB2 . 19439 1
381 . 1 1 54 54 LEU HB3 H 1 0.851 0.015 . 2 . . . A 99 LEU HB3 . 19439 1
382 . 1 1 54 54 LEU HG H 1 0.399 0.001 . 1 . . . A 99 LEU HG . 19439 1
383 . 1 1 54 54 LEU HD11 H 1 0.235 0.001 . 2 . . . A 99 LEU HD11 . 19439 1
384 . 1 1 54 54 LEU HD12 H 1 0.235 0.001 . 2 . . . A 99 LEU HD12 . 19439 1
385 . 1 1 54 54 LEU HD13 H 1 0.235 0.001 . 2 . . . A 99 LEU HD13 . 19439 1
386 . 1 1 54 54 LEU HD21 H 1 0.235 0.001 . 2 . . . A 99 LEU HD21 . 19439 1
387 . 1 1 54 54 LEU HD22 H 1 0.235 0.001 . 2 . . . A 99 LEU HD22 . 19439 1
388 . 1 1 54 54 LEU HD23 H 1 0.235 0.001 . 2 . . . A 99 LEU HD23 . 19439 1
389 . 1 1 54 54 LEU CA C 13 54.352 0.037 . 1 . . . A 99 LEU CA . 19439 1
390 . 1 1 54 54 LEU CB C 13 40.485 0.000 . 1 . . . A 99 LEU CB . 19439 1
391 . 1 1 54 54 LEU N N 15 127.814 0.008 . 1 . . . A 99 LEU N . 19439 1
392 . 1 1 55 55 ASP H H 1 8.018 0.024 . 1 . . . A 100 ASP H . 19439 1
393 . 1 1 55 55 ASP HA H 1 4.646 0.005 . 1 . . . A 100 ASP HA . 19439 1
394 . 1 1 55 55 ASP HB2 H 1 2.695 0.002 . 2 . . . A 100 ASP HB2 . 19439 1
395 . 1 1 55 55 ASP HB3 H 1 2.256 0.004 . 2 . . . A 100 ASP HB3 . 19439 1
396 . 1 1 55 55 ASP CA C 13 52.894 0.000 . 1 . . . A 100 ASP CA . 19439 1
397 . 1 1 55 55 ASP CB C 13 41.224 0.045 . 1 . . . A 100 ASP CB . 19439 1
398 . 1 1 55 55 ASP N N 15 126.633 0.004 . 1 . . . A 100 ASP N . 19439 1
399 . 1 1 56 56 MET H H 1 8.639 0.022 . 1 . . . A 101 MET H . 19439 1
400 . 1 1 56 56 MET HA H 1 4.481 0.001 . 1 . . . A 101 MET HA . 19439 1
401 . 1 1 56 56 MET HB2 H 1 1.972 0.003 . 2 . . . A 101 MET HB2 . 19439 1
402 . 1 1 56 56 MET HB3 H 1 1.875 0.002 . 2 . . . A 101 MET HB3 . 19439 1
403 . 1 1 56 56 MET HG2 H 1 2.236 0.001 . 2 . . . A 101 MET HG2 . 19439 1
404 . 1 1 56 56 MET HG3 H 1 2.160 0.001 . 2 . . . A 101 MET HG3 . 19439 1
405 . 1 1 56 56 MET HE1 H 1 1.881 0.003 . 1 . . . A 101 MET HE1 . 19439 1
406 . 1 1 56 56 MET HE2 H 1 1.881 0.003 . 1 . . . A 101 MET HE2 . 19439 1
407 . 1 1 56 56 MET HE3 H 1 1.881 0.003 . 1 . . . A 101 MET HE3 . 19439 1
408 . 1 1 56 56 MET CA C 13 53.398 0.100 . 1 . . . A 101 MET CA . 19439 1
409 . 1 1 56 56 MET CB C 13 33.296 0.013 . 1 . . . A 101 MET CB . 19439 1
410 . 1 1 56 56 MET N N 15 122.473 0.006 . 1 . . . A 101 MET N . 19439 1
411 . 1 1 57 57 SER H H 1 8.096 0.035 . 1 . . . A 102 SER H . 19439 1
412 . 1 1 57 57 SER HA H 1 4.114 0.003 . 1 . . . A 102 SER HA . 19439 1
413 . 1 1 57 57 SER HB2 H 1 4.011 0.002 . 2 . . . A 102 SER HB2 . 19439 1
414 . 1 1 57 57 SER HB3 H 1 4.011 0.002 . 2 . . . A 102 SER HB3 . 19439 1
415 . 1 1 57 57 SER CA C 13 58.709 0.032 . 1 . . . A 102 SER CA . 19439 1
416 . 1 1 57 57 SER CB C 13 64.701 0.021 . 1 . . . A 102 SER CB . 19439 1
417 . 1 1 57 57 SER N N 15 116.243 0.004 . 1 . . . A 102 SER N . 19439 1
418 . 1 1 58 58 ASP H H 1 8.669 0.024 . 1 . . . A 103 ASP H . 19439 1
419 . 1 1 58 58 ASP HA H 1 3.724 0.001 . 1 . . . A 103 ASP HA . 19439 1
420 . 1 1 58 58 ASP HB2 H 1 2.338 0.005 . 2 . . . A 103 ASP HB2 . 19439 1
421 . 1 1 58 58 ASP HB3 H 1 2.139 0.003 . 2 . . . A 103 ASP HB3 . 19439 1
422 . 1 1 58 58 ASP CA C 13 57.296 0.035 . 1 . . . A 103 ASP CA . 19439 1
423 . 1 1 58 58 ASP CB C 13 38.720 0.031 . 1 . . . A 103 ASP CB . 19439 1
424 . 1 1 58 58 ASP N N 15 121.639 0.007 . 1 . . . A 103 ASP N . 19439 1
425 . 1 1 59 59 LYS H H 1 7.775 0.022 . 1 . . . A 104 LYS H . 19439 1
426 . 1 1 59 59 LYS HA H 1 3.678 0.004 . 1 . . . A 104 LYS HA . 19439 1
427 . 1 1 59 59 LYS HB2 H 1 1.713 0.003 . 2 . . . A 104 LYS HB2 . 19439 1
428 . 1 1 59 59 LYS HB3 H 1 1.631 0.009 . 2 . . . A 104 LYS HB3 . 19439 1
429 . 1 1 59 59 LYS HG2 H 1 1.295 0.000 . 2 . . . A 104 LYS HG2 . 19439 1
430 . 1 1 59 59 LYS HG3 H 1 1.295 0.000 . 2 . . . A 104 LYS HG3 . 19439 1
431 . 1 1 59 59 LYS CA C 13 59.833 0.010 . 1 . . . A 104 LYS CA . 19439 1
432 . 1 1 59 59 LYS CB C 13 32.090 0.000 . 1 . . . A 104 LYS CB . 19439 1
433 . 1 1 59 59 LYS N N 15 116.276 0.004 . 1 . . . A 104 LYS N . 19439 1
434 . 1 1 60 60 ALA H H 1 7.266 0.028 . 1 . . . A 105 ALA H . 19439 1
435 . 1 1 60 60 ALA HA H 1 3.873 0.001 . 1 . . . A 105 ALA HA . 19439 1
436 . 1 1 60 60 ALA HB1 H 1 1.218 0.001 . 1 . . . A 105 ALA HB1 . 19439 1
437 . 1 1 60 60 ALA HB2 H 1 1.218 0.001 . 1 . . . A 105 ALA HB2 . 19439 1
438 . 1 1 60 60 ALA HB3 H 1 1.218 0.001 . 1 . . . A 105 ALA HB3 . 19439 1
439 . 1 1 60 60 ALA CA C 13 55.008 0.001 . 1 . . . A 105 ALA CA . 19439 1
440 . 1 1 60 60 ALA CB C 13 17.741 0.009 . 1 . . . A 105 ALA CB . 19439 1
441 . 1 1 60 60 ALA N N 15 122.257 0.001 . 1 . . . A 105 ALA N . 19439 1
442 . 1 1 61 61 ILE H H 1 7.974 0.023 . 1 . . . A 106 ILE H . 19439 1
443 . 1 1 61 61 ILE HA H 1 3.419 0.002 . 1 . . . A 106 ILE HA . 19439 1
444 . 1 1 61 61 ILE HB H 1 1.740 0.005 . 1 . . . A 106 ILE HB . 19439 1
445 . 1 1 61 61 ILE HG12 H 1 1.576 0.002 . 2 . . . A 106 ILE HG12 . 19439 1
446 . 1 1 61 61 ILE HG13 H 1 1.576 0.002 . 2 . . . A 106 ILE HG13 . 19439 1
447 . 1 1 61 61 ILE HG21 H 1 0.795 0.002 . 1 . . . A 106 ILE HG21 . 19439 1
448 . 1 1 61 61 ILE HG22 H 1 0.795 0.002 . 1 . . . A 106 ILE HG22 . 19439 1
449 . 1 1 61 61 ILE HG23 H 1 0.795 0.002 . 1 . . . A 106 ILE HG23 . 19439 1
450 . 1 1 61 61 ILE HD11 H 1 0.747 0.001 . 1 . . . A 106 ILE HD11 . 19439 1
451 . 1 1 61 61 ILE HD12 H 1 0.747 0.001 . 1 . . . A 106 ILE HD12 . 19439 1
452 . 1 1 61 61 ILE HD13 H 1 0.747 0.001 . 1 . . . A 106 ILE HD13 . 19439 1
453 . 1 1 61 61 ILE CA C 13 65.971 0.034 . 1 . . . A 106 ILE CA . 19439 1
454 . 1 1 61 61 ILE CB C 13 37.430 0.000 . 1 . . . A 106 ILE CB . 19439 1
455 . 1 1 61 61 ILE N N 15 119.452 0.003 . 1 . . . A 106 ILE N . 19439 1
456 . 1 1 62 62 PHE H H 1 8.434 0.024 . 1 . . . A 107 PHE H . 19439 1
457 . 1 1 62 62 PHE HA H 1 4.368 0.002 . 1 . . . A 107 PHE HA . 19439 1
458 . 1 1 62 62 PHE HB2 H 1 3.101 0.004 . 2 . . . A 107 PHE HB2 . 19439 1
459 . 1 1 62 62 PHE HB3 H 1 3.014 0.003 . 2 . . . A 107 PHE HB3 . 19439 1
460 . 1 1 62 62 PHE HD1 H 1 6.901 0.001 . 3 . . . A 107 PHE HD1 . 19439 1
461 . 1 1 62 62 PHE HD2 H 1 6.901 0.001 . 3 . . . A 107 PHE HD2 . 19439 1
462 . 1 1 62 62 PHE HE1 H 1 7.091 0.000 . 3 . . . A 107 PHE HE1 . 19439 1
463 . 1 1 62 62 PHE HE2 H 1 7.091 0.000 . 3 . . . A 107 PHE HE2 . 19439 1
464 . 1 1 62 62 PHE CA C 13 56.844 0.017 . 1 . . . A 107 PHE CA . 19439 1
465 . 1 1 62 62 PHE CB C 13 37.150 0.031 . 1 . . . A 107 PHE CB . 19439 1
466 . 1 1 62 62 PHE N N 15 117.814 0.011 . 1 . . . A 107 PHE N . 19439 1
467 . 1 1 63 63 ARG H H 1 7.474 0.031 . 1 . . . A 108 ARG H . 19439 1
468 . 1 1 63 63 ARG HA H 1 3.994 0.002 . 1 . . . A 108 ARG HA . 19439 1
469 . 1 1 63 63 ARG HB2 H 1 1.830 0.001 . 2 . . . A 108 ARG HB2 . 19439 1
470 . 1 1 63 63 ARG HB3 H 1 1.777 0.002 . 2 . . . A 108 ARG HB3 . 19439 1
471 . 1 1 63 63 ARG HG2 H 1 1.689 0.000 . 2 . . . A 108 ARG HG2 . 19439 1
472 . 1 1 63 63 ARG CA C 13 58.682 0.080 . 1 . . . A 108 ARG CA . 19439 1
473 . 1 1 63 63 ARG CB C 13 30.287 0.034 . 1 . . . A 108 ARG CB . 19439 1
474 . 1 1 63 63 ARG N N 15 117.368 0.012 . 1 . . . A 108 ARG N . 19439 1
475 . 1 1 64 64 ARG H H 1 7.118 0.030 . 1 . . . A 109 ARG H . 19439 1
476 . 1 1 64 64 ARG HA H 1 3.900 0.002 . 1 . . . A 109 ARG HA . 19439 1
477 . 1 1 64 64 ARG HB2 H 1 1.396 0.003 . 2 . . . A 109 ARG HB2 . 19439 1
478 . 1 1 64 64 ARG HB3 H 1 1.094 0.004 . 2 . . . A 109 ARG HB3 . 19439 1
479 . 1 1 64 64 ARG HG2 H 1 1.046 0.003 . 2 . . . A 109 ARG HG2 . 19439 1
480 . 1 1 64 64 ARG HG3 H 1 0.858 0.001 . 2 . . . A 109 ARG HG3 . 19439 1
481 . 1 1 64 64 ARG CA C 13 57.312 0.024 . 1 . . . A 109 ARG CA . 19439 1
482 . 1 1 64 64 ARG CB C 13 31.626 0.002 . 1 . . . A 109 ARG CB . 19439 1
483 . 1 1 64 64 ARG N N 15 117.440 0.006 . 1 . . . A 109 ARG N . 19439 1
484 . 1 1 65 65 TYR H H 1 8.707 0.024 . 1 . . . A 110 TYR H . 19439 1
485 . 1 1 65 65 TYR HA H 1 5.265 0.002 . 1 . . . A 110 TYR HA . 19439 1
486 . 1 1 65 65 TYR HB2 H 1 3.002 0.003 . 2 . . . A 110 TYR HB2 . 19439 1
487 . 1 1 65 65 TYR HB3 H 1 2.971 0.008 . 2 . . . A 110 TYR HB3 . 19439 1
488 . 1 1 65 65 TYR HD1 H 1 7.221 0.002 . 3 . . . A 110 TYR HD1 . 19439 1
489 . 1 1 65 65 TYR HD2 H 1 7.221 0.002 . 3 . . . A 110 TYR HD2 . 19439 1
490 . 1 1 65 65 TYR HE1 H 1 6.734 0.005 . 3 . . . A 110 TYR HE1 . 19439 1
491 . 1 1 65 65 TYR HE2 H 1 6.734 0.005 . 3 . . . A 110 TYR HE2 . 19439 1
492 . 1 1 65 65 TYR CA C 13 54.188 0.000 . 1 . . . A 110 TYR CA . 19439 1
493 . 1 1 65 65 TYR CB C 13 38.484 0.000 . 1 . . . A 110 TYR CB . 19439 1
494 . 1 1 65 65 TYR N N 15 116.060 0.002 . 1 . . . A 110 TYR N . 19439 1
495 . 1 1 66 66 PRO HA H 1 4.388 0.003 . 1 . . . A 111 PRO HA . 19439 1
496 . 1 1 66 66 PRO HB2 H 1 2.358 0.002 . 2 . . . A 111 PRO HB2 . 19439 1
497 . 1 1 66 66 PRO HB3 H 1 1.993 0.000 . 2 . . . A 111 PRO HB3 . 19439 1
498 . 1 1 66 66 PRO HG2 H 1 2.219 0.000 . 2 . . . A 111 PRO HG2 . 19439 1
499 . 1 1 66 66 PRO HG3 H 1 2.070 0.001 . 2 . . . A 111 PRO HG3 . 19439 1
500 . 1 1 66 66 PRO HD2 H 1 3.964 0.000 . 2 . . . A 111 PRO HD2 . 19439 1
501 . 1 1 66 66 PRO HD3 H 1 3.296 0.002 . 2 . . . A 111 PRO HD3 . 19439 1
502 . 1 1 66 66 PRO CA C 13 64.847 0.000 . 1 . . . A 111 PRO CA . 19439 1
503 . 1 1 66 66 PRO CB C 13 31.381 0.000 . 1 . . . A 111 PRO CB . 19439 1
504 . 1 1 67 67 HIS H H 1 8.196 0.029 . 1 . . . A 112 HIS H . 19439 1
505 . 1 1 67 67 HIS HA H 1 4.482 0.001 . 1 . . . A 112 HIS HA . 19439 1
506 . 1 1 67 67 HIS HB2 H 1 3.243 0.002 . 2 . . . A 112 HIS HB2 . 19439 1
507 . 1 1 67 67 HIS HB3 H 1 2.887 0.003 . 2 . . . A 112 HIS HB3 . 19439 1
508 . 1 1 67 67 HIS HD2 H 1 7.220 0.001 . 1 . . . A 112 HIS HD2 . 19439 1
509 . 1 1 67 67 HIS HE1 H 1 7.775 0.003 . 1 . . . A 112 HIS HE1 . 19439 1
510 . 1 1 67 67 HIS CA C 13 58.498 0.025 . 1 . . . A 112 HIS CA . 19439 1
511 . 1 1 67 67 HIS CB C 13 29.654 0.013 . 1 . . . A 112 HIS CB . 19439 1
512 . 1 1 67 67 HIS N N 15 115.542 0.006 . 1 . . . A 112 HIS N . 19439 1
513 . 1 1 68 68 LEU H H 1 7.527 0.026 . 1 . . . A 113 LEU H . 19439 1
514 . 1 1 68 68 LEU HA H 1 4.165 0.003 . 1 . . . A 113 LEU HA . 19439 1
515 . 1 1 68 68 LEU HB2 H 1 1.662 0.002 . 2 . . . A 113 LEU HB2 . 19439 1
516 . 1 1 68 68 LEU HB3 H 1 1.421 0.005 . 2 . . . A 113 LEU HB3 . 19439 1
517 . 1 1 68 68 LEU HG H 1 0.428 0.001 . 1 . . . A 113 LEU HG . 19439 1
518 . 1 1 68 68 LEU HD11 H 1 -0.042 0.001 . 2 . . . A 113 LEU HD11 . 19439 1
519 . 1 1 68 68 LEU HD12 H 1 -0.042 0.001 . 2 . . . A 113 LEU HD12 . 19439 1
520 . 1 1 68 68 LEU HD13 H 1 -0.042 0.001 . 2 . . . A 113 LEU HD13 . 19439 1
521 . 1 1 68 68 LEU HD21 H 1 0.496 0.006 . 2 . . . A 113 LEU HD21 . 19439 1
522 . 1 1 68 68 LEU HD22 H 1 0.496 0.006 . 2 . . . A 113 LEU HD22 . 19439 1
523 . 1 1 68 68 LEU HD23 H 1 0.496 0.006 . 2 . . . A 113 LEU HD23 . 19439 1
524 . 1 1 68 68 LEU CA C 13 54.013 0.031 . 1 . . . A 113 LEU CA . 19439 1
525 . 1 1 68 68 LEU CB C 13 41.669 0.006 . 1 . . . A 113 LEU CB . 19439 1
526 . 1 1 68 68 LEU N N 15 120.583 0.003 . 1 . . . A 113 LEU N . 19439 1
527 . 1 1 69 69 ARG H H 1 6.997 0.029 . 1 . . . A 114 ARG H . 19439 1
528 . 1 1 69 69 ARG CA C 13 58.975 0.000 . 1 . . . A 114 ARG CA . 19439 1
529 . 1 1 69 69 ARG CB C 13 30.783 0.000 . 1 . . . A 114 ARG CB . 19439 1
530 . 1 1 69 69 ARG N N 15 125.491 0.010 . 1 . . . A 114 ARG N . 19439 1
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