Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 36171
_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 $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-1H NOESY' 1 $sample_1 isotropic 36171 1
2 '2D 1H-15N HSQC' 1 $sample_1 isotropic 36171 1
3 '3D HNHA' 1 $sample_1 isotropic 36171 1
4 '3D HNHB' 1 $sample_1 isotropic 36171 1
5 '3D HCCH-TOCSY' 1 $sample_1 isotropic 36171 1
6 '3D CBCA(CO)NH' 1 $sample_1 isotropic 36171 1
7 '3D HNCACB' 1 $sample_1 isotropic 36171 1
8 '3D HNCO' 1 $sample_1 isotropic 36171 1
9 '3D 1H-13C NOESY' 1 $sample_1 isotropic 36171 1
10 '3D 1H-15N NOESY' 1 $sample_1 isotropic 36171 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 ASN HD21 H 1 7.653 0.000 . . . . . . A 1 ASN HD21 . 36171 1
2 . 1 1 1 1 ASN HD22 H 1 6.957 0.049 . . . . . . A 1 ASN HD22 . 36171 1
3 . 1 1 1 1 ASN C C 13 171.536 0.000 . . . . . . A 1 ASN C . 36171 1
4 . 1 1 1 1 ASN CG C 13 175.564 0.000 . . . . . . A 1 ASN CG . 36171 1
5 . 1 1 1 1 ASN ND2 N 15 112.239 0.397 . . . . . . A 1 ASN ND2 . 36171 1
6 . 1 1 2 2 ARG H H 1 8.677 0.007 . . . . . . A 2 ARG H . 36171 1
7 . 1 1 2 2 ARG HA H 1 4.429 0.017 . . . . . . A 2 ARG HA . 36171 1
8 . 1 1 2 2 ARG HB2 H 1 1.864 0.017 . . . . . . A 2 ARG HB2 . 36171 1
9 . 1 1 2 2 ARG HG2 H 1 1.848 0.017 . . . . . . A 2 ARG HG2 . 36171 1
10 . 1 1 2 2 ARG HD2 H 1 3.213 0.008 . . . . . . A 2 ARG HD2 . 36171 1
11 . 1 1 2 2 ARG HE H 1 7.205 0.002 . . . . . . A 2 ARG HE . 36171 1
12 . 1 1 2 2 ARG C C 13 175.645 0.000 . . . . . . A 2 ARG C . 36171 1
13 . 1 1 2 2 ARG CA C 13 56.067 0.064 . . . . . . A 2 ARG CA . 36171 1
14 . 1 1 2 2 ARG CB C 13 31.093 0.085 . . . . . . A 2 ARG CB . 36171 1
15 . 1 1 2 2 ARG CG C 13 26.813 0.088 . . . . . . A 2 ARG CG . 36171 1
16 . 1 1 2 2 ARG CD C 13 43.434 0.036 . . . . . . A 2 ARG CD . 36171 1
17 . 1 1 2 2 ARG N N 15 121.532 0.023 . . . . . . A 2 ARG N . 36171 1
18 . 1 1 2 2 ARG NE N 15 120.782 0.032 . . . . . . A 2 ARG NE . 36171 1
19 . 1 1 3 3 LEU H H 1 8.241 0.019 . . . . . . A 3 LEU H . 36171 1
20 . 1 1 3 3 LEU HA H 1 4.215 0.012 . . . . . . A 3 LEU HA . 36171 1
21 . 1 1 3 3 LEU HB3 H 1 1.463 0.012 . . . . . . A 3 LEU HB3 . 36171 1
22 . 1 1 3 3 LEU HG H 1 1.614 0.002 . . . . . . A 3 LEU HG . 36171 1
23 . 1 1 3 3 LEU HD11 H 1 0.902 0.012 . . . . . . A 3 LEU HD11 . 36171 1
24 . 1 1 3 3 LEU HD12 H 1 0.902 0.012 . . . . . . A 3 LEU HD12 . 36171 1
25 . 1 1 3 3 LEU HD13 H 1 0.902 0.012 . . . . . . A 3 LEU HD13 . 36171 1
26 . 1 1 3 3 LEU HD21 H 1 0.852 0.003 . . . . . . A 3 LEU HD21 . 36171 1
27 . 1 1 3 3 LEU HD22 H 1 0.852 0.003 . . . . . . A 3 LEU HD22 . 36171 1
28 . 1 1 3 3 LEU HD23 H 1 0.852 0.003 . . . . . . A 3 LEU HD23 . 36171 1
29 . 1 1 3 3 LEU C C 13 175.268 0.000 . . . . . . A 3 LEU C . 36171 1
30 . 1 1 3 3 LEU CA C 13 55.245 0.036 . . . . . . A 3 LEU CA . 36171 1
31 . 1 1 3 3 LEU CB C 13 43.297 0.073 . . . . . . A 3 LEU CB . 36171 1
32 . 1 1 3 3 LEU CG C 13 26.991 0.044 . . . . . . A 3 LEU CG . 36171 1
33 . 1 1 3 3 LEU CD1 C 13 24.161 0.101 . . . . . . A 3 LEU CD1 . 36171 1
34 . 1 1 3 3 LEU CD2 C 13 24.733 0.014 . . . . . . A 3 LEU CD2 . 36171 1
35 . 1 1 3 3 LEU N N 15 124.802 0.063 . . . . . . A 3 LEU N . 36171 1
36 . 1 1 4 4 CYS H H 1 8.630 0.016 . . . . . . A 4 CYS H . 36171 1
37 . 1 1 4 4 CYS HA H 1 4.984 0.007 . . . . . . A 4 CYS HA . 36171 1
38 . 1 1 4 4 CYS C C 13 173.527 0.000 . . . . . . A 4 CYS C . 36171 1
39 . 1 1 4 4 CYS CA C 13 55.475 0.029 . . . . . . A 4 CYS CA . 36171 1
40 . 1 1 4 4 CYS CB C 13 42.430 0.000 . . . . . . A 4 CYS CB . 36171 1
41 . 1 1 4 4 CYS N N 15 125.664 0.106 . . . . . . A 4 CYS N . 36171 1
42 . 1 1 5 5 THR H H 1 9.132 0.012 . . . . . . A 5 THR H . 36171 1
43 . 1 1 5 5 THR HA H 1 4.486 0.004 . . . . . . A 5 THR HA . 36171 1
44 . 1 1 5 5 THR HB H 1 3.918 0.006 . . . . . . A 5 THR HB . 36171 1
45 . 1 1 5 5 THR HG21 H 1 0.614 0.005 . . . . . . A 5 THR HG21 . 36171 1
46 . 1 1 5 5 THR HG22 H 1 0.614 0.005 . . . . . . A 5 THR HG22 . 36171 1
47 . 1 1 5 5 THR HG23 H 1 0.614 0.005 . . . . . . A 5 THR HG23 . 36171 1
48 . 1 1 5 5 THR C C 13 171.832 0.000 . . . . . . A 5 THR C . 36171 1
49 . 1 1 5 5 THR CA C 13 60.165 0.049 . . . . . . A 5 THR CA . 36171 1
50 . 1 1 5 5 THR CB C 13 68.146 0.061 . . . . . . A 5 THR CB . 36171 1
51 . 1 1 5 5 THR CG2 C 13 18.369 0.081 . . . . . . A 5 THR CG2 . 36171 1
52 . 1 1 5 5 THR N N 15 121.611 0.060 . . . . . . A 5 THR N . 36171 1
53 . 1 1 6 6 ASN H H 1 8.396 0.012 . . . . . . A 6 ASN H . 36171 1
54 . 1 1 6 6 ASN HA H 1 4.497 0.006 . . . . . . A 6 ASN HA . 36171 1
55 . 1 1 6 6 ASN HB2 H 1 2.987 0.011 . . . . . . A 6 ASN HB2 . 36171 1
56 . 1 1 6 6 ASN HD21 H 1 7.287 0.016 . . . . . . A 6 ASN HD21 . 36171 1
57 . 1 1 6 6 ASN HD22 H 1 6.468 0.018 . . . . . . A 6 ASN HD22 . 36171 1
58 . 1 1 6 6 ASN C C 13 173.602 0.000 . . . . . . A 6 ASN C . 36171 1
59 . 1 1 6 6 ASN CA C 13 52.026 0.033 . . . . . . A 6 ASN CA . 36171 1
60 . 1 1 6 6 ASN CB C 13 40.563 0.025 . . . . . . A 6 ASN CB . 36171 1
61 . 1 1 6 6 ASN CG C 13 175.079 0.000 . . . . . . A 6 ASN CG . 36171 1
62 . 1 1 6 6 ASN N N 15 114.712 0.085 . . . . . . A 6 ASN N . 36171 1
63 . 1 1 6 6 ASN ND2 N 15 115.413 0.083 . . . . . . A 6 ASN ND2 . 36171 1
64 . 1 1 7 7 CYS H H 1 9.108 0.005 . . . . . . A 7 CYS H . 36171 1
65 . 1 1 7 7 CYS HA H 1 3.524 0.001 . . . . . . A 7 CYS HA . 36171 1
66 . 1 1 7 7 CYS HB2 H 1 2.754 0.001 . . . . . . A 7 CYS HB2 . 36171 1
67 . 1 1 7 7 CYS HB3 H 1 2.944 0.018 . . . . . . A 7 CYS HB3 . 36171 1
68 . 1 1 7 7 CYS C C 13 174.353 0.000 . . . . . . A 7 CYS C . 36171 1
69 . 1 1 7 7 CYS CA C 13 60.226 0.088 . . . . . . A 7 CYS CA . 36171 1
70 . 1 1 7 7 CYS CB C 13 41.001 0.084 . . . . . . A 7 CYS CB . 36171 1
71 . 1 1 7 7 CYS N N 15 116.880 0.043 . . . . . . A 7 CYS N . 36171 1
72 . 1 1 8 8 CYS H H 1 7.676 0.013 . . . . . . A 8 CYS H . 36171 1
73 . 1 1 8 8 CYS HA H 1 4.081 0.020 . . . . . . A 8 CYS HA . 36171 1
74 . 1 1 8 8 CYS HB2 H 1 3.585 0.000 . . . . . . A 8 CYS HB2 . 36171 1
75 . 1 1 8 8 CYS HB3 H 1 2.730 0.009 . . . . . . A 8 CYS HB3 . 36171 1
76 . 1 1 8 8 CYS C C 13 174.804 0.000 . . . . . . A 8 CYS C . 36171 1
77 . 1 1 8 8 CYS CA C 13 59.575 0.055 . . . . . . A 8 CYS CA . 36171 1
78 . 1 1 8 8 CYS CB C 13 34.052 0.024 . . . . . . A 8 CYS CB . 36171 1
79 . 1 1 8 8 CYS N N 15 117.570 0.037 . . . . . . A 8 CYS N . 36171 1
80 . 1 1 9 9 ALA H H 1 7.962 0.010 . . . . . . A 9 ALA H . 36171 1
81 . 1 1 9 9 ALA HA H 1 3.910 0.007 . . . . . . A 9 ALA HA . 36171 1
82 . 1 1 9 9 ALA HB1 H 1 1.133 0.008 . . . . . . A 9 ALA HB1 . 36171 1
83 . 1 1 9 9 ALA HB2 H 1 1.133 0.008 . . . . . . A 9 ALA HB2 . 36171 1
84 . 1 1 9 9 ALA HB3 H 1 1.133 0.008 . . . . . . A 9 ALA HB3 . 36171 1
85 . 1 1 9 9 ALA C C 13 178.750 0.000 . . . . . . A 9 ALA C . 36171 1
86 . 1 1 9 9 ALA CA C 13 52.607 0.065 . . . . . . A 9 ALA CA . 36171 1
87 . 1 1 9 9 ALA CB C 13 19.457 0.044 . . . . . . A 9 ALA CB . 36171 1
88 . 1 1 9 9 ALA N N 15 120.053 0.026 . . . . . . A 9 ALA N . 36171 1
89 . 1 1 10 10 GLY H H 1 8.032 0.009 . . . . . . A 10 GLY H . 36171 1
90 . 1 1 10 10 GLY HA2 H 1 3.167 0.005 . . . . . . A 10 GLY HA2 . 36171 1
91 . 1 1 10 10 GLY HA3 H 1 3.855 0.009 . . . . . . A 10 GLY HA3 . 36171 1
92 . 1 1 10 10 GLY C C 13 170.931 0.000 . . . . . . A 10 GLY C . 36171 1
93 . 1 1 10 10 GLY CA C 13 44.477 0.083 . . . . . . A 10 GLY CA . 36171 1
94 . 1 1 10 10 GLY N N 15 107.791 0.055 . . . . . . A 10 GLY N . 36171 1
95 . 1 1 11 11 ARG H H 1 8.190 0.011 . . . . . . A 11 ARG H . 36171 1
96 . 1 1 11 11 ARG HA H 1 4.434 0.002 . . . . . . A 11 ARG HA . 36171 1
97 . 1 1 11 11 ARG HB2 H 1 1.820 0.002 . . . . . . A 11 ARG HB2 . 36171 1
98 . 1 1 11 11 ARG HG2 H 1 1.769 0.006 . . . . . . A 11 ARG HG2 . 36171 1
99 . 1 1 11 11 ARG HD2 H 1 3.228 0.008 . . . . . . A 11 ARG HD2 . 36171 1
100 . 1 1 11 11 ARG HE H 1 7.251 0.001 . . . . . . A 11 ARG HE . 36171 1
101 . 1 1 11 11 ARG C C 13 176.810 0.000 . . . . . . A 11 ARG C . 36171 1
102 . 1 1 11 11 ARG CA C 13 56.112 0.087 . . . . . . A 11 ARG CA . 36171 1
103 . 1 1 11 11 ARG CB C 13 31.870 0.000 . . . . . . A 11 ARG CB . 36171 1
104 . 1 1 11 11 ARG CG C 13 27.431 0.067 . . . . . . A 11 ARG CG . 36171 1
105 . 1 1 11 11 ARG CD C 13 43.805 0.018 . . . . . . A 11 ARG CD . 36171 1
106 . 1 1 11 11 ARG N N 15 122.027 0.077 . . . . . . A 11 ARG N . 36171 1
107 . 1 1 11 11 ARG NE N 15 120.841 0.003 . . . . . . A 11 ARG NE . 36171 1
108 . 1 1 12 12 LYS H H 1 8.277 0.014 . . . . . . A 12 LYS H . 36171 1
109 . 1 1 12 12 LYS HA H 1 4.133 0.000 . . . . . . A 12 LYS HA . 36171 1
110 . 1 1 12 12 LYS HB2 H 1 1.337 0.007 . . . . . . A 12 LYS HB2 . 36171 1
111 . 1 1 12 12 LYS HB3 H 1 1.673 0.005 . . . . . . A 12 LYS HB3 . 36171 1
112 . 1 1 12 12 LYS HG2 H 1 1.309 0.025 . . . . . . A 12 LYS HG2 . 36171 1
113 . 1 1 12 12 LYS HD2 H 1 1.596 0.006 . . . . . . A 12 LYS HD2 . 36171 1
114 . 1 1 12 12 LYS HE2 H 1 2.946 0.019 . . . . . . A 12 LYS HE2 . 36171 1
115 . 1 1 12 12 LYS C C 13 177.438 0.000 . . . . . . A 12 LYS C . 36171 1
116 . 1 1 12 12 LYS CA C 13 57.692 0.040 . . . . . . A 12 LYS CA . 36171 1
117 . 1 1 12 12 LYS CB C 13 32.523 0.038 . . . . . . A 12 LYS CB . 36171 1
118 . 1 1 12 12 LYS CG C 13 24.768 0.064 . . . . . . A 12 LYS CG . 36171 1
119 . 1 1 12 12 LYS CD C 13 29.651 0.041 . . . . . . A 12 LYS CD . 36171 1
120 . 1 1 12 12 LYS CE C 13 42.119 0.010 . . . . . . A 12 LYS CE . 36171 1
121 . 1 1 12 12 LYS N N 15 126.499 0.118 . . . . . . A 12 LYS N . 36171 1
122 . 1 1 13 13 GLY H H 1 8.683 0.006 . . . . . . A 13 GLY H . 36171 1
123 . 1 1 13 13 GLY HA2 H 1 4.307 0.016 . . . . . . A 13 GLY HA2 . 36171 1
124 . 1 1 13 13 GLY HA3 H 1 3.619 0.022 . . . . . . A 13 GLY HA3 . 36171 1
125 . 1 1 13 13 GLY C C 13 174.090 0.000 . . . . . . A 13 GLY C . 36171 1
126 . 1 1 13 13 GLY CA C 13 44.992 0.004 . . . . . . A 13 GLY CA . 36171 1
127 . 1 1 13 13 GLY N N 15 114.373 0.141 . . . . . . A 13 GLY N . 36171 1
128 . 1 1 14 14 CYS H H 1 8.322 0.009 . . . . . . A 14 CYS H . 36171 1
129 . 1 1 14 14 CYS HA H 1 5.050 0.008 . . . . . . A 14 CYS HA . 36171 1
130 . 1 1 14 14 CYS HB2 H 1 3.633 0.009 . . . . . . A 14 CYS HB2 . 36171 1
131 . 1 1 14 14 CYS HB3 H 1 2.140 0.009 . . . . . . A 14 CYS HB3 . 36171 1
132 . 1 1 14 14 CYS C C 13 171.824 0.000 . . . . . . A 14 CYS C . 36171 1
133 . 1 1 14 14 CYS CA C 13 55.818 0.028 . . . . . . A 14 CYS CA . 36171 1
134 . 1 1 14 14 CYS CB C 13 46.656 0.039 . . . . . . A 14 CYS CB . 36171 1
135 . 1 1 14 14 CYS N N 15 117.381 0.048 . . . . . . A 14 CYS N . 36171 1
136 . 1 1 15 15 ASN H H 1 8.642 0.016 . . . . . . A 15 ASN H . 36171 1
137 . 1 1 15 15 ASN HA H 1 5.192 0.011 . . . . . . A 15 ASN HA . 36171 1
138 . 1 1 15 15 ASN HB3 H 1 2.308 0.014 . . . . . . A 15 ASN HB3 . 36171 1
139 . 1 1 15 15 ASN HD21 H 1 7.117 0.008 . . . . . . A 15 ASN HD21 . 36171 1
140 . 1 1 15 15 ASN HD22 H 1 6.614 0.006 . . . . . . A 15 ASN HD22 . 36171 1
141 . 1 1 15 15 ASN C C 13 173.068 0.000 . . . . . . A 15 ASN C . 36171 1
142 . 1 1 15 15 ASN CA C 13 51.534 0.039 . . . . . . A 15 ASN CA . 36171 1
143 . 1 1 15 15 ASN CB C 13 42.251 0.033 . . . . . . A 15 ASN CB . 36171 1
144 . 1 1 15 15 ASN CG C 13 175.456 0.000 . . . . . . A 15 ASN CG . 36171 1
145 . 1 1 15 15 ASN N N 15 120.412 0.046 . . . . . . A 15 ASN N . 36171 1
146 . 1 1 15 15 ASN ND2 N 15 110.949 0.069 . . . . . . A 15 ASN ND2 . 36171 1
147 . 1 1 16 16 TYR H H 1 8.505 0.007 . . . . . . A 16 TYR H . 36171 1
148 . 1 1 16 16 TYR HA H 1 4.637 0.009 . . . . . . A 16 TYR HA . 36171 1
149 . 1 1 16 16 TYR HB3 H 1 2.535 0.018 . . . . . . A 16 TYR HB3 . 36171 1
150 . 1 1 16 16 TYR HD1 H 1 6.880 0.009 . . . . . . A 16 TYR HD1 . 36171 1
151 . 1 1 16 16 TYR HD2 H 1 6.880 0.009 . . . . . . A 16 TYR HD2 . 36171 1
152 . 1 1 16 16 TYR HE1 H 1 6.623 0.010 . . . . . . A 16 TYR HE1 . 36171 1
153 . 1 1 16 16 TYR HE2 H 1 6.623 0.010 . . . . . . A 16 TYR HE2 . 36171 1
154 . 1 1 16 16 TYR C C 13 174.101 0.000 . . . . . . A 16 TYR C . 36171 1
155 . 1 1 16 16 TYR CA C 13 58.635 0.048 . . . . . . A 16 TYR CA . 36171 1
156 . 1 1 16 16 TYR CB C 13 39.183 0.085 . . . . . . A 16 TYR CB . 36171 1
157 . 1 1 16 16 TYR CD2 C 13 133.093 0.084 . . . . . . A 16 TYR CD2 . 36171 1
158 . 1 1 16 16 TYR CE2 C 13 117.925 0.037 . . . . . . A 16 TYR CE2 . 36171 1
159 . 1 1 16 16 TYR N N 15 120.167 0.038 . . . . . . A 16 TYR N . 36171 1
160 . 1 1 17 17 TYR H H 1 8.338 0.007 . . . . . . A 17 TYR H . 36171 1
161 . 1 1 17 17 TYR HA H 1 4.989 0.010 . . . . . . A 17 TYR HA . 36171 1
162 . 1 1 17 17 TYR HB2 H 1 2.507 0.011 . . . . . . A 17 TYR HB2 . 36171 1
163 . 1 1 17 17 TYR HB3 H 1 1.073 0.009 . . . . . . A 17 TYR HB3 . 36171 1
164 . 1 1 17 17 TYR HD1 H 1 6.679 0.010 . . . . . . A 17 TYR HD1 . 36171 1
165 . 1 1 17 17 TYR HD2 H 1 6.679 0.010 . . . . . . A 17 TYR HD2 . 36171 1
166 . 1 1 17 17 TYR HE1 H 1 6.451 0.001 . . . . . . A 17 TYR HE1 . 36171 1
167 . 1 1 17 17 TYR HE2 H 1 6.451 0.001 . . . . . . A 17 TYR HE2 . 36171 1
168 . 1 1 17 17 TYR C C 13 176.072 0.000 . . . . . . A 17 TYR C . 36171 1
169 . 1 1 17 17 TYR CA C 13 56.858 0.068 . . . . . . A 17 TYR CA . 36171 1
170 . 1 1 17 17 TYR CB C 13 43.288 0.016 . . . . . . A 17 TYR CB . 36171 1
171 . 1 1 17 17 TYR CD1 C 13 133.658 0.049 . . . . . . A 17 TYR CD1 . 36171 1
172 . 1 1 17 17 TYR N N 15 119.926 0.034 . . . . . . A 17 TYR N . 36171 1
173 . 1 1 18 18 SER H H 1 9.073 0.012 . . . . . . A 18 SER H . 36171 1
174 . 1 1 18 18 SER HA H 1 5.078 0.016 . . . . . . A 18 SER HA . 36171 1
175 . 1 1 18 18 SER HB2 H 1 4.333 0.015 . . . . . . A 18 SER HB2 . 36171 1
176 . 1 1 18 18 SER HB3 H 1 3.975 0.011 . . . . . . A 18 SER HB3 . 36171 1
177 . 1 1 18 18 SER C C 13 175.659 0.000 . . . . . . A 18 SER C . 36171 1
178 . 1 1 18 18 SER CA C 13 57.167 0.065 . . . . . . A 18 SER CA . 36171 1
179 . 1 1 18 18 SER CB C 13 65.149 0.103 . . . . . . A 18 SER CB . 36171 1
180 . 1 1 18 18 SER N N 15 117.667 0.046 . . . . . . A 18 SER N . 36171 1
181 . 1 1 19 19 ALA H H 1 8.900 0.012 . . . . . . A 19 ALA H . 36171 1
182 . 1 1 19 19 ALA HA H 1 4.013 0.005 . . . . . . A 19 ALA HA . 36171 1
183 . 1 1 19 19 ALA HB1 H 1 1.447 0.013 . . . . . . A 19 ALA HB1 . 36171 1
184 . 1 1 19 19 ALA HB2 H 1 1.447 0.013 . . . . . . A 19 ALA HB2 . 36171 1
185 . 1 1 19 19 ALA HB3 H 1 1.447 0.013 . . . . . . A 19 ALA HB3 . 36171 1
186 . 1 1 19 19 ALA C C 13 178.677 0.000 . . . . . . A 19 ALA C . 36171 1
187 . 1 1 19 19 ALA CA C 13 55.249 0.025 . . . . . . A 19 ALA CA . 36171 1
188 . 1 1 19 19 ALA CB C 13 18.193 0.018 . . . . . . A 19 ALA CB . 36171 1
189 . 1 1 19 19 ALA N N 15 121.740 0.073 . . . . . . A 19 ALA N . 36171 1
190 . 1 1 20 20 ASP H H 1 7.981 0.011 . . . . . . A 20 ASP H . 36171 1
191 . 1 1 20 20 ASP HA H 1 4.655 0.000 . . . . . . A 20 ASP HA . 36171 1
192 . 1 1 20 20 ASP HB2 H 1 3.018 0.000 . . . . . . A 20 ASP HB2 . 36171 1
193 . 1 1 20 20 ASP HB3 H 1 2.686 0.000 . . . . . . A 20 ASP HB3 . 36171 1
194 . 1 1 20 20 ASP C C 13 176.771 0.000 . . . . . . A 20 ASP C . 36171 1
195 . 1 1 20 20 ASP CA C 13 52.935 0.002 . . . . . . A 20 ASP CA . 36171 1
196 . 1 1 20 20 ASP CB C 13 39.740 0.074 . . . . . . A 20 ASP CB . 36171 1
197 . 1 1 20 20 ASP N N 15 113.983 0.053 . . . . . . A 20 ASP N . 36171 1
198 . 1 1 21 21 GLY H H 1 8.469 0.012 . . . . . . A 21 GLY H . 36171 1
199 . 1 1 21 21 GLY HA2 H 1 4.281 0.000 . . . . . . A 21 GLY HA2 . 36171 1
200 . 1 1 21 21 GLY C C 13 174.717 0.000 . . . . . . A 21 GLY C . 36171 1
201 . 1 1 21 21 GLY CA C 13 45.240 0.057 . . . . . . A 21 GLY CA . 36171 1
202 . 1 1 21 21 GLY N N 15 108.531 0.040 . . . . . . A 21 GLY N . 36171 1
203 . 1 1 22 22 THR H H 1 7.845 0.005 . . . . . . A 22 THR H . 36171 1
204 . 1 1 22 22 THR HA H 1 4.148 0.022 . . . . . . A 22 THR HA . 36171 1
205 . 1 1 22 22 THR HB H 1 4.189 0.011 . . . . . . A 22 THR HB . 36171 1
206 . 1 1 22 22 THR HG21 H 1 1.211 0.002 . . . . . . A 22 THR HG21 . 36171 1
207 . 1 1 22 22 THR HG22 H 1 1.211 0.002 . . . . . . A 22 THR HG22 . 36171 1
208 . 1 1 22 22 THR HG23 H 1 1.211 0.002 . . . . . . A 22 THR HG23 . 36171 1
209 . 1 1 22 22 THR C C 13 174.302 0.000 . . . . . . A 22 THR C . 36171 1
210 . 1 1 22 22 THR CA C 13 63.913 0.064 . . . . . . A 22 THR CA . 36171 1
211 . 1 1 22 22 THR CB C 13 68.502 0.048 . . . . . . A 22 THR CB . 36171 1
212 . 1 1 22 22 THR CG2 C 13 21.457 0.031 . . . . . . A 22 THR CG2 . 36171 1
213 . 1 1 22 22 THR N N 15 118.651 0.070 . . . . . . A 22 THR N . 36171 1
214 . 1 1 23 23 PHE H H 1 9.007 0.015 . . . . . . A 23 PHE H . 36171 1
215 . 1 1 23 23 PHE HA H 1 3.769 0.009 . . . . . . A 23 PHE HA . 36171 1
216 . 1 1 23 23 PHE HB2 H 1 2.806 0.009 . . . . . . A 23 PHE HB2 . 36171 1
217 . 1 1 23 23 PHE HD1 H 1 7.047 0.009 . . . . . . A 23 PHE HD1 . 36171 1
218 . 1 1 23 23 PHE HD2 H 1 7.047 0.009 . . . . . . A 23 PHE HD2 . 36171 1
219 . 1 1 23 23 PHE HE1 H 1 6.670 0.010 . . . . . . A 23 PHE HE1 . 36171 1
220 . 1 1 23 23 PHE HE2 H 1 6.670 0.010 . . . . . . A 23 PHE HE2 . 36171 1
221 . 1 1 23 23 PHE HZ H 1 6.735 0.002 . . . . . . A 23 PHE HZ . 36171 1
222 . 1 1 23 23 PHE C C 13 173.967 0.000 . . . . . . A 23 PHE C . 36171 1
223 . 1 1 23 23 PHE CA C 13 59.346 0.068 . . . . . . A 23 PHE CA . 36171 1
224 . 1 1 23 23 PHE CB C 13 38.906 0.068 . . . . . . A 23 PHE CB . 36171 1
225 . 1 1 23 23 PHE CD1 C 13 131.364 0.032 . . . . . . A 23 PHE CD1 . 36171 1
226 . 1 1 23 23 PHE CE1 C 13 131.135 0.023 . . . . . . A 23 PHE CE1 . 36171 1
227 . 1 1 23 23 PHE N N 15 128.388 0.029 . . . . . . A 23 PHE N . 36171 1
228 . 1 1 24 24 ILE H H 1 8.342 0.013 . . . . . . A 24 ILE H . 36171 1
229 . 1 1 24 24 ILE HA H 1 3.774 0.012 . . . . . . A 24 ILE HA . 36171 1
230 . 1 1 24 24 ILE HB H 1 1.219 0.015 . . . . . . A 24 ILE HB . 36171 1
231 . 1 1 24 24 ILE HG12 H 1 1.144 0.011 . . . . . . A 24 ILE HG12 . 36171 1
232 . 1 1 24 24 ILE HG13 H 1 1.113 0.002 . . . . . . A 24 ILE HG13 . 36171 1
233 . 1 1 24 24 ILE HG21 H 1 0.531 0.009 . . . . . . A 24 ILE HG21 . 36171 1
234 . 1 1 24 24 ILE HG22 H 1 0.531 0.009 . . . . . . A 24 ILE HG22 . 36171 1
235 . 1 1 24 24 ILE HG23 H 1 0.531 0.009 . . . . . . A 24 ILE HG23 . 36171 1
236 . 1 1 24 24 ILE HD11 H 1 0.438 0.001 . . . . . . A 24 ILE HD11 . 36171 1
237 . 1 1 24 24 ILE HD12 H 1 0.438 0.001 . . . . . . A 24 ILE HD12 . 36171 1
238 . 1 1 24 24 ILE HD13 H 1 0.438 0.001 . . . . . . A 24 ILE HD13 . 36171 1
239 . 1 1 24 24 ILE C C 13 175.628 0.000 . . . . . . A 24 ILE C . 36171 1
240 . 1 1 24 24 ILE CA C 13 61.093 0.078 . . . . . . A 24 ILE CA . 36171 1
241 . 1 1 24 24 ILE CB C 13 38.023 0.096 . . . . . . A 24 ILE CB . 36171 1
242 . 1 1 24 24 ILE CG1 C 13 26.433 0.034 . . . . . . A 24 ILE CG1 . 36171 1
243 . 1 1 24 24 ILE CG2 C 13 16.937 0.024 . . . . . . A 24 ILE CG2 . 36171 1
244 . 1 1 24 24 ILE CD1 C 13 11.493 0.071 . . . . . . A 24 ILE CD1 . 36171 1
245 . 1 1 24 24 ILE N N 15 128.712 0.032 . . . . . . A 24 ILE N . 36171 1
246 . 1 1 25 25 CYS H H 1 6.379 0.016 . . . . . . A 25 CYS H . 36171 1
247 . 1 1 25 25 CYS HA H 1 4.237 0.002 . . . . . . A 25 CYS HA . 36171 1
248 . 1 1 25 25 CYS HB2 H 1 3.664 0.003 . . . . . . A 25 CYS HB2 . 36171 1
249 . 1 1 25 25 CYS C C 13 172.088 0.000 . . . . . . A 25 CYS C . 36171 1
250 . 1 1 25 25 CYS CA C 13 55.124 0.091 . . . . . . A 25 CYS CA . 36171 1
251 . 1 1 25 25 CYS CB C 13 46.548 0.066 . . . . . . A 25 CYS CB . 36171 1
252 . 1 1 25 25 CYS N N 15 108.883 0.031 . . . . . . A 25 CYS N . 36171 1
253 . 1 1 26 26 GLU H H 1 8.737 0.014 . . . . . . A 26 GLU H . 36171 1
254 . 1 1 26 26 GLU HA H 1 5.217 0.791 . . . . . . A 26 GLU HA . 36171 1
255 . 1 1 26 26 GLU HB2 H 1 2.179 0.000 . . . . . . A 26 GLU HB2 . 36171 1
256 . 1 1 26 26 GLU HB3 H 1 1.997 0.000 . . . . . . A 26 GLU HB3 . 36171 1
257 . 1 1 26 26 GLU HG2 H 1 2.559 0.002 . . . . . . A 26 GLU HG2 . 36171 1
258 . 1 1 26 26 GLU HG3 H 1 3.070 0.000 . . . . . . A 26 GLU HG3 . 36171 1
259 . 1 1 26 26 GLU C C 13 176.592 0.000 . . . . . . A 26 GLU C . 36171 1
260 . 1 1 26 26 GLU CA C 13 54.405 0.105 . . . . . . A 26 GLU CA . 36171 1
261 . 1 1 26 26 GLU CB C 13 29.640 0.036 . . . . . . A 26 GLU CB . 36171 1
262 . 1 1 26 26 GLU CG C 13 35.045 0.055 . . . . . . A 26 GLU CG . 36171 1
263 . 1 1 26 26 GLU N N 15 122.472 0.044 . . . . . . A 26 GLU N . 36171 1
264 . 1 1 27 27 GLY H H 1 8.648 0.026 . . . . . . A 27 GLY H . 36171 1
265 . 1 1 27 27 GLY HA2 H 1 3.453 0.000 . . . . . . A 27 GLY HA2 . 36171 1
266 . 1 1 27 27 GLY HA3 H 1 4.113 0.000 . . . . . . A 27 GLY HA3 . 36171 1
267 . 1 1 27 27 GLY C C 13 174.011 0.000 . . . . . . A 27 GLY C . 36171 1
268 . 1 1 27 27 GLY CA C 13 45.912 0.019 . . . . . . A 27 GLY CA . 36171 1
269 . 1 1 27 27 GLY N N 15 110.943 0.034 . . . . . . A 27 GLY N . 36171 1
270 . 1 1 28 28 GLU H H 1 7.159 0.007 . . . . . . A 28 GLU H . 36171 1
271 . 1 1 28 28 GLU HA H 1 4.439 0.000 . . . . . . A 28 GLU HA . 36171 1
272 . 1 1 28 28 GLU HB2 H 1 2.152 0.017 . . . . . . A 28 GLU HB2 . 36171 1
273 . 1 1 28 28 GLU HB3 H 1 2.256 0.000 . . . . . . A 28 GLU HB3 . 36171 1
274 . 1 1 28 28 GLU HG2 H 1 2.367 0.013 . . . . . . A 28 GLU HG2 . 36171 1
275 . 1 1 28 28 GLU HG3 H 1 2.439 0.000 . . . . . . A 28 GLU HG3 . 36171 1
276 . 1 1 28 28 GLU C C 13 177.530 0.000 . . . . . . A 28 GLU C . 36171 1
277 . 1 1 28 28 GLU CA C 13 55.731 0.010 . . . . . . A 28 GLU CA . 36171 1
278 . 1 1 28 28 GLU CB C 13 30.695 0.030 . . . . . . A 28 GLU CB . 36171 1
279 . 1 1 28 28 GLU CG C 13 34.771 0.000 . . . . . . A 28 GLU CG . 36171 1
280 . 1 1 28 28 GLU N N 15 116.967 0.038 . . . . . . A 28 GLU N . 36171 1
281 . 1 1 29 29 SER H H 1 9.152 0.004 . . . . . . A 29 SER H . 36171 1
282 . 1 1 29 29 SER HA H 1 4.635 0.008 . . . . . . A 29 SER HA . 36171 1
283 . 1 1 29 29 SER HB2 H 1 3.438 0.002 . . . . . . A 29 SER HB2 . 36171 1
284 . 1 1 29 29 SER HB3 H 1 3.969 0.006 . . . . . . A 29 SER HB3 . 36171 1
285 . 1 1 29 29 SER C C 13 174.031 0.000 . . . . . . A 29 SER C . 36171 1
286 . 1 1 29 29 SER CA C 13 60.635 0.061 . . . . . . A 29 SER CA . 36171 1
287 . 1 1 29 29 SER CB C 13 64.357 0.049 . . . . . . A 29 SER CB . 36171 1
288 . 1 1 29 29 SER N N 15 116.821 0.022 . . . . . . A 29 SER N . 36171 1
289 . 1 1 30 30 ASP H H 1 9.322 0.007 . . . . . . A 30 ASP H . 36171 1
290 . 1 1 30 30 ASP HA H 1 4.811 0.004 . . . . . . A 30 ASP HA . 36171 1
291 . 1 1 30 30 ASP HB2 H 1 2.853 0.004 . . . . . . A 30 ASP HB2 . 36171 1
292 . 1 1 30 30 ASP HB3 H 1 2.579 0.005 . . . . . . A 30 ASP HB3 . 36171 1
293 . 1 1 30 30 ASP CA C 13 50.931 0.053 . . . . . . A 30 ASP CA . 36171 1
294 . 1 1 30 30 ASP CB C 13 42.426 0.058 . . . . . . A 30 ASP CB . 36171 1
295 . 1 1 30 30 ASP N N 15 129.362 0.044 . . . . . . A 30 ASP N . 36171 1
296 . 1 1 31 31 PRO HA H 1 4.234 0.003 . . . . . . A 31 PRO HA . 36171 1
297 . 1 1 31 31 PRO HB3 H 1 2.253 0.004 . . . . . . A 31 PRO HB3 . 36171 1
298 . 1 1 31 31 PRO HG2 H 1 1.905 0.000 . . . . . . A 31 PRO HG2 . 36171 1
299 . 1 1 31 31 PRO HD2 H 1 3.942 0.004 . . . . . . A 31 PRO HD2 . 36171 1
300 . 1 1 31 31 PRO C C 13 177.361 0.000 . . . . . . A 31 PRO C . 36171 1
301 . 1 1 31 31 PRO CA C 13 64.442 0.074 . . . . . . A 31 PRO CA . 36171 1
302 . 1 1 31 31 PRO CB C 13 32.192 0.056 . . . . . . A 31 PRO CB . 36171 1
303 . 1 1 31 31 PRO CG C 13 27.066 0.000 . . . . . . A 31 PRO CG . 36171 1
304 . 1 1 31 31 PRO CD C 13 51.045 0.055 . . . . . . A 31 PRO CD . 36171 1
305 . 1 1 32 32 ASN H H 1 8.339 0.010 . . . . . . A 32 ASN H . 36171 1
306 . 1 1 32 32 ASN HA H 1 4.630 0.008 . . . . . . A 32 ASN HA . 36171 1
307 . 1 1 32 32 ASN HB2 H 1 2.773 0.019 . . . . . . A 32 ASN HB2 . 36171 1
308 . 1 1 32 32 ASN HD21 H 1 7.799 0.004 . . . . . . A 32 ASN HD21 . 36171 1
309 . 1 1 32 32 ASN HD22 H 1 6.920 0.007 . . . . . . A 32 ASN HD22 . 36171 1
310 . 1 1 32 32 ASN C C 13 175.169 0.000 . . . . . . A 32 ASN C . 36171 1
311 . 1 1 32 32 ASN CA C 13 53.703 0.053 . . . . . . A 32 ASN CA . 36171 1
312 . 1 1 32 32 ASN CB C 13 39.143 0.055 . . . . . . A 32 ASN CB . 36171 1
313 . 1 1 32 32 ASN CG C 13 177.063 0.000 . . . . . . A 32 ASN CG . 36171 1
314 . 1 1 32 32 ASN N N 15 113.653 0.023 . . . . . . A 32 ASN N . 36171 1
315 . 1 1 32 32 ASN ND2 N 15 114.391 0.126 . . . . . . A 32 ASN ND2 . 36171 1
316 . 1 1 33 33 ASN H H 1 7.785 0.011 . . . . . . A 33 ASN H . 36171 1
317 . 1 1 33 33 ASN HA H 1 4.908 0.009 . . . . . . A 33 ASN HA . 36171 1
318 . 1 1 33 33 ASN HB2 H 1 2.636 0.002 . . . . . . A 33 ASN HB2 . 36171 1
319 . 1 1 33 33 ASN HD21 H 1 7.566 0.001 . . . . . . A 33 ASN HD21 . 36171 1
320 . 1 1 33 33 ASN HD22 H 1 6.753 0.005 . . . . . . A 33 ASN HD22 . 36171 1
321 . 1 1 33 33 ASN CA C 13 51.676 0.056 . . . . . . A 33 ASN CA . 36171 1
322 . 1 1 33 33 ASN CB C 13 39.350 0.063 . . . . . . A 33 ASN CB . 36171 1
323 . 1 1 33 33 ASN CG C 13 177.968 0.000 . . . . . . A 33 ASN CG . 36171 1
324 . 1 1 33 33 ASN N N 15 116.425 0.045 . . . . . . A 33 ASN N . 36171 1
325 . 1 1 33 33 ASN ND2 N 15 112.506 0.091 . . . . . . A 33 ASN ND2 . 36171 1
326 . 1 1 34 34 PRO HA H 1 4.299 0.003 . . . . . . A 34 PRO HA . 36171 1
327 . 1 1 34 34 PRO HB2 H 1 2.197 0.001 . . . . . . A 34 PRO HB2 . 36171 1
328 . 1 1 34 34 PRO HG2 H 1 1.929 0.000 . . . . . . A 34 PRO HG2 . 36171 1
329 . 1 1 34 34 PRO HD2 H 1 3.556 0.005 . . . . . . A 34 PRO HD2 . 36171 1
330 . 1 1 34 34 PRO HD3 H 1 3.379 0.001 . . . . . . A 34 PRO HD3 . 36171 1
331 . 1 1 34 34 PRO C C 13 176.789 0.000 . . . . . . A 34 PRO C . 36171 1
332 . 1 1 34 34 PRO CA C 13 63.964 0.042 . . . . . . A 34 PRO CA . 36171 1
333 . 1 1 34 34 PRO CB C 13 32.375 0.036 . . . . . . A 34 PRO CB . 36171 1
334 . 1 1 34 34 PRO CG C 13 27.344 0.000 . . . . . . A 34 PRO CG . 36171 1
335 . 1 1 34 34 PRO CD C 13 50.246 0.028 . . . . . . A 34 PRO CD . 36171 1
336 . 1 1 35 35 LYS H H 1 7.752 0.010 . . . . . . A 35 LYS H . 36171 1
337 . 1 1 35 35 LYS HA H 1 4.314 0.012 . . . . . . A 35 LYS HA . 36171 1
338 . 1 1 35 35 LYS HB2 H 1 1.710 0.008 . . . . . . A 35 LYS HB2 . 36171 1
339 . 1 1 35 35 LYS HG2 H 1 1.371 0.003 . . . . . . A 35 LYS HG2 . 36171 1
340 . 1 1 35 35 LYS HD2 H 1 1.597 0.000 . . . . . . A 35 LYS HD2 . 36171 1
341 . 1 1 35 35 LYS HE2 H 1 3.038 0.004 . . . . . . A 35 LYS HE2 . 36171 1
342 . 1 1 35 35 LYS C C 13 175.396 0.000 . . . . . . A 35 LYS C . 36171 1
343 . 1 1 35 35 LYS CA C 13 55.493 0.073 . . . . . . A 35 LYS CA . 36171 1
344 . 1 1 35 35 LYS CB C 13 34.326 0.073 . . . . . . A 35 LYS CB . 36171 1
345 . 1 1 35 35 LYS CG C 13 24.630 0.013 . . . . . . A 35 LYS CG . 36171 1
346 . 1 1 35 35 LYS CD C 13 30.198 0.000 . . . . . . A 35 LYS CD . 36171 1
347 . 1 1 35 35 LYS CE C 13 42.197 0.044 . . . . . . A 35 LYS CE . 36171 1
348 . 1 1 35 35 LYS N N 15 122.007 0.034 . . . . . . A 35 LYS N . 36171 1
349 . 1 1 36 36 ALA H H 1 8.256 0.008 . . . . . . A 36 ALA H . 36171 1
350 . 1 1 36 36 ALA HA H 1 4.324 0.004 . . . . . . A 36 ALA HA . 36171 1
351 . 1 1 36 36 ALA HB1 H 1 1.256 0.012 . . . . . . A 36 ALA HB1 . 36171 1
352 . 1 1 36 36 ALA HB2 H 1 1.256 0.012 . . . . . . A 36 ALA HB2 . 36171 1
353 . 1 1 36 36 ALA HB3 H 1 1.256 0.012 . . . . . . A 36 ALA HB3 . 36171 1
354 . 1 1 36 36 ALA C C 13 177.109 0.000 . . . . . . A 36 ALA C . 36171 1
355 . 1 1 36 36 ALA CA C 13 52.268 0.063 . . . . . . A 36 ALA CA . 36171 1
356 . 1 1 36 36 ALA CB C 13 17.920 0.082 . . . . . . A 36 ALA CB . 36171 1
357 . 1 1 36 36 ALA N N 15 125.235 0.086 . . . . . . A 36 ALA N . 36171 1
358 . 1 1 37 37 CYS H H 1 8.017 0.008 . . . . . . A 37 CYS H . 36171 1
359 . 1 1 37 37 CYS HA H 1 5.238 0.013 . . . . . . A 37 CYS HA . 36171 1
360 . 1 1 37 37 CYS HB2 H 1 3.079 0.011 . . . . . . A 37 CYS HB2 . 36171 1
361 . 1 1 37 37 CYS HB3 H 1 2.471 0.012 . . . . . . A 37 CYS HB3 . 36171 1
362 . 1 1 37 37 CYS CA C 13 51.560 0.030 . . . . . . A 37 CYS CA . 36171 1
363 . 1 1 37 37 CYS CB C 13 40.499 0.054 . . . . . . A 37 CYS CB . 36171 1
364 . 1 1 37 37 CYS N N 15 122.714 0.027 . . . . . . A 37 CYS N . 36171 1
365 . 1 1 38 38 PRO HA H 1 4.448 0.001 . . . . . . A 38 PRO HA . 36171 1
366 . 1 1 38 38 PRO HB2 H 1 2.321 0.003 . . . . . . A 38 PRO HB2 . 36171 1
367 . 1 1 38 38 PRO HG2 H 1 1.874 0.000 . . . . . . A 38 PRO HG2 . 36171 1
368 . 1 1 38 38 PRO HD2 H 1 3.450 0.001 . . . . . . A 38 PRO HD2 . 36171 1
369 . 1 1 38 38 PRO HD3 H 1 3.829 0.004 . . . . . . A 38 PRO HD3 . 36171 1
370 . 1 1 38 38 PRO C C 13 176.948 0.000 . . . . . . A 38 PRO C . 36171 1
371 . 1 1 38 38 PRO CA C 13 62.448 0.047 . . . . . . A 38 PRO CA . 36171 1
372 . 1 1 38 38 PRO CB C 13 32.213 0.049 . . . . . . A 38 PRO CB . 36171 1
373 . 1 1 38 38 PRO CG C 13 27.665 0.000 . . . . . . A 38 PRO CG . 36171 1
374 . 1 1 38 38 PRO CD C 13 50.601 0.052 . . . . . . A 38 PRO CD . 36171 1
375 . 1 1 39 39 ARG H H 1 8.605 0.009 . . . . . . A 39 ARG H . 36171 1
376 . 1 1 39 39 ARG HA H 1 4.218 0.006 . . . . . . A 39 ARG HA . 36171 1
377 . 1 1 39 39 ARG HB2 H 1 1.599 0.000 . . . . . . A 39 ARG HB2 . 36171 1
378 . 1 1 39 39 ARG HB3 H 1 1.859 0.007 . . . . . . A 39 ARG HB3 . 36171 1
379 . 1 1 39 39 ARG HG2 H 1 1.550 0.002 . . . . . . A 39 ARG HG2 . 36171 1
380 . 1 1 39 39 ARG HD2 H 1 3.112 0.005 . . . . . . A 39 ARG HD2 . 36171 1
381 . 1 1 39 39 ARG HE H 1 7.091 0.002 . . . . . . A 39 ARG HE . 36171 1
382 . 1 1 39 39 ARG C C 13 176.228 0.000 . . . . . . A 39 ARG C . 36171 1
383 . 1 1 39 39 ARG CA C 13 55.292 0.035 . . . . . . A 39 ARG CA . 36171 1
384 . 1 1 39 39 ARG CB C 13 29.868 0.023 . . . . . . A 39 ARG CB . 36171 1
385 . 1 1 39 39 ARG CG C 13 26.959 0.031 . . . . . . A 39 ARG CG . 36171 1
386 . 1 1 39 39 ARG CD C 13 42.949 0.078 . . . . . . A 39 ARG CD . 36171 1
387 . 1 1 39 39 ARG N N 15 120.374 0.025 . . . . . . A 39 ARG N . 36171 1
388 . 1 1 39 39 ARG NE N 15 120.680 0.037 . . . . . . A 39 ARG NE . 36171 1
389 . 1 1 40 40 ASN H H 1 7.655 0.008 . . . . . . A 40 ASN H . 36171 1
390 . 1 1 40 40 ASN HA H 1 4.401 0.010 . . . . . . A 40 ASN HA . 36171 1
391 . 1 1 40 40 ASN HB2 H 1 2.586 0.007 . . . . . . A 40 ASN HB2 . 36171 1
392 . 1 1 40 40 ASN HD21 H 1 6.765 0.005 . . . . . . A 40 ASN HD21 . 36171 1
393 . 1 1 40 40 ASN HD22 H 1 7.388 0.009 . . . . . . A 40 ASN HD22 . 36171 1
394 . 1 1 40 40 ASN C C 13 174.443 0.000 . . . . . . A 40 ASN C . 36171 1
395 . 1 1 40 40 ASN CA C 13 53.180 0.047 . . . . . . A 40 ASN CA . 36171 1
396 . 1 1 40 40 ASN CB C 13 38.442 0.027 . . . . . . A 40 ASN CB . 36171 1
397 . 1 1 40 40 ASN CG C 13 176.764 0.000 . . . . . . A 40 ASN CG . 36171 1
398 . 1 1 40 40 ASN N N 15 116.089 0.045 . . . . . . A 40 ASN N . 36171 1
399 . 1 1 40 40 ASN ND2 N 15 112.860 0.195 . . . . . . A 40 ASN ND2 . 36171 1
400 . 1 1 41 41 CYS H H 1 8.629 0.008 . . . . . . A 41 CYS H . 36171 1
401 . 1 1 41 41 CYS HA H 1 4.297 0.012 . . . . . . A 41 CYS HA . 36171 1
402 . 1 1 41 41 CYS HB2 H 1 3.450 0.000 . . . . . . A 41 CYS HB2 . 36171 1
403 . 1 1 41 41 CYS C C 13 174.445 0.000 . . . . . . A 41 CYS C . 36171 1
404 . 1 1 41 41 CYS CA C 13 52.978 0.041 . . . . . . A 41 CYS CA . 36171 1
405 . 1 1 41 41 CYS CB C 13 40.715 0.067 . . . . . . A 41 CYS CB . 36171 1
406 . 1 1 41 41 CYS N N 15 119.390 0.049 . . . . . . A 41 CYS N . 36171 1
407 . 1 1 42 42 ASP H H 1 9.034 0.010 . . . . . . A 42 ASP H . 36171 1
408 . 1 1 42 42 ASP HA H 1 4.847 0.024 . . . . . . A 42 ASP HA . 36171 1
409 . 1 1 42 42 ASP CA C 13 51.315 0.030 . . . . . . A 42 ASP CA . 36171 1
410 . 1 1 42 42 ASP CB C 13 41.414 0.000 . . . . . . A 42 ASP CB . 36171 1
411 . 1 1 42 42 ASP N N 15 126.298 0.051 . . . . . . A 42 ASP N . 36171 1
412 . 1 1 43 43 PRO HA H 1 4.396 0.003 . . . . . . A 43 PRO HA . 36171 1
413 . 1 1 43 43 PRO HB2 H 1 2.260 0.000 . . . . . . A 43 PRO HB2 . 36171 1
414 . 1 1 43 43 PRO HG2 H 1 1.972 0.003 . . . . . . A 43 PRO HG2 . 36171 1
415 . 1 1 43 43 PRO HD2 H 1 3.911 0.011 . . . . . . A 43 PRO HD2 . 36171 1
416 . 1 1 43 43 PRO C C 13 177.172 0.000 . . . . . . A 43 PRO C . 36171 1
417 . 1 1 43 43 PRO CA C 13 63.862 0.049 . . . . . . A 43 PRO CA . 36171 1
418 . 1 1 43 43 PRO CB C 13 32.014 0.000 . . . . . . A 43 PRO CB . 36171 1
419 . 1 1 43 43 PRO CG C 13 26.948 0.063 . . . . . . A 43 PRO CG . 36171 1
420 . 1 1 43 43 PRO CD C 13 51.025 0.063 . . . . . . A 43 PRO CD . 36171 1
421 . 1 1 44 44 ASN H H 1 8.715 0.005 . . . . . . A 44 ASN H . 36171 1
422 . 1 1 44 44 ASN HA H 1 4.537 0.017 . . . . . . A 44 ASN HA . 36171 1
423 . 1 1 44 44 ASN HB2 H 1 2.612 0.000 . . . . . . A 44 ASN HB2 . 36171 1
424 . 1 1 44 44 ASN HD21 H 1 8.033 0.005 . . . . . . A 44 ASN HD21 . 36171 1
425 . 1 1 44 44 ASN HD22 H 1 6.979 0.000 . . . . . . A 44 ASN HD22 . 36171 1
426 . 1 1 44 44 ASN C C 13 175.154 0.000 . . . . . . A 44 ASN C . 36171 1
427 . 1 1 44 44 ASN CA C 13 53.355 0.137 . . . . . . A 44 ASN CA . 36171 1
428 . 1 1 44 44 ASN CB C 13 39.248 0.000 . . . . . . A 44 ASN CB . 36171 1
429 . 1 1 44 44 ASN CG C 13 177.129 0.000 . . . . . . A 44 ASN CG . 36171 1
430 . 1 1 44 44 ASN N N 15 115.898 0.062 . . . . . . A 44 ASN N . 36171 1
431 . 1 1 44 44 ASN ND2 N 15 115.926 0.037 . . . . . . A 44 ASN ND2 . 36171 1
432 . 1 1 45 45 ILE H H 1 7.214 0.012 . . . . . . A 45 ILE H . 36171 1
433 . 1 1 45 45 ILE HA H 1 3.508 0.008 . . . . . . A 45 ILE HA . 36171 1
434 . 1 1 45 45 ILE HB H 1 1.649 0.005 . . . . . . A 45 ILE HB . 36171 1
435 . 1 1 45 45 ILE HG12 H 1 0.425 0.002 . . . . . . A 45 ILE HG12 . 36171 1
436 . 1 1 45 45 ILE HG13 H 1 1.403 0.005 . . . . . . A 45 ILE HG13 . 36171 1
437 . 1 1 45 45 ILE HG21 H 1 0.737 0.002 . . . . . . A 45 ILE HG21 . 36171 1
438 . 1 1 45 45 ILE HG22 H 1 0.737 0.002 . . . . . . A 45 ILE HG22 . 36171 1
439 . 1 1 45 45 ILE HG23 H 1 0.737 0.002 . . . . . . A 45 ILE HG23 . 36171 1
440 . 1 1 45 45 ILE HD11 H 1 0.426 0.003 . . . . . . A 45 ILE HD11 . 36171 1
441 . 1 1 45 45 ILE HD12 H 1 0.426 0.003 . . . . . . A 45 ILE HD12 . 36171 1
442 . 1 1 45 45 ILE HD13 H 1 0.426 0.003 . . . . . . A 45 ILE HD13 . 36171 1
443 . 1 1 45 45 ILE C C 13 173.930 0.000 . . . . . . A 45 ILE C . 36171 1
444 . 1 1 45 45 ILE CA C 13 62.951 0.043 . . . . . . A 45 ILE CA . 36171 1
445 . 1 1 45 45 ILE CB C 13 38.888 0.036 . . . . . . A 45 ILE CB . 36171 1
446 . 1 1 45 45 ILE CG1 C 13 28.539 0.046 . . . . . . A 45 ILE CG1 . 36171 1
447 . 1 1 45 45 ILE CG2 C 13 18.522 0.077 . . . . . . A 45 ILE CG2 . 36171 1
448 . 1 1 45 45 ILE CD1 C 13 13.399 0.060 . . . . . . A 45 ILE CD1 . 36171 1
449 . 1 1 45 45 ILE N N 15 117.732 0.087 . . . . . . A 45 ILE N . 36171 1
450 . 1 1 46 46 ALA H H 1 9.438 0.015 . . . . . . A 46 ALA H . 36171 1
451 . 1 1 46 46 ALA HA H 1 4.741 0.012 . . . . . . A 46 ALA HA . 36171 1
452 . 1 1 46 46 ALA HB1 H 1 1.500 0.006 . . . . . . A 46 ALA HB1 . 36171 1
453 . 1 1 46 46 ALA HB2 H 1 1.500 0.006 . . . . . . A 46 ALA HB2 . 36171 1
454 . 1 1 46 46 ALA HB3 H 1 1.500 0.006 . . . . . . A 46 ALA HB3 . 36171 1
455 . 1 1 46 46 ALA C C 13 177.057 0.000 . . . . . . A 46 ALA C . 36171 1
456 . 1 1 46 46 ALA CA C 13 52.573 0.024 . . . . . . A 46 ALA CA . 36171 1
457 . 1 1 46 46 ALA CB C 13 22.005 0.042 . . . . . . A 46 ALA CB . 36171 1
458 . 1 1 46 46 ALA N N 15 129.869 0.030 . . . . . . A 46 ALA N . 36171 1
459 . 1 1 47 47 TYR H H 1 7.947 0.018 . . . . . . A 47 TYR H . 36171 1
460 . 1 1 47 47 TYR HA H 1 4.932 0.012 . . . . . . A 47 TYR HA . 36171 1
461 . 1 1 47 47 TYR HB3 H 1 3.121 0.006 . . . . . . A 47 TYR HB3 . 36171 1
462 . 1 1 47 47 TYR HD1 H 1 6.770 0.012 . . . . . . A 47 TYR HD1 . 36171 1
463 . 1 1 47 47 TYR HD2 H 1 6.770 0.012 . . . . . . A 47 TYR HD2 . 36171 1
464 . 1 1 47 47 TYR HE1 H 1 6.450 0.002 . . . . . . A 47 TYR HE1 . 36171 1
465 . 1 1 47 47 TYR HE2 H 1 6.450 0.002 . . . . . . A 47 TYR HE2 . 36171 1
466 . 1 1 47 47 TYR C C 13 171.709 0.000 . . . . . . A 47 TYR C . 36171 1
467 . 1 1 47 47 TYR CA C 13 56.895 0.033 . . . . . . A 47 TYR CA . 36171 1
468 . 1 1 47 47 TYR CB C 13 39.540 0.047 . . . . . . A 47 TYR CB . 36171 1
469 . 1 1 47 47 TYR CD1 C 13 133.255 0.042 . . . . . . A 47 TYR CD1 . 36171 1
470 . 1 1 47 47 TYR N N 15 112.700 0.087 . . . . . . A 47 TYR N . 36171 1
471 . 1 1 48 48 SER H H 1 8.605 0.008 . . . . . . A 48 SER H . 36171 1
472 . 1 1 48 48 SER HA H 1 5.512 0.007 . . . . . . A 48 SER HA . 36171 1
473 . 1 1 48 48 SER HB2 H 1 3.278 0.013 . . . . . . A 48 SER HB2 . 36171 1
474 . 1 1 48 48 SER HB3 H 1 3.411 0.002 . . . . . . A 48 SER HB3 . 36171 1
475 . 1 1 48 48 SER C C 13 173.703 0.000 . . . . . . A 48 SER C . 36171 1
476 . 1 1 48 48 SER CA C 13 54.787 0.037 . . . . . . A 48 SER CA . 36171 1
477 . 1 1 48 48 SER CB C 13 67.880 0.054 . . . . . . A 48 SER CB . 36171 1
478 . 1 1 48 48 SER N N 15 113.131 0.030 . . . . . . A 48 SER N . 36171 1
479 . 1 1 49 49 LEU H H 1 8.814 0.012 . . . . . . A 49 LEU H . 36171 1
480 . 1 1 49 49 LEU HA H 1 4.743 0.008 . . . . . . A 49 LEU HA . 36171 1
481 . 1 1 49 49 LEU HB2 H 1 1.714 0.004 . . . . . . A 49 LEU HB2 . 36171 1
482 . 1 1 49 49 LEU HG H 1 1.855 0.002 . . . . . . A 49 LEU HG . 36171 1
483 . 1 1 49 49 LEU HD11 H 1 0.985 0.001 . . . . . . A 49 LEU HD11 . 36171 1
484 . 1 1 49 49 LEU HD12 H 1 0.985 0.001 . . . . . . A 49 LEU HD12 . 36171 1
485 . 1 1 49 49 LEU HD13 H 1 0.985 0.001 . . . . . . A 49 LEU HD13 . 36171 1
486 . 1 1 49 49 LEU HD21 H 1 0.836 0.003 . . . . . . A 49 LEU HD21 . 36171 1
487 . 1 1 49 49 LEU HD22 H 1 0.836 0.003 . . . . . . A 49 LEU HD22 . 36171 1
488 . 1 1 49 49 LEU HD23 H 1 0.836 0.003 . . . . . . A 49 LEU HD23 . 36171 1
489 . 1 1 49 49 LEU C C 13 176.250 0.000 . . . . . . A 49 LEU C . 36171 1
490 . 1 1 49 49 LEU CA C 13 55.296 0.054 . . . . . . A 49 LEU CA . 36171 1
491 . 1 1 49 49 LEU CB C 13 44.834 0.030 . . . . . . A 49 LEU CB . 36171 1
492 . 1 1 49 49 LEU CG C 13 26.990 0.000 . . . . . . A 49 LEU CG . 36171 1
493 . 1 1 49 49 LEU CD1 C 13 23.526 0.038 . . . . . . A 49 LEU CD1 . 36171 1
494 . 1 1 49 49 LEU CD2 C 13 25.250 0.007 . . . . . . A 49 LEU CD2 . 36171 1
495 . 1 1 49 49 LEU N N 15 121.697 0.061 . . . . . . A 49 LEU N . 36171 1
496 . 1 1 50 50 CYS H H 1 8.557 0.018 . . . . . . A 50 CYS H . 36171 1
497 . 1 1 50 50 CYS HA H 1 4.982 0.000 . . . . . . A 50 CYS HA . 36171 1
498 . 1 1 50 50 CYS HB2 H 1 3.168 0.013 . . . . . . A 50 CYS HB2 . 36171 1
499 . 1 1 50 50 CYS HB3 H 1 3.019 0.002 . . . . . . A 50 CYS HB3 . 36171 1
500 . 1 1 50 50 CYS CA C 13 56.462 0.000 . . . . . . A 50 CYS CA . 36171 1
501 . 1 1 50 50 CYS CB C 13 46.976 0.044 . . . . . . A 50 CYS CB . 36171 1
502 . 1 1 50 50 CYS N N 15 128.821 0.100 . . . . . . A 50 CYS N . 36171 1
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