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 36107
_Assigned_chem_shift_list.ID 1
_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-1H TOCSY' 1 $sample_1 isotropic 36107 1
2 '2D 1H-1H NOESY' 1 $sample_1 isotropic 36107 1
3 '2D 1H-15N HSQC' 1 $sample_1 isotropic 36107 1
4 '2D 1H-13C HSQC' 1 $sample_1 isotropic 36107 1
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 1 1 ALA HA H 1 4.232 0.001 . 1 . . 117 . A 1 ALA HA . 36107 1
2 . 1 . 1 1 1 ALA HB1 H 1 1.534 0.001 . 1 . . 161 . A 1 ALA HB1 . 36107 1
3 . 1 . 1 1 1 ALA HB2 H 1 1.534 0.001 . 1 . . 161 . A 1 ALA HB2 . 36107 1
4 . 1 . 1 1 1 ALA HB3 H 1 1.534 0.001 . 1 . . 161 . A 1 ALA HB3 . 36107 1
5 . 1 . 1 1 1 ALA CA C 13 51.933 . . 1 . . 111 . A 1 ALA CA . 36107 1
6 . 1 . 1 1 1 ALA CB C 13 19.731 . . 1 . . 183 . A 1 ALA CB . 36107 1
7 . 1 . 1 2 2 PHE H H 1 8.740 0.002 . 1 . . 26 . A 2 PHE H . 36107 1
8 . 1 . 1 2 2 PHE HA H 1 4.875 . . 1 . . 73 . A 2 PHE HA . 36107 1
9 . 1 . 1 2 2 PHE HB2 H 1 3.186 0.002 . 2 . . 173 . A 2 PHE HB2 . 36107 1
10 . 1 . 1 2 2 PHE HB3 H 1 3.186 0.002 . 2 . . 172 . A 2 PHE HB3 . 36107 1
11 . 1 . 1 2 2 PHE HD1 H 1 7.314 0.002 . 3 . . 195 . A 2 PHE HD1 . 36107 1
12 . 1 . 1 2 2 PHE HD2 H 1 7.314 0.002 . 3 . . 195 . A 2 PHE HD2 . 36107 1
13 . 1 . 1 2 2 PHE HE1 H 1 7.223 0.007 . 3 . . 196 . A 2 PHE HE1 . 36107 1
14 . 1 . 1 2 2 PHE HE2 H 1 7.223 0.007 . 3 . . 196 . A 2 PHE HE2 . 36107 1
15 . 1 . 1 2 2 PHE HZ H 1 7.216 0.0 . 1 . . 206 . A 2 PHE HZ . 36107 1
16 . 1 . 1 2 2 PHE CB C 13 40.686 . . 1 . . 208 . A 2 PHE CB . 36107 1
17 . 1 . 1 2 2 PHE CD1 C 13 132.194 . . 3 . . 204 . A 2 PHE CD1 . 36107 1
18 . 1 . 1 2 2 PHE CD2 C 13 132.194 . . 3 . . 204 . A 2 PHE CD2 . 36107 1
19 . 1 . 1 2 2 PHE CE1 C 13 131.601 . . 3 . . 205 . A 2 PHE CE1 . 36107 1
20 . 1 . 1 2 2 PHE CE2 C 13 131.601 . . 3 . . 205 . A 2 PHE CE2 . 36107 1
21 . 1 . 1 2 2 PHE CZ C 13 129.899 . . 1 . . 207 . A 2 PHE CZ . 36107 1
22 . 1 . 1 2 2 PHE N N 15 122.108 . . 1 . . 27 . A 2 PHE N . 36107 1
23 . 1 . 1 3 3 CYS H H 1 8.015 0.002 . 1 . . 8 . A 3 CYS H . 36107 1
24 . 1 . 1 3 3 CYS HA H 1 5.594 0.004 . 1 . . 64 . A 3 CYS HA . 36107 1
25 . 1 . 1 3 3 CYS HB2 H 1 2.549 0.003 . 2 . . 163 . A 3 CYS HB2 . 36107 1
26 . 1 . 1 3 3 CYS HB3 H 1 2.856 0.006 . 2 . . 162 . A 3 CYS HB3 . 36107 1
27 . 1 . 1 3 3 CYS CA C 13 55.462 . . 1 . . 120 . A 3 CYS CA . 36107 1
28 . 1 . 1 3 3 CYS CB C 13 48.727 0.006 . 1 . . 187 . A 3 CYS CB . 36107 1
29 . 1 . 1 3 3 CYS N N 15 121.318 . . 1 . . 9 . A 3 CYS N . 36107 1
30 . 1 . 1 4 4 TRP H H 1 9.241 0.001 . 1 . . 37 . A 4 TRP H . 36107 1
31 . 1 . 1 4 4 TRP HB2 H 1 3.219 0.001 . 2 . . 100 . A 4 TRP HB2 . 36107 1
32 . 1 . 1 4 4 TRP HB3 H 1 3.222 0.009 . 2 . . 192 . A 4 TRP HB3 . 36107 1
33 . 1 . 1 4 4 TRP HD1 H 1 6.967 0.002 . 1 . . 81 . A 4 TRP HD1 . 36107 1
34 . 1 . 1 4 4 TRP HE1 H 1 10.002 0.002 . 1 . . 30 . A 4 TRP HE1 . 36107 1
35 . 1 . 1 4 4 TRP HE3 H 1 7.115 0.003 . 1 . . 178 . A 4 TRP HE3 . 36107 1
36 . 1 . 1 4 4 TRP HZ2 H 1 7.278 0.002 . 1 . . 101 . A 4 TRP HZ2 . 36107 1
37 . 1 . 1 4 4 TRP HZ3 H 1 6.915 0.004 . 1 . . 177 . A 4 TRP HZ3 . 36107 1
38 . 1 . 1 4 4 TRP HH2 H 1 7.010 0.003 . 1 . . 176 . A 4 TRP HH2 . 36107 1
39 . 1 . 1 4 4 TRP CB C 13 31.886 . . 1 . . 191 . A 4 TRP CB . 36107 1
40 . 1 . 1 4 4 TRP CD1 C 13 127.612 . . 1 . . 203 . A 4 TRP CD1 . 36107 1
41 . 1 . 1 4 4 TRP CE3 C 13 122.973 . . 1 . . 200 . A 4 TRP CE3 . 36107 1
42 . 1 . 1 4 4 TRP CZ2 C 13 113.948 . . 1 . . 197 . A 4 TRP CZ2 . 36107 1
43 . 1 . 1 4 4 TRP CZ3 C 13 121.826 . . 1 . . 199 . A 4 TRP CZ3 . 36107 1
44 . 1 . 1 4 4 TRP CH2 C 13 123.865 . . 1 . . 201 . A 4 TRP CH2 . 36107 1
45 . 1 . 1 4 4 TRP N N 15 122.069 . . 1 . . 38 . A 4 TRP N . 36107 1
46 . 1 . 1 4 4 TRP NE1 N 15 128.961 . . 1 . . 31 . A 4 TRP NE1 . 36107 1
47 . 1 . 1 5 5 ASN H H 1 8.667 0.003 . 1 . . 60 . A 5 ASN H . 36107 1
48 . 1 . 1 5 5 ASN HA H 1 5.175 0.001 . 1 . . 78 . A 5 ASN HA . 36107 1
49 . 1 . 1 5 5 ASN HB2 H 1 2.693 0.004 . 2 . . 166 . A 5 ASN HB2 . 36107 1
50 . 1 . 1 5 5 ASN HB3 H 1 2.442 0.005 . 2 . . 167 . A 5 ASN HB3 . 36107 1
51 . 1 . 1 5 5 ASN HD21 H 1 7.492 0.0 . 1 . . 47 . A 5 ASN HD21 . 36107 1
52 . 1 . 1 5 5 ASN HD22 H 1 6.745 0.001 . 1 . . 14 . A 5 ASN HD22 . 36107 1
53 . 1 . 1 5 5 ASN CA C 13 52.257 . . 1 . . 108 . A 5 ASN CA . 36107 1
54 . 1 . 1 5 5 ASN CB C 13 40.455 0.023 . 1 . . 185 . A 5 ASN CB . 36107 1
55 . 1 . 1 5 5 ASN N N 15 117.902 . . 1 . . 61 . A 5 ASN N . 36107 1
56 . 1 . 1 5 5 ASN ND2 N 15 112.683 0.001 . 1 . . 15 . A 5 ASN ND2 . 36107 1
57 . 1 . 1 6 6 VAL H H 1 8.802 0.004 . 1 . . 6 . A 6 VAL H . 36107 1
58 . 1 . 1 6 6 VAL HA H 1 4.293 0.002 . 1 . . 75 . A 6 VAL HA . 36107 1
59 . 1 . 1 6 6 VAL HB H 1 1.708 0.004 . 1 . . 85 . A 6 VAL HB . 36107 1
60 . 1 . 1 6 6 VAL HG11 H 1 0.907 0.006 . 2 . . 86 . A 6 VAL HG11 . 36107 1
61 . 1 . 1 6 6 VAL HG12 H 1 0.907 0.006 . 2 . . 86 . A 6 VAL HG12 . 36107 1
62 . 1 . 1 6 6 VAL HG13 H 1 0.907 0.006 . 2 . . 86 . A 6 VAL HG13 . 36107 1
63 . 1 . 1 6 6 VAL HG21 H 1 0.908 0.006 . 2 . . 159 . A 6 VAL HG21 . 36107 1
64 . 1 . 1 6 6 VAL HG22 H 1 0.908 0.006 . 2 . . 159 . A 6 VAL HG22 . 36107 1
65 . 1 . 1 6 6 VAL HG23 H 1 0.908 0.006 . 2 . . 159 . A 6 VAL HG23 . 36107 1
66 . 1 . 1 6 6 VAL CA C 13 61.926 . . 1 . . 122 . A 6 VAL CA . 36107 1
67 . 1 . 1 6 6 VAL CB C 13 33.243 0.029 . 1 . . 155 . A 6 VAL CB . 36107 1
68 . 1 . 1 6 6 VAL N N 15 124.605 . . 1 . . 7 . A 6 VAL N . 36107 1
69 . 1 . 1 7 7 CYS H H 1 8.941 0.001 . 1 . . 52 . A 7 CYS H . 36107 1
70 . 1 . 1 7 7 CYS HA H 1 5.621 0.003 . 1 . . 68 . A 7 CYS HA . 36107 1
71 . 1 . 1 7 7 CYS HB2 H 1 2.990 0.001 . 2 . . 103 . A 7 CYS HB2 . 36107 1
72 . 1 . 1 7 7 CYS HB3 H 1 2.382 0.001 . 2 . . 102 . A 7 CYS HB3 . 36107 1
73 . 1 . 1 7 7 CYS CA C 13 55.345 . . 1 . . 121 . A 7 CYS CA . 36107 1
74 . 1 . 1 7 7 CYS CB C 13 48.020 0.011 . 1 . . 189 . A 7 CYS CB . 36107 1
75 . 1 . 1 7 7 CYS N N 15 125.845 . . 1 . . 53 . A 7 CYS N . 36107 1
76 . 1 . 1 8 8 VAL H H 1 8.791 0.002 . 1 . . 48 . A 8 VAL H . 36107 1
77 . 1 . 1 8 8 VAL HA H 1 4.542 0.001 . 1 . . 76 . A 8 VAL HA . 36107 1
78 . 1 . 1 8 8 VAL HB H 1 2.170 0.002 . 1 . . 82 . A 8 VAL HB . 36107 1
79 . 1 . 1 8 8 VAL HG11 H 1 0.824 0.004 . 2 . . 91 . A 8 VAL HG11 . 36107 1
80 . 1 . 1 8 8 VAL HG12 H 1 0.824 0.004 . 2 . . 91 . A 8 VAL HG12 . 36107 1
81 . 1 . 1 8 8 VAL HG13 H 1 0.824 0.004 . 2 . . 91 . A 8 VAL HG13 . 36107 1
82 . 1 . 1 8 8 VAL HG21 H 1 0.914 0.005 . 2 . . 92 . A 8 VAL HG21 . 36107 1
83 . 1 . 1 8 8 VAL HG22 H 1 0.914 0.005 . 2 . . 92 . A 8 VAL HG22 . 36107 1
84 . 1 . 1 8 8 VAL HG23 H 1 0.914 0.005 . 2 . . 92 . A 8 VAL HG23 . 36107 1
85 . 1 . 1 8 8 VAL CA C 13 59.610 . . 1 . . 110 . A 8 VAL CA . 36107 1
86 . 1 . 1 8 8 VAL CB C 13 35.612 0.019 . 1 . . 157 . A 8 VAL CB . 36107 1
87 . 1 . 1 8 8 VAL N N 15 119.227 . . 1 . . 49 . A 8 VAL N . 36107 1
88 . 1 . 1 9 9 TYR H H 1 8.691 0.004 . 1 . . 45 . A 9 TYR H . 36107 1
89 . 1 . 1 9 9 TYR HA H 1 5.085 0.005 . 1 . . 72 . A 9 TYR HA . 36107 1
90 . 1 . 1 9 9 TYR HB2 H 1 2.787 0.004 . 2 . . 175 . A 9 TYR HB2 . 36107 1
91 . 1 . 1 9 9 TYR HB3 H 1 2.740 0.016 . 2 . . 174 . A 9 TYR HB3 . 36107 1
92 . 1 . 1 9 9 TYR HD1 H 1 6.870 0.003 . 3 . . 193 . A 9 TYR HD1 . 36107 1
93 . 1 . 1 9 9 TYR HD2 H 1 6.870 0.003 . 3 . . 193 . A 9 TYR HD2 . 36107 1
94 . 1 . 1 9 9 TYR HE1 H 1 6.733 0.002 . 3 . . 194 . A 9 TYR HE1 . 36107 1
95 . 1 . 1 9 9 TYR HE2 H 1 6.733 0.002 . 3 . . 194 . A 9 TYR HE2 . 36107 1
96 . 1 . 1 9 9 TYR CA C 13 57.879 . . 1 . . 119 . A 9 TYR CA . 36107 1
97 . 1 . 1 9 9 TYR CD1 C 13 132.785 . . 3 . . 202 . A 9 TYR CD1 . 36107 1
98 . 1 . 1 9 9 TYR CD2 C 13 132.785 . . 3 . . 202 . A 9 TYR CD2 . 36107 1
99 . 1 . 1 9 9 TYR CE1 C 13 118.026 . . 3 . . 198 . A 9 TYR CE1 . 36107 1
100 . 1 . 1 9 9 TYR CE2 C 13 118.026 . . 3 . . 198 . A 9 TYR CE2 . 36107 1
101 . 1 . 1 9 9 TYR N N 15 121.223 . . 1 . . 46 . A 9 TYR N . 36107 1
102 . 1 . 1 10 10 ARG H H 1 8.947 0.002 . 1 . . 33 . A 10 ARG H . 36107 1
103 . 1 . 1 10 10 ARG HA H 1 4.529 0.001 . 1 . . 67 . A 10 ARG HA . 36107 1
104 . 1 . 1 10 10 ARG HB2 H 1 1.737 0.004 . 2 . . 141 . A 10 ARG HB2 . 36107 1
105 . 1 . 1 10 10 ARG HB3 H 1 1.623 0.011 . 2 . . 143 . A 10 ARG HB3 . 36107 1
106 . 1 . 1 10 10 ARG HG2 H 1 1.607 0.009 . 2 . . 147 . A 10 ARG HG2 . 36107 1
107 . 1 . 1 10 10 ARG HG3 H 1 1.474 0.003 . 2 . . 145 . A 10 ARG HG3 . 36107 1
108 . 1 . 1 10 10 ARG HD2 H 1 3.183 0.007 . 2 . . 144 . A 10 ARG HD2 . 36107 1
109 . 1 . 1 10 10 ARG HD3 H 1 3.183 0.006 . 2 . . 95 . A 10 ARG HD3 . 36107 1
110 . 1 . 1 10 10 ARG HE H 1 7.201 0.004 . 1 . . 99 . A 10 ARG HE . 36107 1
111 . 1 . 1 10 10 ARG CA C 13 54.970 . . 1 . . 109 . A 10 ARG CA . 36107 1
112 . 1 . 1 10 10 ARG CB C 13 31.951 0.003 . 1 . . 142 . A 10 ARG CB . 36107 1
113 . 1 . 1 10 10 ARG CG C 13 26.996 0.015 . 1 . . 146 . A 10 ARG CG . 36107 1
114 . 1 . 1 10 10 ARG CD C 13 43.395 . . 1 . . 123 . A 10 ARG CD . 36107 1
115 . 1 . 1 10 10 ARG N N 15 124.686 . . 1 . . 34 . A 10 ARG N . 36107 1
116 . 1 . 1 11 11 ASN H H 1 9.514 0.001 . 1 . . 58 . A 11 ASN H . 36107 1
117 . 1 . 1 11 11 ASN HA H 1 4.273 0.003 . 1 . . 62 . A 11 ASN HA . 36107 1
118 . 1 . 1 11 11 ASN HB2 H 1 2.832 0.006 . 2 . . 165 . A 11 ASN HB2 . 36107 1
119 . 1 . 1 11 11 ASN HB3 H 1 3.006 0.009 . 2 . . 164 . A 11 ASN HB3 . 36107 1
120 . 1 . 1 11 11 ASN HD21 H 1 7.602 0.002 . 1 . . 20 . A 11 ASN HD21 . 36107 1
121 . 1 . 1 11 11 ASN HD22 H 1 6.915 0.005 . 1 . . 51 . A 11 ASN HD22 . 36107 1
122 . 1 . 1 11 11 ASN CA C 13 55.106 . . 1 . . 116 . A 11 ASN CA . 36107 1
123 . 1 . 1 11 11 ASN CB C 13 37.336 0.007 . 1 . . 184 . A 11 ASN CB . 36107 1
124 . 1 . 1 11 11 ASN N N 15 126.096 . . 1 . . 59 . A 11 ASN N . 36107 1
125 . 1 . 1 11 11 ASN ND2 N 15 112.941 0.0 . 1 . . 21 . A 11 ASN ND2 . 36107 1
126 . 1 . 1 12 12 ALA H H 1 8.509 0.001 . 1 . . 10 . A 12 ALA H . 36107 1
127 . 1 . 1 12 12 ALA HA H 1 3.963 0.001 . 1 . . 71 . A 12 ALA HA . 36107 1
128 . 1 . 1 12 12 ALA HB1 H 1 1.534 0.001 . 1 . . 160 . A 12 ALA HB1 . 36107 1
129 . 1 . 1 12 12 ALA HB2 H 1 1.534 0.001 . 1 . . 160 . A 12 ALA HB2 . 36107 1
130 . 1 . 1 12 12 ALA HB3 H 1 1.534 0.001 . 1 . . 160 . A 12 ALA HB3 . 36107 1
131 . 1 . 1 12 12 ALA CA C 13 53.721 . . 1 . . 113 . A 12 ALA CA . 36107 1
132 . 1 . 1 12 12 ALA CB C 13 17.906 . . 1 . . 182 . A 12 ALA CB . 36107 1
133 . 1 . 1 12 12 ALA N N 15 114.363 . . 1 . . 11 . A 12 ALA N . 36107 1
134 . 1 . 1 13 13 VAL H H 1 7.778 0.002 . 1 . . 18 . A 13 VAL H . 36107 1
135 . 1 . 1 13 13 VAL HA H 1 4.278 0.006 . 1 . . 63 . A 13 VAL HA . 36107 1
136 . 1 . 1 13 13 VAL HB H 1 2.099 0.002 . 1 . . 84 . A 13 VAL HB . 36107 1
137 . 1 . 1 13 13 VAL HG11 H 1 0.905 0.005 . 2 . . 89 . A 13 VAL HG11 . 36107 1
138 . 1 . 1 13 13 VAL HG12 H 1 0.905 0.005 . 2 . . 89 . A 13 VAL HG12 . 36107 1
139 . 1 . 1 13 13 VAL HG13 H 1 0.905 0.005 . 2 . . 89 . A 13 VAL HG13 . 36107 1
140 . 1 . 1 13 13 VAL HG21 H 1 0.958 0.002 . 2 . . 90 . A 13 VAL HG21 . 36107 1
141 . 1 . 1 13 13 VAL HG22 H 1 0.958 0.002 . 2 . . 90 . A 13 VAL HG22 . 36107 1
142 . 1 . 1 13 13 VAL HG23 H 1 0.958 0.002 . 2 . . 90 . A 13 VAL HG23 . 36107 1
143 . 1 . 1 13 13 VAL CA C 13 61.717 . . 1 . . 118 . A 13 VAL CA . 36107 1
144 . 1 . 1 13 13 VAL CB C 13 34.328 0.007 . 1 . . 158 . A 13 VAL CB . 36107 1
145 . 1 . 1 13 13 VAL N N 15 120.156 . . 1 . . 19 . A 13 VAL N . 36107 1
146 . 1 . 1 14 14 ARG H H 1 8.589 0.001 . 1 . . 39 . A 14 ARG H . 36107 1
147 . 1 . 1 14 14 ARG HA H 1 4.095 0.002 . 1 . . 70 . A 14 ARG HA . 36107 1
148 . 1 . 1 14 14 ARG HB2 H 1 1.663 0.003 . 2 . . 127 . A 14 ARG HB2 . 36107 1
149 . 1 . 1 14 14 ARG HB3 H 1 1.292 0.004 . 2 . . 129 . A 14 ARG HB3 . 36107 1
150 . 1 . 1 14 14 ARG HG2 H 1 1.202 0.004 . 2 . . 132 . A 14 ARG HG2 . 36107 1
151 . 1 . 1 14 14 ARG HG3 H 1 0.883 0.006 . 2 . . 130 . A 14 ARG HG3 . 36107 1
152 . 1 . 1 14 14 ARG HD2 H 1 3.017 0.003 . 2 . . 133 . A 14 ARG HD2 . 36107 1
153 . 1 . 1 14 14 ARG HD3 H 1 3.017 0.003 . 2 . . 94 . A 14 ARG HD3 . 36107 1
154 . 1 . 1 14 14 ARG HE H 1 7.051 0.001 . 1 . . 93 . A 14 ARG HE . 36107 1
155 . 1 . 1 14 14 ARG CA C 13 55.923 . . 1 . . 114 . A 14 ARG CA . 36107 1
156 . 1 . 1 14 14 ARG CB C 13 30.944 0.013 . 1 . . 128 . A 14 ARG CB . 36107 1
157 . 1 . 1 14 14 ARG CG C 13 28.071 0.001 . 1 . . 131 . A 14 ARG CG . 36107 1
158 . 1 . 1 14 14 ARG CD C 13 43.669 . . 1 . . 126 . A 14 ARG CD . 36107 1
159 . 1 . 1 14 14 ARG N N 15 127.680 . . 1 . . 40 . A 14 ARG N . 36107 1
160 . 1 . 1 15 15 VAL H H 1 9.077 0.002 . 1 . . 54 . A 15 VAL H . 36107 1
161 . 1 . 1 15 15 VAL HA H 1 4.232 0.001 . 1 . . 66 . A 15 VAL HA . 36107 1
162 . 1 . 1 15 15 VAL HB H 1 1.911 0.003 . 1 . . 83 . A 15 VAL HB . 36107 1
163 . 1 . 1 15 15 VAL HG11 H 1 0.820 0.003 . 2 . . 88 . A 15 VAL HG11 . 36107 1
164 . 1 . 1 15 15 VAL HG12 H 1 0.820 0.003 . 2 . . 88 . A 15 VAL HG12 . 36107 1
165 . 1 . 1 15 15 VAL HG13 H 1 0.820 0.003 . 2 . . 88 . A 15 VAL HG13 . 36107 1
166 . 1 . 1 15 15 VAL HG21 H 1 0.873 0.009 . 2 . . 87 . A 15 VAL HG21 . 36107 1
167 . 1 . 1 15 15 VAL HG22 H 1 0.873 0.009 . 2 . . 87 . A 15 VAL HG22 . 36107 1
168 . 1 . 1 15 15 VAL HG23 H 1 0.873 0.009 . 2 . . 87 . A 15 VAL HG23 . 36107 1
169 . 1 . 1 15 15 VAL CA C 13 61.758 . . 1 . . 112 . A 15 VAL CA . 36107 1
170 . 1 . 1 15 15 VAL CB C 13 33.944 0.021 . 1 . . 156 . A 15 VAL CB . 36107 1
171 . 1 . 1 15 15 VAL N N 15 129.063 . . 1 . . 55 . A 15 VAL N . 36107 1
172 . 1 . 1 16 16 CYS H H 1 8.893 0.004 . 1 . . 41 . A 16 CYS H . 36107 1
173 . 1 . 1 16 16 CYS HA H 1 5.684 0.005 . 1 . . 69 . A 16 CYS HA . 36107 1
174 . 1 . 1 16 16 CYS HB2 H 1 2.928 0.007 . 2 . . 170 . A 16 CYS HB2 . 36107 1
175 . 1 . 1 16 16 CYS HB3 H 1 2.641 0.001 . 2 . . 171 . A 16 CYS HB3 . 36107 1
176 . 1 . 1 16 16 CYS CA C 13 55.150 . . 1 . . 106 . A 16 CYS CA . 36107 1
177 . 1 . 1 16 16 CYS CB C 13 48.399 0.0 . 1 . . 188 . A 16 CYS CB . 36107 1
178 . 1 . 1 16 16 CYS N N 15 125.746 . . 1 . . 42 . A 16 CYS N . 36107 1
179 . 1 . 1 17 17 HIS H H 1 8.864 0.001 . 1 . . 16 . A 17 HIS H . 36107 1
180 . 1 . 1 17 17 HIS HB2 H 1 3.158 0.008 . 2 . . 180 . A 17 HIS HB2 . 36107 1
181 . 1 . 1 17 17 HIS HB3 H 1 3.078 0.006 . 2 . . 179 . A 17 HIS HB3 . 36107 1
182 . 1 . 1 17 17 HIS HD2 H 1 7.164 0.003 . 1 . . 239 . A 17 HIS HD2 . 36107 1
183 . 1 . 1 17 17 HIS HE1 H 1 8.520 0.002 . 1 . . 238 . A 17 HIS HE1 . 36107 1
184 . 1 . 1 17 17 HIS CB C 13 31.595 0.002 . 1 . . 181 . A 17 HIS CB . 36107 1
185 . 1 . 1 17 17 HIS CD2 C 13 120.144 . . 1 . . 240 . A 17 HIS CD2 . 36107 1
186 . 1 . 1 17 17 HIS CE1 C 13 136.309 . . 1 . . 241 . A 17 HIS CE1 . 36107 1
187 . 1 . 1 17 17 HIS N N 15 118.107 . . 1 . . 17 . A 17 HIS N . 36107 1
188 . 1 . 1 18 18 ARG H H 1 8.661 0.001 . 1 . . 35 . A 18 ARG H . 36107 1
189 . 1 . 1 18 18 ARG HA H 1 4.734 . . 1 . . 80 . A 18 ARG HA . 36107 1
190 . 1 . 1 18 18 ARG HB2 H 1 1.606 0.003 . 2 . . 152 . A 18 ARG HB2 . 36107 1
191 . 1 . 1 18 18 ARG HB3 H 1 1.606 0.003 . 2 . . 153 . A 18 ARG HB3 . 36107 1
192 . 1 . 1 18 18 ARG HG2 H 1 1.384 0.002 . 2 . . 150 . A 18 ARG HG2 . 36107 1
193 . 1 . 1 18 18 ARG HG3 H 1 1.384 0.002 . 2 . . 148 . A 18 ARG HG3 . 36107 1
194 . 1 . 1 18 18 ARG HD2 H 1 3.035 0.004 . 2 . . 154 . A 18 ARG HD2 . 36107 1
195 . 1 . 1 18 18 ARG HD3 H 1 3.034 0.004 . 2 . . 96 . A 18 ARG HD3 . 36107 1
196 . 1 . 1 18 18 ARG HE H 1 7.121 0.001 . 1 . . 97 . A 18 ARG HE . 36107 1
197 . 1 . 1 18 18 ARG CB C 13 31.752 . . 1 . . 151 . A 18 ARG CB . 36107 1
198 . 1 . 1 18 18 ARG CG C 13 27.451 . . 1 . . 149 . A 18 ARG CG . 36107 1
199 . 1 . 1 18 18 ARG CD C 13 43.672 . . 1 . . 125 . A 18 ARG CD . 36107 1
200 . 1 . 1 18 18 ARG N N 15 124.296 . . 1 . . 36 . A 18 ARG N . 36107 1
201 . 1 . 1 19 19 ARG H H 1 8.773 0.001 . 1 . . 24 . A 19 ARG H . 36107 1
202 . 1 . 1 19 19 ARG HA H 1 4.327 0.006 . 1 . . 77 . A 19 ARG HA . 36107 1
203 . 1 . 1 19 19 ARG HB2 H 1 0.914 0.008 . 2 . . 136 . A 19 ARG HB2 . 36107 1
204 . 1 . 1 19 19 ARG HB3 H 1 0.793 0.004 . 2 . . 134 . A 19 ARG HB3 . 36107 1
205 . 1 . 1 19 19 ARG HG2 H 1 1.279 0.003 . 2 . . 137 . A 19 ARG HG2 . 36107 1
206 . 1 . 1 19 19 ARG HG3 H 1 1.156 0.004 . 2 . . 139 . A 19 ARG HG3 . 36107 1
207 . 1 . 1 19 19 ARG HD2 H 1 3.093 0.003 . 2 . . 140 . A 19 ARG HD2 . 36107 1
208 . 1 . 1 19 19 ARG HD3 H 1 3.093 0.003 . 2 . . 79 . A 19 ARG HD3 . 36107 1
209 . 1 . 1 19 19 ARG HE H 1 7.156 0.005 . 1 . . 98 . A 19 ARG HE . 36107 1
210 . 1 . 1 19 19 ARG CA C 13 54.473 . . 1 . . 115 . A 19 ARG CA . 36107 1
211 . 1 . 1 19 19 ARG CB C 13 32.894 0.004 . 1 . . 135 . A 19 ARG CB . 36107 1
212 . 1 . 1 19 19 ARG CG C 13 26.780 0.01 . 1 . . 138 . A 19 ARG CG . 36107 1
213 . 1 . 1 19 19 ARG CD C 13 43.303 . . 1 . . 124 . A 19 ARG CD . 36107 1
214 . 1 . 1 19 19 ARG N N 15 127.871 . . 1 . . 25 . A 19 ARG N . 36107 1
215 . 1 . 1 20 20 CYS H H 1 8.181 0.001 . 1 . . 43 . A 20 CYS H . 36107 1
216 . 1 . 1 20 20 CYS HA H 1 5.349 0.003 . 1 . . 65 . A 20 CYS HA . 36107 1
217 . 1 . 1 20 20 CYS HB2 H 1 2.843 0.004 . 2 . . 104 . A 20 CYS HB2 . 36107 1
218 . 1 . 1 20 20 CYS HB3 H 1 2.905 0.005 . 2 . . 105 . A 20 CYS HB3 . 36107 1
219 . 1 . 1 20 20 CYS CA C 13 55.127 . . 1 . . 107 . A 20 CYS CA . 36107 1
220 . 1 . 1 20 20 CYS CB C 13 48.574 0.004 . 1 . . 190 . A 20 CYS CB . 36107 1
221 . 1 . 1 20 20 CYS N N 15 117.884 . . 1 . . 44 . A 20 CYS N . 36107 1
222 . 1 . 1 21 21 ASN H H 1 8.834 0.001 . 1 . . 56 . A 21 ASN H . 36107 1
223 . 1 . 1 21 21 ASN HA H 1 4.871 . . 1 . . 74 . A 21 ASN HA . 36107 1
224 . 1 . 1 21 21 ASN HB2 H 1 3.025 0.005 . 2 . . 169 . A 21 ASN HB2 . 36107 1
225 . 1 . 1 21 21 ASN HB3 H 1 3.241 0.006 . 2 . . 168 . A 21 ASN HB3 . 36107 1
226 . 1 . 1 21 21 ASN HD21 H 1 7.737 0.001 . 1 . . 28 . A 21 ASN HD21 . 36107 1
227 . 1 . 1 21 21 ASN HD22 H 1 6.879 0.004 . 1 . . 32 . A 21 ASN HD22 . 36107 1
228 . 1 . 1 21 21 ASN CB C 13 39.406 0.021 . 1 . . 186 . A 21 ASN CB . 36107 1
229 . 1 . 1 21 21 ASN N N 15 122.591 . . 1 . . 57 . A 21 ASN N . 36107 1
230 . 1 . 1 21 21 ASN ND2 N 15 110.836 0.001 . 1 . . 29 . A 21 ASN ND2 . 36107 1
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