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 53623
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name chemical_shift_list_Pin1_0_uM_ligand
_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 0uM . . . 53623 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
2 $software_2 . . 53623 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 23 23 ALA H H 1 8.533920013 . . . . . . . . 7 ALA H . 53623 1
2 . 1 . 1 23 23 ALA N N 15 122.4950595 . . . . . . . . 7 ALA N . 53623 1
3 . 1 . 1 24 24 ARG H H 1 7.633319973 . . . . . . . . 8 ARG H . 53623 1
4 . 1 . 1 24 24 ARG N N 15 115.4933889 . . . . . . . . 8 ARG N . 53623 1
5 . 1 . 1 25 25 VAL H H 1 7.789020661 . . . . . . . . 9 VAL H . 53623 1
6 . 1 . 1 25 25 VAL N N 15 113.8754494 . . . . . . . . 9 VAL N . 53623 1
7 . 1 . 1 26 26 ARG H H 1 8.134805339 . . . . . . . . 10 ARG H . 53623 1
8 . 1 . 1 26 26 ARG N N 15 120.7860601 . . . . . . . . 10 ARG N . 53623 1
9 . 1 . 1 27 27 CYS H H 1 7.164399125 . . . . . . . . 11 CYS H . 53623 1
10 . 1 . 1 27 27 CYS N N 15 117.5754294 . . . . . . . . 11 CYS N . 53623 1
11 . 1 . 1 28 28 SER H H 1 9.284105169 . . . . . . . . 12 SER H . 53623 1
12 . 1 . 1 28 28 SER N N 15 116.4894995 . . . . . . . . 12 SER N . 53623 1
13 . 1 . 1 29 29 HIS H H 1 9.730145535 . . . . . . . . 13 HIS H . 53623 1
14 . 1 . 1 29 29 HIS N N 15 120.0366218 . . . . . . . . 13 HIS N . 53623 1
15 . 1 . 1 30 30 LEU H H 1 8.845242259 . . . . . . . . 14 LEU H . 53623 1
16 . 1 . 1 30 30 LEU N N 15 125.2329982 . . . . . . . . 14 LEU N . 53623 1
17 . 1 . 1 31 31 LEU H H 1 8.037494205 . . . . . . . . 15 LEU H . 53623 1
18 . 1 . 1 31 31 LEU N N 15 127.2326479 . . . . . . . . 15 LEU N . 53623 1
19 . 1 . 1 32 32 VAL H H 1 9.461558527 . . . . . . . . 16 VAL H . 53623 1
20 . 1 . 1 32 32 VAL N N 15 128.2420013 . . . . . . . . 16 VAL N . 53623 1
21 . 1 . 1 33 33 LYS H H 1 9.055360375 . . . . . . . . 17 LYS H . 53623 1
22 . 1 . 1 33 33 LYS N N 15 125.5487796 . . . . . . . . 17 LYS N . 53623 1
23 . 1 . 1 34 34 HIS H H 1 8.317058301 . . . . . . . . 18 HIS H . 53623 1
24 . 1 . 1 34 34 HIS N N 15 114.1054884 . . . . . . . . 18 HIS N . 53623 1
25 . 1 . 1 35 35 SER H H 1 9.435713212 . . . . . . . . 19 SER H . 53623 1
26 . 1 . 1 35 35 SER N N 15 113.7428046 . . . . . . . . 19 SER N . 53623 1
27 . 1 . 1 36 36 GLN H H 1 9.128749415 . . . . . . . . 20 GLN H . 53623 1
28 . 1 . 1 36 36 GLN N N 15 120.4721097 . . . . . . . . 20 GLN N . 53623 1
29 . 1 . 1 37 37 SER H H 1 7.7868848 . . . . . . . . 21 SER H . 53623 1
30 . 1 . 1 37 37 SER N N 15 121.3506671 . . . . . . . . 21 SER N . 53623 1
31 . 1 . 1 38 38 ARG H H 1 8.023937729 . . . . . . . . 22 ARG H . 53623 1
32 . 1 . 1 38 38 ARG N N 15 123.0698545 . . . . . . . . 22 ARG N . 53623 1
33 . 1 . 1 41 41 SER H H 1 9.119440999 . . . . . . . . 25 SER H . 53623 1
34 . 1 . 1 41 41 SER N N 15 121.4524719 . . . . . . . . 25 SER N . 53623 1
35 . 1 . 1 42 42 SER H H 1 8.879043499 . . . . . . . . 26 SER H . 53623 1
36 . 1 . 1 42 42 SER N N 15 119.0038188 . . . . . . . . 26 SER N . 53623 1
37 . 1 . 1 43 43 TRP H H 1 8.407646557 . . . . . . . . 27 TRP H . 53623 1
38 . 1 . 1 43 43 TRP N N 15 121.8971789 . . . . . . . . 27 TRP N . 53623 1
39 . 1 . 1 44 44 ARG H H 1 6.974746396 . . . . . . . . 28 ARG H . 53623 1
40 . 1 . 1 44 44 ARG N N 15 117.8369501 . . . . . . . . 28 ARG N . 53623 1
41 . 1 . 1 45 45 GLN H H 1 6.822390349 . . . . . . . . 29 GLN H . 53623 1
42 . 1 . 1 45 45 GLN N N 15 118.488145 . . . . . . . . 29 GLN N . 53623 1
43 . 1 . 1 47 47 LYS H H 1 7.921595371 . . . . . . . . 31 LYS H . 53623 1
44 . 1 . 1 47 47 LYS N N 15 117.6657628 . . . . . . . . 31 LYS N . 53623 1
45 . 1 . 1 48 48 ILE H H 1 7.72334675 . . . . . . . . 32 ILE H . 53623 1
46 . 1 . 1 48 48 ILE N N 15 126.1514258 . . . . . . . . 32 ILE N . 53623 1
47 . 1 . 1 49 49 THR H H 1 8.098041305 . . . . . . . . 33 THR H . 53623 1
48 . 1 . 1 49 49 THR N N 15 116.3746293 . . . . . . . . 33 THR N . 53623 1
49 . 1 . 1 50 50 ARG H H 1 7.509004496 . . . . . . . . 34 ARG H . 53623 1
50 . 1 . 1 50 50 ARG N N 15 123.8302815 . . . . . . . . 34 ARG N . 53623 1
51 . 1 . 1 51 51 THR H H 1 8.939684693 . . . . . . . . 35 THR H . 53623 1
52 . 1 . 1 51 51 THR N N 15 113.533816 . . . . . . . . 35 THR N . 53623 1
53 . 1 . 1 52 52 LYS H H 1 8.784293269 . . . . . . . . 36 LYS H . 53623 1
54 . 1 . 1 52 52 LYS N N 15 122.336223 . . . . . . . . 36 LYS N . 53623 1
55 . 1 . 1 53 53 GLU H H 1 8.48168495 . . . . . . . . 37 GLU H . 53623 1
56 . 1 . 1 53 53 GLU N N 15 118.339323 . . . . . . . . 37 GLU N . 53623 1
57 . 1 . 1 54 54 GLU H H 1 7.872983198 . . . . . . . . 38 GLU H . 53623 1
58 . 1 . 1 54 54 GLU N N 15 121.792245 . . . . . . . . 38 GLU N . 53623 1
59 . 1 . 1 55 55 ALA H H 1 8.566950429 . . . . . . . . 39 ALA H . 53623 1
60 . 1 . 1 55 55 ALA N N 15 121.9575321 . . . . . . . . 39 ALA N . 53623 1
61 . 1 . 1 56 56 LEU H H 1 8.319663525 . . . . . . . . 40 LEU H . 53623 1
62 . 1 . 1 56 56 LEU N N 15 119.5176299 . . . . . . . . 40 LEU N . 53623 1
63 . 1 . 1 57 57 GLU H H 1 7.601994301 . . . . . . . . 41 GLU H . 53623 1
64 . 1 . 1 57 57 GLU N N 15 119.2579197 . . . . . . . . 41 GLU N . 53623 1
65 . 1 . 1 58 58 LEU H H 1 7.670348239 . . . . . . . . 42 LEU H . 53623 1
66 . 1 . 1 58 58 LEU N N 15 121.1476057 . . . . . . . . 42 LEU N . 53623 1
67 . 1 . 1 59 59 ILE H H 1 7.923656622 . . . . . . . . 43 ILE H . 53623 1
68 . 1 . 1 59 59 ILE N N 15 119.7352798 . . . . . . . . 43 ILE N . 53623 1
69 . 1 . 1 60 60 ASN H H 1 8.64904697 . . . . . . . . 44 ASN H . 53623 1
70 . 1 . 1 60 60 ASN N N 15 118.8608745 . . . . . . . . 44 ASN N . 53623 1
71 . 1 . 1 61 61 GLY H H 1 7.878274484 . . . . . . . . 45 GLY H . 53623 1
72 . 1 . 1 61 61 GLY N N 15 110.1054926 . . . . . . . . 45 GLY N . 53623 1
73 . 1 . 1 62 62 TYR H H 1 8.013438112 . . . . . . . . 46 TYR H . 53623 1
74 . 1 . 1 62 62 TYR N N 15 122.6714947 . . . . . . . . 46 TYR N . 53623 1
75 . 1 . 1 63 63 ILE H H 1 8.553812247 . . . . . . . . 47 ILE H . 53623 1
76 . 1 . 1 63 63 ILE N N 15 118.8120901 . . . . . . . . 47 ILE N . 53623 1
77 . 1 . 1 64 64 GLN H H 1 7.705886118 . . . . . . . . 48 GLN H . 53623 1
78 . 1 . 1 64 64 GLN N N 15 117.492522 . . . . . . . . 48 GLN N . 53623 1
79 . 1 . 1 65 65 LYS H H 1 7.968433279 . . . . . . . . 49 LYS H . 53623 1
80 . 1 . 1 65 65 LYS N N 15 120.1635075 . . . . . . . . 49 LYS N . 53623 1
81 . 1 . 1 66 66 ILE H H 1 8.09175221 . . . . . . . . 50 ILE H . 53623 1
82 . 1 . 1 66 66 ILE N N 15 120.0319233 . . . . . . . . 50 ILE N . 53623 1
83 . 1 . 1 67 67 LYS H H 1 8.949254447 . . . . . . . . 51 LYS H . 53623 1
84 . 1 . 1 67 67 LYS N N 15 120.8802421 . . . . . . . . 51 LYS N . 53623 1
85 . 1 . 1 68 68 SER H H 1 8.067785702 . . . . . . . . 52 SER H . 53623 1
86 . 1 . 1 68 68 SER N N 15 111.5363343 . . . . . . . . 52 SER N . 53623 1
87 . 1 . 1 69 69 GLY H H 1 7.743833711 . . . . . . . . 53 GLY H . 53623 1
88 . 1 . 1 69 69 GLY N N 15 110.2526515 . . . . . . . . 53 GLY N . 53623 1
89 . 1 . 1 70 70 GLU H H 1 8.183108497 . . . . . . . . 54 GLU H . 53623 1
90 . 1 . 1 70 70 GLU N N 15 121.6810807 . . . . . . . . 54 GLU N . 53623 1
91 . 1 . 1 71 71 GLU H H 1 7.303157767 . . . . . . . . 55 GLU H . 53623 1
92 . 1 . 1 71 71 GLU N N 15 114.3590938 . . . . . . . . 55 GLU N . 53623 1
93 . 1 . 1 72 72 ASP H H 1 8.268650141 . . . . . . . . 56 ASP H . 53623 1
94 . 1 . 1 72 72 ASP N N 15 118.6037117 . . . . . . . . 56 ASP N . 53623 1
95 . 1 . 1 73 73 PHE H H 1 9.01270804 . . . . . . . . 57 PHE H . 53623 1
96 . 1 . 1 73 73 PHE N N 15 122.2300062 . . . . . . . . 57 PHE N . 53623 1
97 . 1 . 1 74 74 GLU H H 1 8.890854834 . . . . . . . . 58 GLU H . 53623 1
98 . 1 . 1 74 74 GLU N N 15 116.650421 . . . . . . . . 58 GLU N . 53623 1
99 . 1 . 1 75 75 SER H H 1 8.017129431 . . . . . . . . 59 SER H . 53623 1
100 . 1 . 1 75 75 SER N N 15 115.9757813 . . . . . . . . 59 SER N . 53623 1
101 . 1 . 1 76 76 LEU H H 1 7.641507478 . . . . . . . . 60 LEU H . 53623 1
102 . 1 . 1 76 76 LEU N N 15 120.8127184 . . . . . . . . 60 LEU N . 53623 1
103 . 1 . 1 77 77 ALA H H 1 8.722499729 . . . . . . . . 61 ALA H . 53623 1
104 . 1 . 1 77 77 ALA N N 15 122.5546097 . . . . . . . . 61 ALA N . 53623 1
105 . 1 . 1 78 78 SER H H 1 7.624781754 . . . . . . . . 62 SER H . 53623 1
106 . 1 . 1 78 78 SER N N 15 108.4610075 . . . . . . . . 62 SER N . 53623 1
107 . 1 . 1 79 79 GLN H H 1 6.785660999 . . . . . . . . 63 GLN H . 53623 1
108 . 1 . 1 79 79 GLN N N 15 115.0218602 . . . . . . . . 63 GLN N . 53623 1
109 . 1 . 1 80 80 PHE H H 1 8.055457414 . . . . . . . . 64 PHE H . 53623 1
110 . 1 . 1 80 80 PHE N N 15 112.6136985 . . . . . . . . 64 PHE N . 53623 1
111 . 1 . 1 81 81 SER H H 1 7.779629373 . . . . . . . . 65 SER H . 53623 1
112 . 1 . 1 81 81 SER N N 15 111.3820782 . . . . . . . . 65 SER N . 53623 1
113 . 1 . 1 82 82 ASP H H 1 9.854067609 . . . . . . . . 66 ASP H . 53623 1
114 . 1 . 1 82 82 ASP N N 15 124.6798846 . . . . . . . . 66 ASP N . 53623 1
115 . 1 . 1 83 83 CYS H H 1 8.049762164 . . . . . . . . 67 CYS H . 53623 1
116 . 1 . 1 83 83 CYS N N 15 123.1815212 . . . . . . . . 67 CYS N . 53623 1
117 . 1 . 1 84 84 SER H H 1 8.784528465 . . . . . . . . 68 SER H . 53623 1
118 . 1 . 1 84 84 SER N N 15 127.2966441 . . . . . . . . 68 SER N . 53623 1
119 . 1 . 1 85 85 SER H H 1 9.780391403 . . . . . . . . 69 SER H . 53623 1
120 . 1 . 1 85 85 SER N N 15 123.4742642 . . . . . . . . 69 SER N . 53623 1
121 . 1 . 1 86 86 ALA H H 1 8.485332713 . . . . . . . . 70 ALA H . 53623 1
122 . 1 . 1 86 86 ALA N N 15 132.1823945 . . . . . . . . 70 ALA N . 53623 1
123 . 1 . 1 87 87 LYS H H 1 6.965388219 . . . . . . . . 71 LYS H . 53623 1
124 . 1 . 1 87 87 LYS N N 15 113.8026785 . . . . . . . . 71 LYS N . 53623 1
125 . 1 . 1 88 88 ALA H H 1 7.670229228 . . . . . . . . 72 ALA H . 53623 1
126 . 1 . 1 88 88 ALA N N 15 124.3079822 . . . . . . . . 72 ALA N . 53623 1
127 . 1 . 1 89 89 ARG H H 1 7.996490914 . . . . . . . . 73 ARG H . 53623 1
128 . 1 . 1 89 89 ARG N N 15 115.2270769 . . . . . . . . 73 ARG N . 53623 1
129 . 1 . 1 91 91 ASP H H 1 7.090067434 . . . . . . . . 75 ASP H . 53623 1
130 . 1 . 1 91 91 ASP N N 15 118.6435602 . . . . . . . . 75 ASP N . 53623 1
131 . 1 . 1 92 92 LEU H H 1 8.696737759 . . . . . . . . 76 LEU H . 53623 1
132 . 1 . 1 92 92 LEU N N 15 125.6442962 . . . . . . . . 76 LEU N . 53623 1
133 . 1 . 1 93 93 GLY H H 1 8.229562173 . . . . . . . . 77 GLY H . 53623 1
134 . 1 . 1 93 93 GLY N N 15 108.8955241 . . . . . . . . 77 GLY N . 53623 1
135 . 1 . 1 94 94 ALA H H 1 8.038217636 . . . . . . . . 78 ALA H . 53623 1
136 . 1 . 1 94 94 ALA N N 15 119.1984653 . . . . . . . . 78 ALA N . 53623 1
137 . 1 . 1 95 95 PHE H H 1 8.851532461 . . . . . . . . 79 PHE H . 53623 1
138 . 1 . 1 95 95 PHE N N 15 117.7510616 . . . . . . . . 79 PHE N . 53623 1
139 . 1 . 1 96 96 SER H H 1 8.399538508 . . . . . . . . 80 SER H . 53623 1
140 . 1 . 1 96 96 SER N N 15 113.8417304 . . . . . . . . 80 SER N . 53623 1
141 . 1 . 1 97 97 ARG H H 1 8.838082054 . . . . . . . . 81 ARG H . 53623 1
142 . 1 . 1 97 97 ARG N N 15 121.388376 . . . . . . . . 81 ARG N . 53623 1
143 . 1 . 1 99 99 GLN H H 1 7.786219952 . . . . . . . . 83 GLN H . 53623 1
144 . 1 . 1 99 99 GLN N N 15 118.9736835 . . . . . . . . 83 GLN N . 53623 1
145 . 1 . 1 100 100 MET H H 1 9.032954797 . . . . . . . . 84 MET H . 53623 1
146 . 1 . 1 100 100 MET N N 15 118.2342174 . . . . . . . . 84 MET N . 53623 1
147 . 1 . 1 101 101 GLN H H 1 8.403777965 . . . . . . . . 85 GLN H . 53623 1
148 . 1 . 1 101 101 GLN N N 15 118.4311783 . . . . . . . . 85 GLN N . 53623 1
149 . 1 . 1 104 104 PHE H H 1 6.8920333 . . . . . . . . 88 PHE H . 53623 1
150 . 1 . 1 104 104 PHE N N 15 116.3757212 . . . . . . . . 88 PHE N . 53623 1
151 . 1 . 1 105 105 GLU H H 1 8.664114387 . . . . . . . . 89 GLU H . 53623 1
152 . 1 . 1 105 105 GLU N N 15 123.0439078 . . . . . . . . 89 GLU N . 53623 1
153 . 1 . 1 106 106 ASP H H 1 9.07972594 . . . . . . . . 90 ASP H . 53623 1
154 . 1 . 1 106 106 ASP N N 15 118.8112501 . . . . . . . . 90 ASP N . 53623 1
155 . 1 . 1 107 107 ALA H H 1 7.058187289 . . . . . . . . 91 ALA H . 53623 1
156 . 1 . 1 107 107 ALA N N 15 118.9950618 . . . . . . . . 91 ALA N . 53623 1
157 . 1 . 1 108 108 SER H H 1 7.850866733 . . . . . . . . 92 SER H . 53623 1
158 . 1 . 1 108 108 SER N N 15 113.8225331 . . . . . . . . 92 SER N . 53623 1
159 . 1 . 1 109 109 PHE H H 1 8.181297025 . . . . . . . . 93 PHE H . 53623 1
160 . 1 . 1 109 109 PHE N N 15 115.1408459 . . . . . . . . 93 PHE N . 53623 1
161 . 1 . 1 110 110 ALA H H 1 6.902901613 . . . . . . . . 94 ALA H . 53623 1
162 . 1 . 1 110 110 ALA N N 15 118.9871506 . . . . . . . . 94 ALA N . 53623 1
163 . 1 . 1 111 111 LEU H H 1 6.863648071 . . . . . . . . 95 LEU H . 53623 1
164 . 1 . 1 111 111 LEU N N 15 120.0704581 . . . . . . . . 95 LEU N . 53623 1
165 . 1 . 1 112 112 ARG H H 1 8.790580091 . . . . . . . . 96 ARG H . 53623 1
166 . 1 . 1 112 112 ARG N N 15 122.0670742 . . . . . . . . 96 ARG N . 53623 1
167 . 1 . 1 113 113 THR H H 1 8.412481493 . . . . . . . . 97 THR H . 53623 1
168 . 1 . 1 113 113 THR N N 15 116.9507928 . . . . . . . . 97 THR N . 53623 1
169 . 1 . 1 114 114 GLY H H 1 8.867168423 . . . . . . . . 98 GLY H . 53623 1
170 . 1 . 1 114 114 GLY N N 15 115.5891586 . . . . . . . . 98 GLY N . 53623 1
171 . 1 . 1 115 115 GLU H H 1 8.087608475 . . . . . . . . 99 GLU H . 53623 1
172 . 1 . 1 115 115 GLU N N 15 122.1565466 . . . . . . . . 99 GLU N . 53623 1
173 . 1 . 1 116 116 MET H H 1 8.161326619 . . . . . . . . 100 MET H . 53623 1
174 . 1 . 1 116 116 MET N N 15 123.0835447 . . . . . . . . 100 MET N . 53623 1
175 . 1 . 1 117 117 SER H H 1 9.628556162 . . . . . . . . 101 SER H . 53623 1
176 . 1 . 1 117 117 SER N N 15 123.5908614 . . . . . . . . 101 SER N . 53623 1
177 . 1 . 1 118 118 GLY H H 1 7.705940695 0 . . . . . . . 102 GLY H . 53623 1
178 . 1 . 1 118 118 GLY N N 15 103.1344505 . . . . . . . . 102 GLY N . 53623 1
179 . 1 . 1 120 120 VAL H H 1 9.151202064 . . . . . . . . 104 VAL H . 53623 1
180 . 1 . 1 120 120 VAL N N 15 127.3979619 . . . . . . . . 104 VAL N . 53623 1
181 . 1 . 1 121 121 PHE H H 1 9.032217441 . . . . . . . . 105 PHE H . 53623 1
182 . 1 . 1 121 121 PHE N N 15 127.8856308 . . . . . . . . 105 PHE N . 53623 1
183 . 1 . 1 122 122 THR H H 1 8.990836985 . . . . . . . . 106 THR H . 53623 1
184 . 1 . 1 122 122 THR N N 15 112.7740999 . . . . . . . . 106 THR N . 53623 1
185 . 1 . 1 123 123 ASP H H 1 8.924487921 . . . . . . . . 107 ASP H . 53623 1
186 . 1 . 1 123 123 ASP N N 15 117.6819655 . . . . . . . . 107 ASP N . 53623 1
187 . 1 . 1 124 124 SER H H 1 9.031086814 . . . . . . . . 108 SER H . 53623 1
188 . 1 . 1 124 124 SER N N 15 114.8861493 . . . . . . . . 108 SER N . 53623 1
189 . 1 . 1 125 125 GLY H H 1 7.612703733 . . . . . . . . 109 GLY H . 53623 1
190 . 1 . 1 125 125 GLY N N 15 110.4343816 . . . . . . . . 109 GLY N . 53623 1
191 . 1 . 1 126 126 ILE H H 1 8.252917393 . . . . . . . . 110 ILE H . 53623 1
192 . 1 . 1 126 126 ILE N N 15 123.3375541 . . . . . . . . 110 ILE N . 53623 1
193 . 1 . 1 127 127 HIS H H 1 9.849352684 . . . . . . . . 111 HIS H . 53623 1
194 . 1 . 1 127 127 HIS N N 15 124.4269317 . . . . . . . . 111 HIS N . 53623 1
195 . 1 . 1 128 128 ILE H H 1 8.472689194 . . . . . . . . 112 ILE H . 53623 1
196 . 1 . 1 128 128 ILE N N 15 115.8462002 . . . . . . . . 112 ILE N . 53623 1
197 . 1 . 1 129 129 ILE H H 1 8.737133323 . . . . . . . . 113 ILE H . 53623 1
198 . 1 . 1 129 129 ILE N N 15 125.5614582 . . . . . . . . 113 ILE N . 53623 1
199 . 1 . 1 130 130 LEU H H 1 8.740356845 . . . . . . . . 114 LEU H . 53623 1
200 . 1 . 1 130 130 LEU N N 15 128.8123346 . . . . . . . . 114 LEU N . 53623 1
201 . 1 . 1 131 131 ARG H H 1 8.004693101 . . . . . . . . 115 ARG H . 53623 1
202 . 1 . 1 131 131 ARG N N 15 127.3918454 . . . . . . . . 115 ARG N . 53623 1
203 . 1 . 1 132 132 THR H H 1 8.99609297 . . . . . . . . 116 THR H . 53623 1
204 . 1 . 1 132 132 THR N N 15 120.9701443 . . . . . . . . 116 THR N . 53623 1
205 . 1 . 1 133 133 GLU H H 1 7.890703509 . . . . . . . . 117 GLU H . 53623 1
206 . 1 . 1 133 133 GLU N N 15 126.1395569 . . . . . . . . 117 GLU N . 53623 1
stop_
save_