Content for NMR-STAR saveframe, assigned_chemical_shifts_2
save_assigned_chemical_shifts_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2
_Assigned_chem_shift_list.Entry_ID 53623
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name chemical_shift_list_Pin1_12-5_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
2 12.5uM . . . 53623 2
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 2
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 23 23 ALA H H 1 8.535840943 . . . . . . . . 7 ALA H . 53623 2
2 . 1 . 1 23 23 ALA N N 15 122.5155636 . . . . . . . . 7 ALA N . 53623 2
3 . 1 . 1 24 24 ARG H H 1 7.631377508 . . . . . . . . 8 ARG H . 53623 2
4 . 1 . 1 24 24 ARG N N 15 115.4914609 . . . . . . . . 8 ARG N . 53623 2
5 . 1 . 1 25 25 VAL H H 1 7.789965398 . . . . . . . . 9 VAL H . 53623 2
6 . 1 . 1 25 25 VAL N N 15 113.8587134 . . . . . . . . 9 VAL N . 53623 2
7 . 1 . 1 26 26 ARG H H 1 8.128394819 . . . . . . . . 10 ARG H . 53623 2
8 . 1 . 1 26 26 ARG N N 15 120.797645 . . . . . . . . 10 ARG N . 53623 2
9 . 1 . 1 27 27 CYS H H 1 7.160890497 . . . . . . . . 11 CYS H . 53623 2
10 . 1 . 1 27 27 CYS N N 15 117.5789934 . . . . . . . . 11 CYS N . 53623 2
11 . 1 . 1 28 28 SER H H 1 9.289023874 . . . . . . . . 12 SER H . 53623 2
12 . 1 . 1 28 28 SER N N 15 116.507813 . . . . . . . . 12 SER N . 53623 2
13 . 1 . 1 29 29 HIS H H 1 9.727548209 . . . . . . . . 13 HIS H . 53623 2
14 . 1 . 1 29 29 HIS N N 15 120.0473143 . . . . . . . . 13 HIS N . 53623 2
15 . 1 . 1 30 30 LEU H H 1 8.847816848 . . . . . . . . 14 LEU H . 53623 2
16 . 1 . 1 30 30 LEU N N 15 125.2273403 . . . . . . . . 14 LEU N . 53623 2
17 . 1 . 1 31 31 LEU H H 1 8.038779888 . . . . . . . . 15 LEU H . 53623 2
18 . 1 . 1 31 31 LEU N N 15 127.2292821 . . . . . . . . 15 LEU N . 53623 2
19 . 1 . 1 32 32 VAL H H 1 9.458629345 . . . . . . . . 16 VAL H . 53623 2
20 . 1 . 1 32 32 VAL N N 15 128.2434484 . . . . . . . . 16 VAL N . 53623 2
21 . 1 . 1 33 33 LYS H H 1 9.059500099 . . . . . . . . 17 LYS H . 53623 2
22 . 1 . 1 33 33 LYS N N 15 125.5648645 . . . . . . . . 17 LYS N . 53623 2
23 . 1 . 1 34 34 HIS H H 1 8.315566575 . . . . . . . . 18 HIS H . 53623 2
24 . 1 . 1 34 34 HIS N N 15 114.1320162 . . . . . . . . 18 HIS N . 53623 2
25 . 1 . 1 35 35 SER H H 1 9.437374139 . . . . . . . . 19 SER H . 53623 2
26 . 1 . 1 35 35 SER N N 15 113.750493 . . . . . . . . 19 SER N . 53623 2
27 . 1 . 1 36 36 GLN H H 1 9.127436558 . . . . . . . . 20 GLN H . 53623 2
28 . 1 . 1 36 36 GLN N N 15 120.4831976 . . . . . . . . 20 GLN N . 53623 2
29 . 1 . 1 37 37 SER H H 1 7.785872951 . . . . . . . . 21 SER H . 53623 2
30 . 1 . 1 37 37 SER N N 15 121.3555023 . . . . . . . . 21 SER N . 53623 2
31 . 1 . 1 38 38 ARG H H 1 8.023184524 . . . . . . . . 22 ARG H . 53623 2
32 . 1 . 1 38 38 ARG N N 15 123.0417338 . . . . . . . . 22 ARG N . 53623 2
33 . 1 . 1 41 41 SER H H 1 9.11984256 . . . . . . . . 25 SER H . 53623 2
34 . 1 . 1 41 41 SER N N 15 121.4666231 . . . . . . . . 25 SER N . 53623 2
35 . 1 . 1 42 42 SER H H 1 8.877673441 . . . . . . . . 26 SER H . 53623 2
36 . 1 . 1 42 42 SER N N 15 119.0171243 . . . . . . . . 26 SER N . 53623 2
37 . 1 . 1 43 43 TRP H H 1 8.403169332 . . . . . . . . 27 TRP H . 53623 2
38 . 1 . 1 43 43 TRP N N 15 121.9028015 . . . . . . . . 27 TRP N . 53623 2
39 . 1 . 1 44 44 ARG H H 1 6.971921528 . . . . . . . . 28 ARG H . 53623 2
40 . 1 . 1 44 44 ARG N N 15 117.8111998 . . . . . . . . 28 ARG N . 53623 2
41 . 1 . 1 45 45 GLN H H 1 6.804327742 . . . . . . . . 29 GLN H . 53623 2
42 . 1 . 1 45 45 GLN N N 15 118.4679782 . . . . . . . . 29 GLN N . 53623 2
43 . 1 . 1 47 47 LYS H H 1 7.926093052 . . . . . . . . 31 LYS H . 53623 2
44 . 1 . 1 47 47 LYS N N 15 117.6694006 . . . . . . . . 31 LYS N . 53623 2
45 . 1 . 1 48 48 ILE H H 1 7.72108467 . . . . . . . . 32 ILE H . 53623 2
46 . 1 . 1 48 48 ILE N N 15 126.1500953 . . . . . . . . 32 ILE N . 53623 2
47 . 1 . 1 49 49 THR H H 1 8.099140445 . . . . . . . . 33 THR H . 53623 2
48 . 1 . 1 49 49 THR N N 15 116.3300088 . . . . . . . . 33 THR N . 53623 2
49 . 1 . 1 50 50 ARG H H 1 7.50936758 . . . . . . . . 34 ARG H . 53623 2
50 . 1 . 1 50 50 ARG N N 15 123.7858879 . . . . . . . . 34 ARG N . 53623 2
51 . 1 . 1 51 51 THR H H 1 8.939405463 . . . . . . . . 35 THR H . 53623 2
52 . 1 . 1 51 51 THR N N 15 113.5332441 . . . . . . . . 35 THR N . 53623 2
53 . 1 . 1 52 52 LYS H H 1 8.780530095 . . . . . . . . 36 LYS H . 53623 2
54 . 1 . 1 52 52 LYS N N 15 122.3750186 . . . . . . . . 36 LYS N . 53623 2
55 . 1 . 1 53 53 GLU H H 1 8.480497766 . . . . . . . . 37 GLU H . 53623 2
56 . 1 . 1 53 53 GLU N N 15 118.3440087 . . . . . . . . 37 GLU N . 53623 2
57 . 1 . 1 54 54 GLU H H 1 7.872058667 . . . . . . . . 38 GLU H . 53623 2
58 . 1 . 1 54 54 GLU N N 15 121.7807317 . . . . . . . . 38 GLU N . 53623 2
59 . 1 . 1 55 55 ALA H H 1 8.564825115 . . . . . . . . 39 ALA H . 53623 2
60 . 1 . 1 55 55 ALA N N 15 121.9240162 . . . . . . . . 39 ALA N . 53623 2
61 . 1 . 1 56 56 LEU H H 1 8.317585794 . . . . . . . . 40 LEU H . 53623 2
62 . 1 . 1 56 56 LEU N N 15 119.527105 . . . . . . . . 40 LEU N . 53623 2
63 . 1 . 1 57 57 GLU H H 1 7.602174662 . . . . . . . . 41 GLU H . 53623 2
64 . 1 . 1 57 57 GLU N N 15 119.2534135 . . . . . . . . 41 GLU N . 53623 2
65 . 1 . 1 58 58 LEU H H 1 7.669083646 . . . . . . . . 42 LEU H . 53623 2
66 . 1 . 1 58 58 LEU N N 15 121.1309529 . . . . . . . . 42 LEU N . 53623 2
67 . 1 . 1 59 59 ILE H H 1 7.912675449 . . . . . . . . 43 ILE H . 53623 2
68 . 1 . 1 59 59 ILE N N 15 119.712872 . . . . . . . . 43 ILE N . 53623 2
69 . 1 . 1 60 60 ASN H H 1 8.645470229 . . . . . . . . 44 ASN H . 53623 2
70 . 1 . 1 60 60 ASN N N 15 118.8573704 . . . . . . . . 44 ASN N . 53623 2
71 . 1 . 1 61 61 GLY H H 1 7.883234503 . . . . . . . . 45 GLY H . 53623 2
72 . 1 . 1 61 61 GLY N N 15 110.090727 . . . . . . . . 45 GLY N . 53623 2
73 . 1 . 1 62 62 TYR H H 1 8.013056587 . . . . . . . . 46 TYR H . 53623 2
74 . 1 . 1 62 62 TYR N N 15 122.6598986 . . . . . . . . 46 TYR N . 53623 2
75 . 1 . 1 63 63 ILE H H 1 8.553726603 . . . . . . . . 47 ILE H . 53623 2
76 . 1 . 1 63 63 ILE N N 15 118.8150105 . . . . . . . . 47 ILE N . 53623 2
77 . 1 . 1 64 64 GLN H H 1 7.704628341 . . . . . . . . 48 GLN H . 53623 2
78 . 1 . 1 64 64 GLN N N 15 117.5078702 . . . . . . . . 48 GLN N . 53623 2
79 . 1 . 1 65 65 LYS H H 1 7.967793277 . . . . . . . . 49 LYS H . 53623 2
80 . 1 . 1 65 65 LYS N N 15 120.163661 . . . . . . . . 49 LYS N . 53623 2
81 . 1 . 1 66 66 ILE H H 1 8.090771047 . . . . . . . . 50 ILE H . 53623 2
82 . 1 . 1 66 66 ILE N N 15 120.0327044 . . . . . . . . 50 ILE N . 53623 2
83 . 1 . 1 67 67 LYS H H 1 8.948877458 . . . . . . . . 51 LYS H . 53623 2
84 . 1 . 1 67 67 LYS N N 15 120.915449 . . . . . . . . 51 LYS N . 53623 2
85 . 1 . 1 68 68 SER H H 1 8.06789849 . . . . . . . . 52 SER H . 53623 2
86 . 1 . 1 68 68 SER N N 15 111.5317315 . . . . . . . . 52 SER N . 53623 2
87 . 1 . 1 69 69 GLY H H 1 7.744721828 . . . . . . . . 53 GLY H . 53623 2
88 . 1 . 1 69 69 GLY N N 15 110.2643587 . . . . . . . . 53 GLY N . 53623 2
89 . 1 . 1 70 70 GLU H H 1 8.183815372 . . . . . . . . 54 GLU H . 53623 2
90 . 1 . 1 70 70 GLU N N 15 121.6616204 . . . . . . . . 54 GLU N . 53623 2
91 . 1 . 1 71 71 GLU H H 1 7.304075306 . . . . . . . . 55 GLU H . 53623 2
92 . 1 . 1 71 71 GLU N N 15 114.3560002 . . . . . . . . 55 GLU N . 53623 2
93 . 1 . 1 72 72 ASP H H 1 8.268209886 . . . . . . . . 56 ASP H . 53623 2
94 . 1 . 1 72 72 ASP N N 15 118.5937813 . . . . . . . . 56 ASP N . 53623 2
95 . 1 . 1 73 73 PHE H H 1 9.010730388 . . . . . . . . 57 PHE H . 53623 2
96 . 1 . 1 73 73 PHE N N 15 122.2041315 . . . . . . . . 57 PHE N . 53623 2
97 . 1 . 1 74 74 GLU H H 1 8.892743766 . . . . . . . . 58 GLU H . 53623 2
98 . 1 . 1 74 74 GLU N N 15 116.6422737 . . . . . . . . 58 GLU N . 53623 2
99 . 1 . 1 75 75 SER H H 1 8.018844283 . . . . . . . . 59 SER H . 53623 2
100 . 1 . 1 75 75 SER N N 15 115.9717997 . . . . . . . . 59 SER N . 53623 2
101 . 1 . 1 76 76 LEU H H 1 7.641133936 . . . . . . . . 60 LEU H . 53623 2
102 . 1 . 1 76 76 LEU N N 15 120.826362 . . . . . . . . 60 LEU N . 53623 2
103 . 1 . 1 77 77 ALA H H 1 8.721470573 . . . . . . . . 61 ALA H . 53623 2
104 . 1 . 1 77 77 ALA N N 15 122.5562908 . . . . . . . . 61 ALA N . 53623 2
105 . 1 . 1 78 78 SER H H 1 7.624948158 . . . . . . . . 62 SER H . 53623 2
106 . 1 . 1 78 78 SER N N 15 108.4653968 . . . . . . . . 62 SER N . 53623 2
107 . 1 . 1 79 79 GLN H H 1 6.787438741 . . . . . . . . 63 GLN H . 53623 2
108 . 1 . 1 79 79 GLN N N 15 115.0362482 . . . . . . . . 63 GLN N . 53623 2
109 . 1 . 1 80 80 PHE H H 1 8.056603231 . . . . . . . . 64 PHE H . 53623 2
110 . 1 . 1 80 80 PHE N N 15 112.5889281 . . . . . . . . 64 PHE N . 53623 2
111 . 1 . 1 81 81 SER H H 1 7.777411196 . . . . . . . . 65 SER H . 53623 2
112 . 1 . 1 81 81 SER N N 15 111.3861096 . . . . . . . . 65 SER N . 53623 2
113 . 1 . 1 82 82 ASP H H 1 9.853892537 . . . . . . . . 66 ASP H . 53623 2
114 . 1 . 1 82 82 ASP N N 15 124.6572831 . . . . . . . . 66 ASP N . 53623 2
115 . 1 . 1 83 83 CYS H H 1 8.04790089 . . . . . . . . 67 CYS H . 53623 2
116 . 1 . 1 83 83 CYS N N 15 123.1518052 . . . . . . . . 67 CYS N . 53623 2
117 . 1 . 1 84 84 SER H H 1 8.785986494 . . . . . . . . 68 SER H . 53623 2
118 . 1 . 1 84 84 SER N N 15 127.3197544 . . . . . . . . 68 SER N . 53623 2
119 . 1 . 1 85 85 SER H H 1 9.780880624 . . . . . . . . 69 SER H . 53623 2
120 . 1 . 1 85 85 SER N N 15 123.5263398 . . . . . . . . 69 SER N . 53623 2
121 . 1 . 1 86 86 ALA H H 1 8.484996247 . . . . . . . . 70 ALA H . 53623 2
122 . 1 . 1 86 86 ALA N N 15 132.1903265 . . . . . . . . 70 ALA N . 53623 2
123 . 1 . 1 87 87 LYS H H 1 6.964616574 . . . . . . . . 71 LYS H . 53623 2
124 . 1 . 1 87 87 LYS N N 15 113.808359 . . . . . . . . 71 LYS N . 53623 2
125 . 1 . 1 88 88 ALA H H 1 7.671776764 . . . . . . . . 72 ALA H . 53623 2
126 . 1 . 1 88 88 ALA N N 15 124.2915739 . . . . . . . . 72 ALA N . 53623 2
127 . 1 . 1 89 89 ARG H H 1 7.996590053 . . . . . . . . 73 ARG H . 53623 2
128 . 1 . 1 89 89 ARG N N 15 115.2261829 . . . . . . . . 73 ARG N . 53623 2
129 . 1 . 1 91 91 ASP H H 1 7.089755677 . . . . . . . . 75 ASP H . 53623 2
130 . 1 . 1 91 91 ASP N N 15 118.6301883 . . . . . . . . 75 ASP N . 53623 2
131 . 1 . 1 92 92 LEU H H 1 8.700819013 . . . . . . . . 76 LEU H . 53623 2
132 . 1 . 1 92 92 LEU N N 15 125.6448047 . . . . . . . . 76 LEU N . 53623 2
133 . 1 . 1 93 93 GLY H H 1 8.231387632 . . . . . . . . 77 GLY H . 53623 2
134 . 1 . 1 93 93 GLY N N 15 108.8889492 . . . . . . . . 77 GLY N . 53623 2
135 . 1 . 1 94 94 ALA H H 1 8.040142079 . . . . . . . . 78 ALA H . 53623 2
136 . 1 . 1 94 94 ALA N N 15 119.230955 . . . . . . . . 78 ALA N . 53623 2
137 . 1 . 1 95 95 PHE H H 1 8.850236643 . . . . . . . . 79 PHE H . 53623 2
138 . 1 . 1 95 95 PHE N N 15 117.7240216 . . . . . . . . 79 PHE N . 53623 2
139 . 1 . 1 96 96 SER H H 1 8.399730965 . . . . . . . . 80 SER H . 53623 2
140 . 1 . 1 96 96 SER N N 15 113.8387863 . . . . . . . . 80 SER N . 53623 2
141 . 1 . 1 97 97 ARG H H 1 8.839158501 . . . . . . . . 81 ARG H . 53623 2
142 . 1 . 1 97 97 ARG N N 15 121.3953661 . . . . . . . . 81 ARG N . 53623 2
143 . 1 . 1 99 99 GLN H H 1 7.791088229 . . . . . . . . 83 GLN H . 53623 2
144 . 1 . 1 99 99 GLN N N 15 118.9646976 . . . . . . . . 83 GLN N . 53623 2
145 . 1 . 1 100 100 MET H H 1 9.033848292 . . . . . . . . 84 MET H . 53623 2
146 . 1 . 1 100 100 MET N N 15 118.217488 . . . . . . . . 84 MET N . 53623 2
147 . 1 . 1 101 101 GLN H H 1 8.405688908 . . . . . . . . 85 GLN H . 53623 2
148 . 1 . 1 101 101 GLN N N 15 118.442169 . . . . . . . . 85 GLN N . 53623 2
149 . 1 . 1 104 104 PHE H H 1 6.892141488 . . . . . . . . 88 PHE H . 53623 2
150 . 1 . 1 104 104 PHE N N 15 116.3708094 . . . . . . . . 88 PHE N . 53623 2
151 . 1 . 1 105 105 GLU H H 1 8.663760526 . . . . . . . . 89 GLU H . 53623 2
152 . 1 . 1 105 105 GLU N N 15 123.0731052 . . . . . . . . 89 GLU N . 53623 2
153 . 1 . 1 106 106 ASP H H 1 9.079963052 0 . . . . . . . 90 ASP H . 53623 2
154 . 1 . 1 106 106 ASP N N 15 118.8385077 0 . . . . . . . 90 ASP N . 53623 2
155 . 1 . 1 107 107 ALA H H 1 7.055643793 . . . . . . . . 91 ALA H . 53623 2
156 . 1 . 1 107 107 ALA N N 15 119.003217 . . . . . . . . 91 ALA N . 53623 2
157 . 1 . 1 108 108 SER H H 1 7.851778859 . . . . . . . . 92 SER H . 53623 2
158 . 1 . 1 108 108 SER N N 15 113.8218196 . . . . . . . . 92 SER N . 53623 2
159 . 1 . 1 109 109 PHE H H 1 8.179526625 . . . . . . . . 93 PHE H . 53623 2
160 . 1 . 1 109 109 PHE N N 15 115.1376396 . . . . . . . . 93 PHE N . 53623 2
161 . 1 . 1 110 110 ALA H H 1 6.903891761 . . . . . . . . 94 ALA H . 53623 2
162 . 1 . 1 110 110 ALA N N 15 118.9870019 . . . . . . . . 94 ALA N . 53623 2
163 . 1 . 1 111 111 LEU H H 1 6.864046502 . . . . . . . . 95 LEU H . 53623 2
164 . 1 . 1 111 111 LEU N N 15 120.0600258 . . . . . . . . 95 LEU N . 53623 2
165 . 1 . 1 112 112 ARG H H 1 8.790800933 . . . . . . . . 96 ARG H . 53623 2
166 . 1 . 1 112 112 ARG N N 15 122.1164772 . . . . . . . . 96 ARG N . 53623 2
167 . 1 . 1 113 113 THR H H 1 8.411836441 . . . . . . . . 97 THR H . 53623 2
168 . 1 . 1 113 113 THR N N 15 116.9487563 . . . . . . . . 97 THR N . 53623 2
169 . 1 . 1 114 114 GLY H H 1 8.862986056 . . . . . . . . 98 GLY H . 53623 2
170 . 1 . 1 114 114 GLY N N 15 115.6003719 . . . . . . . . 98 GLY N . 53623 2
171 . 1 . 1 115 115 GLU H H 1 8.087471085 . . . . . . . . 99 GLU H . 53623 2
172 . 1 . 1 115 115 GLU N N 15 122.1525878 . . . . . . . . 99 GLU N . 53623 2
173 . 1 . 1 116 116 MET H H 1 8.161950989 . . . . . . . . 100 MET H . 53623 2
174 . 1 . 1 116 116 MET N N 15 123.0921145 . . . . . . . . 100 MET N . 53623 2
175 . 1 . 1 117 117 SER H H 1 9.629075921 . . . . . . . . 101 SER H . 53623 2
176 . 1 . 1 117 117 SER N N 15 123.6298395 . . . . . . . . 101 SER N . 53623 2
177 . 1 . 1 118 118 GLY H H 1 7.70172 0 . . . . . . . 102 GLY H . 53623 2
178 . 1 . 1 118 118 GLY N N 15 103.1337194 . . . . . . . . 102 GLY N . 53623 2
179 . 1 . 1 120 120 VAL H H 1 9.150735265 . . . . . . . . 104 VAL H . 53623 2
180 . 1 . 1 120 120 VAL N N 15 127.3872158 . . . . . . . . 104 VAL N . 53623 2
181 . 1 . 1 121 121 PHE H H 1 9.03357855 . . . . . . . . 105 PHE H . 53623 2
182 . 1 . 1 121 121 PHE N N 15 127.8953985 . . . . . . . . 105 PHE N . 53623 2
183 . 1 . 1 122 122 THR H H 1 8.98793748 . . . . . . . . 106 THR H . 53623 2
184 . 1 . 1 122 122 THR N N 15 112.749427 . . . . . . . . 106 THR N . 53623 2
185 . 1 . 1 123 123 ASP H H 1 8.927142743 . . . . . . . . 107 ASP H . 53623 2
186 . 1 . 1 123 123 ASP N N 15 117.6902485 . . . . . . . . 107 ASP N . 53623 2
187 . 1 . 1 124 124 SER H H 1 9.029127749 0 . . . . . . . 108 SER H . 53623 2
188 . 1 . 1 124 124 SER N N 15 114.8696157 0 . . . . . . . 108 SER N . 53623 2
189 . 1 . 1 125 125 GLY H H 1 7.612278672 . . . . . . . . 109 GLY H . 53623 2
190 . 1 . 1 125 125 GLY N N 15 110.4472732 . . . . . . . . 109 GLY N . 53623 2
191 . 1 . 1 126 126 ILE H H 1 8.249194913 . . . . . . . . 110 ILE H . 53623 2
192 . 1 . 1 126 126 ILE N N 15 123.3426949 . . . . . . . . 110 ILE N . 53623 2
193 . 1 . 1 127 127 HIS H H 1 9.853892537 . . . . . . . . 111 HIS H . 53623 2
194 . 1 . 1 127 127 HIS N N 15 124.6572831 . . . . . . . . 111 HIS N . 53623 2
195 . 1 . 1 128 128 ILE H H 1 8.471017402 0 . . . . . . . 112 ILE H . 53623 2
196 . 1 . 1 128 128 ILE N N 15 115.8629689 0 . . . . . . . 112 ILE N . 53623 2
197 . 1 . 1 129 129 ILE H H 1 8.700819013 . . . . . . . . 113 ILE H . 53623 2
198 . 1 . 1 129 129 ILE N N 15 125.6448047 . . . . . . . . 113 ILE N . 53623 2
199 . 1 . 1 130 130 LEU H H 1 8.741318817 . . . . . . . . 114 LEU H . 53623 2
200 . 1 . 1 130 130 LEU N N 15 128.7933125 . . . . . . . . 114 LEU N . 53623 2
201 . 1 . 1 131 131 ARG H H 1 8.00512386 . . . . . . . . 115 ARG H . 53623 2
202 . 1 . 1 131 131 ARG N N 15 127.3811917 . . . . . . . . 115 ARG N . 53623 2
203 . 1 . 1 132 132 THR H H 1 8.993596067 . . . . . . . . 116 THR H . 53623 2
204 . 1 . 1 132 132 THR N N 15 120.9650433 . . . . . . . . 116 THR N . 53623 2
205 . 1 . 1 133 133 GLU H H 1 7.890265902 . . . . . . . . 117 GLU H . 53623 2
206 . 1 . 1 133 133 GLU N N 15 126.11597 . . . . . . . . 117 GLU N . 53623 2
stop_
save_