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 50220
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'assigned chem shift list 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 0.01
_Assigned_chem_shift_list.Chem_shift_13C_err 0.1
_Assigned_chem_shift_list.Chem_shift_15N_err 0.02
_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-13C HSQC' . . . 50220 1
2 '3D CCH-TOCSY' . . . 50220 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
1 $software_1 . . 50220 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 8 8 ILE HG21 H 1 0.563 0.036 . 1 . . 215 . . 408 ILE HG21 . 50220 1
2 . 1 . 1 8 8 ILE HG22 H 1 0.563 0.036 . 1 . . 215 . . 408 ILE HG22 . 50220 1
3 . 1 . 1 8 8 ILE HG23 H 1 0.563 0.036 . 1 . . 215 . . 408 ILE HG23 . 50220 1
4 . 1 . 1 8 8 ILE HD11 H 1 0.659 0.027 . 1 . . 165 . . 408 ILE HD11 . 50220 1
5 . 1 . 1 8 8 ILE HD12 H 1 0.659 0.027 . 1 . . 165 . . 408 ILE HD12 . 50220 1
6 . 1 . 1 8 8 ILE HD13 H 1 0.659 0.027 . 1 . . 165 . . 408 ILE HD13 . 50220 1
7 . 1 . 1 8 8 ILE CA C 13 58.443 . . 1 . . 1224 . . 408 ILE CA . 50220 1
8 . 1 . 1 8 8 ILE CB C 13 40.280 . . 1 . . 1223 . . 408 ILE CB . 50220 1
9 . 1 . 1 8 8 ILE CG1 C 13 26.316 0.088 . 1 . . 1222 . . 408 ILE CG1 . 50220 1
10 . 1 . 1 8 8 ILE CG2 C 13 14.754 0.115 . 1 . . 216 . . 408 ILE CG2 . 50220 1
11 . 1 . 1 8 8 ILE CD1 C 13 13.275 0.121 . 1 . . 166 . . 408 ILE CD1 . 50220 1
12 . 1 . 1 10 10 LEU HD11 H 1 0.592 0.0 . 1 . . 1281 . . 410 LEU HD11 . 50220 1
13 . 1 . 1 10 10 LEU HD12 H 1 0.592 0.0 . 1 . . 1281 . . 410 LEU HD12 . 50220 1
14 . 1 . 1 10 10 LEU HD13 H 1 0.592 0.0 . 1 . . 1281 . . 410 LEU HD13 . 50220 1
15 . 1 . 1 10 10 LEU CB C 13 45.240 . . 1 . . 1283 . . 410 LEU CB . 50220 1
16 . 1 . 1 10 10 LEU CD1 C 13 21.327 0.045 . 1 . . 1280 . . 410 LEU CD1 . 50220 1
17 . 1 . 1 12 12 VAL HG11 H 1 0.770 0.034 . 1 . . 227 . . 412 VAL HG11 . 50220 1
18 . 1 . 1 12 12 VAL HG12 H 1 0.770 0.034 . 1 . . 227 . . 412 VAL HG12 . 50220 1
19 . 1 . 1 12 12 VAL HG13 H 1 0.770 0.034 . 1 . . 227 . . 412 VAL HG13 . 50220 1
20 . 1 . 1 12 12 VAL CA C 13 60.268 . . 1 . . 1539 . . 412 VAL CA . 50220 1
21 . 1 . 1 12 12 VAL CB C 13 33.599 . . 1 . . 1540 . . 412 VAL CB . 50220 1
22 . 1 . 1 12 12 VAL CG1 C 13 20.572 0.129 . 1 . . 228 . . 412 VAL CG1 . 50220 1
23 . 1 . 1 18 18 ALA HB1 H 1 1.356 0.0 . 1 . . 12 . . 418 ALA HB1 . 50220 1
24 . 1 . 1 18 18 ALA HB2 H 1 1.356 0.0 . 1 . . 12 . . 418 ALA HB2 . 50220 1
25 . 1 . 1 18 18 ALA HB3 H 1 1.356 0.0 . 1 . . 12 . . 418 ALA HB3 . 50220 1
26 . 1 . 1 18 18 ALA CA C 13 54.310 . . 1 . . 1365 . . 418 ALA CA . 50220 1
27 . 1 . 1 18 18 ALA CB C 13 17.168 0.034 . 1 . . 11 . . 418 ALA CB . 50220 1
28 . 1 . 1 24 24 THR HG21 H 1 1.126 0.0 . 1 . . 50 . . 424 THR HG21 . 50220 1
29 . 1 . 1 24 24 THR HG22 H 1 1.126 0.0 . 1 . . 50 . . 424 THR HG22 . 50220 1
30 . 1 . 1 24 24 THR HG23 H 1 1.126 0.0 . 1 . . 50 . . 424 THR HG23 . 50220 1
31 . 1 . 1 24 24 THR CA C 13 66.270 . . 1 . . 1298 . . 424 THR CA . 50220 1
32 . 1 . 1 24 24 THR CB C 13 68.114 . . 1 . . 1297 . . 424 THR CB . 50220 1
33 . 1 . 1 24 24 THR CG2 C 13 20.781 0.033 . 1 . . 49 . . 424 THR CG2 . 50220 1
34 . 1 . 1 26 26 ALA H H 1 7.923 . . 1 . . 1691 . . 426 ALA H . 50220 1
35 . 1 . 1 26 26 ALA HB1 H 1 0.750 0.026 . 1 . . 40 . . 426 ALA HB1 . 50220 1
36 . 1 . 1 26 26 ALA HB2 H 1 0.750 0.026 . 1 . . 40 . . 426 ALA HB2 . 50220 1
37 . 1 . 1 26 26 ALA HB3 H 1 0.750 0.026 . 1 . . 40 . . 426 ALA HB3 . 50220 1
38 . 1 . 1 26 26 ALA CA C 13 53.895 . . 1 . . 1244 . . 426 ALA CA . 50220 1
39 . 1 . 1 26 26 ALA CB C 13 17.720 0.024 . 1 . . 39 . . 426 ALA CB . 50220 1
40 . 1 . 1 27 27 LEU HD11 H 1 0.656 0.0 . 1 . . 177 . . 427 LEU HD11 . 50220 1
41 . 1 . 1 27 27 LEU HD12 H 1 0.656 0.0 . 1 . . 177 . . 427 LEU HD12 . 50220 1
42 . 1 . 1 27 27 LEU HD13 H 1 0.656 0.0 . 1 . . 177 . . 427 LEU HD13 . 50220 1
43 . 1 . 1 27 27 LEU CA C 13 57.612 . . 1 . . 1345 . . 427 LEU CA . 50220 1
44 . 1 . 1 27 27 LEU CB C 13 40.223 . . 1 . . 1340 . . 427 LEU CB . 50220 1
45 . 1 . 1 27 27 LEU CG C 13 25.238 . . 1 . . 1341 . . 427 LEU CG . 50220 1
46 . 1 . 1 27 27 LEU CD1 C 13 22.142 0.036 . 1 . . 178 . . 427 LEU CD1 . 50220 1
47 . 1 . 1 28 28 VAL HG11 H 1 0.962 0.0 . 2 . . 1310 . . 428 VAL HG11 . 50220 1
48 . 1 . 1 28 28 VAL HG12 H 1 0.962 0.0 . 2 . . 1310 . . 428 VAL HG12 . 50220 1
49 . 1 . 1 28 28 VAL HG13 H 1 0.962 0.0 . 2 . . 1310 . . 428 VAL HG13 . 50220 1
50 . 1 . 1 28 28 VAL HG21 H 1 0.839 0.002 . 2 . . 1316 . . 428 VAL HG21 . 50220 1
51 . 1 . 1 28 28 VAL HG22 H 1 0.839 0.002 . 2 . . 1316 . . 428 VAL HG22 . 50220 1
52 . 1 . 1 28 28 VAL HG23 H 1 0.839 0.002 . 2 . . 1316 . . 428 VAL HG23 . 50220 1
53 . 1 . 1 28 28 VAL CA C 13 65.767 0.033 . 1 . . 1314 . . 428 VAL CA . 50220 1
54 . 1 . 1 28 28 VAL CB C 13 30.815 0.024 . 1 . . 1313 . . 428 VAL CB . 50220 1
55 . 1 . 1 28 28 VAL CG1 C 13 21.327 0.035 . 2 . . 1311 . . 428 VAL CG1 . 50220 1
56 . 1 . 1 28 28 VAL CG2 C 13 20.101 0.037 . 2 . . 1315 . . 428 VAL CG2 . 50220 1
57 . 1 . 1 30 30 LEU HD11 H 1 0.449 0.0 . 2 . . 1275 . . 430 LEU HD11 . 50220 1
58 . 1 . 1 30 30 LEU HD12 H 1 0.449 0.0 . 2 . . 1275 . . 430 LEU HD12 . 50220 1
59 . 1 . 1 30 30 LEU HD13 H 1 0.449 0.0 . 2 . . 1275 . . 430 LEU HD13 . 50220 1
60 . 1 . 1 30 30 LEU HD21 H 1 0.697 0.0 . 2 . . 1347 . . 430 LEU HD21 . 50220 1
61 . 1 . 1 30 30 LEU HD22 H 1 0.697 0.0 . 2 . . 1347 . . 430 LEU HD22 . 50220 1
62 . 1 . 1 30 30 LEU HD23 H 1 0.697 0.0 . 2 . . 1347 . . 430 LEU HD23 . 50220 1
63 . 1 . 1 30 30 LEU CA C 13 57.576 0.035 . 1 . . 1344 . . 430 LEU CA . 50220 1
64 . 1 . 1 30 30 LEU CB C 13 40.352 0.023 . 1 . . 1343 . . 430 LEU CB . 50220 1
65 . 1 . 1 30 30 LEU CG C 13 25.838 0.103 . 1 . . 1342 . . 430 LEU CG . 50220 1
66 . 1 . 1 30 30 LEU CD1 C 13 24.345 0.033 . 2 . . 1276 . . 430 LEU CD1 . 50220 1
67 . 1 . 1 30 30 LEU CD2 C 13 21.442 0.042 . 2 . . 1346 . . 430 LEU CD2 . 50220 1
68 . 1 . 1 36 36 THR HG21 H 1 0.915 0.001 . 1 . . 65 . . 436 THR HG21 . 50220 1
69 . 1 . 1 36 36 THR HG22 H 1 0.915 0.001 . 1 . . 65 . . 436 THR HG22 . 50220 1
70 . 1 . 1 36 36 THR HG23 H 1 0.915 0.001 . 1 . . 65 . . 436 THR HG23 . 50220 1
71 . 1 . 1 36 36 THR CA C 13 61.430 . . 1 . . 1625 . . 436 THR CA . 50220 1
72 . 1 . 1 36 36 THR CB C 13 68.726 . . 1 . . 1626 . . 436 THR CB . 50220 1
73 . 1 . 1 39 39 ALA H H 1 7.845 . . 1 . . 1682 . . 439 ALA H . 50220 1
74 . 1 . 1 39 39 ALA HB1 H 1 1.040 0.027 . 1 . . 34 . . 439 ALA HB1 . 50220 1
75 . 1 . 1 39 39 ALA HB2 H 1 1.040 0.027 . 1 . . 34 . . 439 ALA HB2 . 50220 1
76 . 1 . 1 39 39 ALA HB3 H 1 1.040 0.027 . 1 . . 34 . . 439 ALA HB3 . 50220 1
77 . 1 . 1 39 39 ALA CA C 13 50.266 . . 1 . . 1233 . . 439 ALA CA . 50220 1
78 . 1 . 1 39 39 ALA CB C 13 22.032 0.018 . 1 . . 33 . . 439 ALA CB . 50220 1
79 . 1 . 1 41 41 THR HG21 H 1 0.781 0.0 . 1 . . 63 . . 441 THR HG21 . 50220 1
80 . 1 . 1 41 41 THR HG22 H 1 0.781 0.0 . 1 . . 63 . . 441 THR HG22 . 50220 1
81 . 1 . 1 41 41 THR HG23 H 1 0.781 0.0 . 1 . . 63 . . 441 THR HG23 . 50220 1
82 . 1 . 1 41 41 THR CA C 13 61.285 . . 1 . . 1336 . . 441 THR CA . 50220 1
83 . 1 . 1 41 41 THR CB C 13 68.866 . . 1 . . 1337 . . 441 THR CB . 50220 1
84 . 1 . 1 41 41 THR CG2 C 13 20.168 0.031 . 1 . . 64 . . 441 THR CG2 . 50220 1
85 . 1 . 1 45 45 THR HG21 H 1 1.086 0.001 . 1 . . 53 . . 445 THR HG21 . 50220 1
86 . 1 . 1 45 45 THR HG22 H 1 1.086 0.001 . 1 . . 53 . . 445 THR HG22 . 50220 1
87 . 1 . 1 45 45 THR HG23 H 1 1.086 0.001 . 1 . . 53 . . 445 THR HG23 . 50220 1
88 . 1 . 1 45 45 THR CA C 13 61.264 . . 1 . . 1299 . . 445 THR CA . 50220 1
89 . 1 . 1 45 45 THR CB C 13 70.567 . . 1 . . 1300 . . 445 THR CB . 50220 1
90 . 1 . 1 45 45 THR CG2 C 13 20.284 0.038 . 1 . . 54 . . 445 THR CG2 . 50220 1
91 . 1 . 1 48 48 VAL HG11 H 1 0.871 0.001 . 2 . . 1103 . . 448 VAL HG11 . 50220 1
92 . 1 . 1 48 48 VAL HG12 H 1 0.871 0.001 . 2 . . 1103 . . 448 VAL HG12 . 50220 1
93 . 1 . 1 48 48 VAL HG13 H 1 0.871 0.001 . 2 . . 1103 . . 448 VAL HG13 . 50220 1
94 . 1 . 1 48 48 VAL HG21 H 1 0.852 0.03 . 2 . . 1105 . . 448 VAL HG21 . 50220 1
95 . 1 . 1 48 48 VAL HG22 H 1 0.852 0.03 . 2 . . 1105 . . 448 VAL HG22 . 50220 1
96 . 1 . 1 48 48 VAL HG23 H 1 0.852 0.03 . 2 . . 1105 . . 448 VAL HG23 . 50220 1
97 . 1 . 1 48 48 VAL CA C 13 60.417 0.005 . 1 . . 1334 . . 448 VAL CA . 50220 1
98 . 1 . 1 48 48 VAL CB C 13 32.983 0.003 . 1 . . 1335 . . 448 VAL CB . 50220 1
99 . 1 . 1 48 48 VAL CG1 C 13 19.497 0.1 . 2 . . 1102 . . 448 VAL CG1 . 50220 1
100 . 1 . 1 48 48 VAL CG2 C 13 20.322 0.118 . 2 . . 1104 . . 448 VAL CG2 . 50220 1
101 . 1 . 1 49 49 ILE HG21 H 1 0.667 0.0 . 1 . . 1226 . . 449 ILE HG21 . 50220 1
102 . 1 . 1 49 49 ILE HG22 H 1 0.667 0.0 . 1 . . 1226 . . 449 ILE HG22 . 50220 1
103 . 1 . 1 49 49 ILE HG23 H 1 0.667 0.0 . 1 . . 1226 . . 449 ILE HG23 . 50220 1
104 . 1 . 1 49 49 ILE HD11 H 1 0.584 0.001 . 1 . . 1212 . . 449 ILE HD11 . 50220 1
105 . 1 . 1 49 49 ILE HD12 H 1 0.584 0.001 . 1 . . 1212 . . 449 ILE HD12 . 50220 1
106 . 1 . 1 49 49 ILE HD13 H 1 0.584 0.001 . 1 . . 1212 . . 449 ILE HD13 . 50220 1
107 . 1 . 1 49 49 ILE CA C 13 58.466 0.046 . 1 . . 1214 . . 449 ILE CA . 50220 1
108 . 1 . 1 49 49 ILE CB C 13 37.271 0.129 . 1 . . 1215 . . 449 ILE CB . 50220 1
109 . 1 . 1 49 49 ILE CG1 C 13 25.826 . . 1 . . 1216 . . 449 ILE CG1 . 50220 1
110 . 1 . 1 49 49 ILE CG2 C 13 17.186 0.028 . 1 . . 1227 . . 449 ILE CG2 . 50220 1
111 . 1 . 1 49 49 ILE CD1 C 13 10.801 0.073 . 1 . . 1211 . . 449 ILE CD1 . 50220 1
112 . 1 . 1 50 50 ILE HG21 H 1 0.720 0.032 . 1 . . 80 . . 450 ILE HG21 . 50220 1
113 . 1 . 1 50 50 ILE HG22 H 1 0.720 0.032 . 1 . . 80 . . 450 ILE HG22 . 50220 1
114 . 1 . 1 50 50 ILE HG23 H 1 0.720 0.032 . 1 . . 80 . . 450 ILE HG23 . 50220 1
115 . 1 . 1 50 50 ILE HD11 H 1 0.572 0.001 . 1 . . 153 . . 450 ILE HD11 . 50220 1
116 . 1 . 1 50 50 ILE HD12 H 1 0.572 0.001 . 1 . . 153 . . 450 ILE HD12 . 50220 1
117 . 1 . 1 50 50 ILE HD13 H 1 0.572 0.001 . 1 . . 153 . . 450 ILE HD13 . 50220 1
118 . 1 . 1 50 50 ILE CA C 13 58.642 0.02 . 1 . . 1221 . . 450 ILE CA . 50220 1
119 . 1 . 1 50 50 ILE CB C 13 38.765 0.029 . 1 . . 1220 . . 450 ILE CB . 50220 1
120 . 1 . 1 50 50 ILE CG1 C 13 25.092 0.026 . 1 . . 1219 . . 450 ILE CG1 . 50220 1
121 . 1 . 1 50 50 ILE CG2 C 13 17.223 0.122 . 1 . . 79 . . 450 ILE CG2 . 50220 1
122 . 1 . 1 50 50 ILE CD1 C 13 12.498 0.03 . 1 . . 154 . . 450 ILE CD1 . 50220 1
123 . 1 . 1 56 56 LEU HD11 H 1 0.741 0.001 . 2 . . 117 . . 456 LEU HD11 . 50220 1
124 . 1 . 1 56 56 LEU HD12 H 1 0.741 0.001 . 2 . . 117 . . 456 LEU HD12 . 50220 1
125 . 1 . 1 56 56 LEU HD13 H 1 0.741 0.001 . 2 . . 117 . . 456 LEU HD13 . 50220 1
126 . 1 . 1 56 56 LEU HD21 H 1 0.692 0.025 . 2 . . 123 . . 456 LEU HD21 . 50220 1
127 . 1 . 1 56 56 LEU HD22 H 1 0.692 0.025 . 2 . . 123 . . 456 LEU HD22 . 50220 1
128 . 1 . 1 56 56 LEU HD23 H 1 0.692 0.025 . 2 . . 123 . . 456 LEU HD23 . 50220 1
129 . 1 . 1 56 56 LEU CA C 13 54.671 0.012 . 1 . . 1279 . . 456 LEU CA . 50220 1
130 . 1 . 1 56 56 LEU CG C 13 25.618 0.043 . 1 . . 1277 . . 456 LEU CG . 50220 1
131 . 1 . 1 56 56 LEU CD1 C 13 23.907 0.059 . 2 . . 118 . . 456 LEU CD1 . 50220 1
132 . 1 . 1 56 56 LEU CD2 C 13 22.408 0.031 . 2 . . 124 . . 456 LEU CD2 . 50220 1
133 . 1 . 1 60 60 ILE HG21 H 1 0.829 0.03 . 1 . . 73 . . 460 ILE HG21 . 50220 1
134 . 1 . 1 60 60 ILE HG22 H 1 0.829 0.03 . 1 . . 73 . . 460 ILE HG22 . 50220 1
135 . 1 . 1 60 60 ILE HG23 H 1 0.829 0.03 . 1 . . 73 . . 460 ILE HG23 . 50220 1
136 . 1 . 1 60 60 ILE HD11 H 1 0.762 0.028 . 1 . . 127 . . 460 ILE HD11 . 50220 1
137 . 1 . 1 60 60 ILE HD12 H 1 0.762 0.028 . 1 . . 127 . . 460 ILE HD12 . 50220 1
138 . 1 . 1 60 60 ILE HD13 H 1 0.762 0.028 . 1 . . 127 . . 460 ILE HD13 . 50220 1
139 . 1 . 1 60 60 ILE CA C 13 63.888 0.061 . 1 . . 1198 . . 460 ILE CA . 50220 1
140 . 1 . 1 60 60 ILE CB C 13 36.716 0.04 . 1 . . 1197 . . 460 ILE CB . 50220 1
141 . 1 . 1 60 60 ILE CG1 C 13 27.506 . . 1 . . 1228 . . 460 ILE CG1 . 50220 1
142 . 1 . 1 60 60 ILE CG2 C 13 16.152 0.127 . 1 . . 74 . . 460 ILE CG2 . 50220 1
143 . 1 . 1 60 60 ILE CD1 C 13 12.144 0.132 . 1 . . 128 . . 460 ILE CD1 . 50220 1
144 . 1 . 1 61 61 LEU HD11 H 1 -0.100 0.0 . 2 . . 211 . . 461 LEU HD11 . 50220 1
145 . 1 . 1 61 61 LEU HD12 H 1 -0.100 0.0 . 2 . . 211 . . 461 LEU HD12 . 50220 1
146 . 1 . 1 61 61 LEU HD13 H 1 -0.100 0.0 . 2 . . 211 . . 461 LEU HD13 . 50220 1
147 . 1 . 1 61 61 LEU HD21 H 1 0.325 0.001 . 2 . . 1362 . . 461 LEU HD21 . 50220 1
148 . 1 . 1 61 61 LEU HD22 H 1 0.325 0.001 . 2 . . 1362 . . 461 LEU HD22 . 50220 1
149 . 1 . 1 61 61 LEU HD23 H 1 0.325 0.001 . 2 . . 1362 . . 461 LEU HD23 . 50220 1
150 . 1 . 1 61 61 LEU CB C 13 40.695 . . 1 . . 1363 . . 461 LEU CB . 50220 1
151 . 1 . 1 61 61 LEU CG C 13 25.493 0.011 . 1 . . 1364 . . 461 LEU CG . 50220 1
152 . 1 . 1 61 61 LEU CD1 C 13 23.875 0.052 . 2 . . 212 . . 461 LEU CD1 . 50220 1
153 . 1 . 1 61 61 LEU CD2 C 13 22.215 0.027 . 2 . . 1361 . . 461 LEU CD2 . 50220 1
154 . 1 . 1 62 62 VAL HG11 H 1 0.809 0.001 . 2 . . 175 . . 462 VAL HG11 . 50220 1
155 . 1 . 1 62 62 VAL HG12 H 1 0.809 0.001 . 2 . . 175 . . 462 VAL HG12 . 50220 1
156 . 1 . 1 62 62 VAL HG13 H 1 0.809 0.001 . 2 . . 175 . . 462 VAL HG13 . 50220 1
157 . 1 . 1 62 62 VAL HG21 H 1 0.774 0.002 . 2 . . 1267 . . 462 VAL HG21 . 50220 1
158 . 1 . 1 62 62 VAL HG22 H 1 0.774 0.002 . 2 . . 1267 . . 462 VAL HG22 . 50220 1
159 . 1 . 1 62 62 VAL HG23 H 1 0.774 0.002 . 2 . . 1267 . . 462 VAL HG23 . 50220 1
160 . 1 . 1 62 62 VAL CA C 13 66.042 0.052 . 1 . . 1269 . . 462 VAL CA . 50220 1
161 . 1 . 1 62 62 VAL CB C 13 30.467 0.026 . 1 . . 1268 . . 462 VAL CB . 50220 1
162 . 1 . 1 62 62 VAL CG1 C 13 22.107 0.023 . 2 . . 176 . . 462 VAL CG1 . 50220 1
163 . 1 . 1 62 62 VAL CG2 C 13 20.909 0.035 . 2 . . 1266 . . 462 VAL CG2 . 50220 1
164 . 1 . 1 71 71 VAL HG11 H 1 0.674 0.029 . 2 . . 225 . . 471 VAL HG11 . 50220 1
165 . 1 . 1 71 71 VAL HG12 H 1 0.674 0.029 . 2 . . 225 . . 471 VAL HG12 . 50220 1
166 . 1 . 1 71 71 VAL HG13 H 1 0.674 0.029 . 2 . . 225 . . 471 VAL HG13 . 50220 1
167 . 1 . 1 71 71 VAL HG21 H 1 0.712 0.0 . 2 . . 1330 . . 471 VAL HG21 . 50220 1
168 . 1 . 1 71 71 VAL HG22 H 1 0.712 0.0 . 2 . . 1330 . . 471 VAL HG22 . 50220 1
169 . 1 . 1 71 71 VAL HG23 H 1 0.712 0.0 . 2 . . 1330 . . 471 VAL HG23 . 50220 1
170 . 1 . 1 71 71 VAL CA C 13 62.232 0.05 . 1 . . 1291 . . 471 VAL CA . 50220 1
171 . 1 . 1 71 71 VAL CB C 13 32.218 0.015 . 1 . . 1290 . . 471 VAL CB . 50220 1
172 . 1 . 1 71 71 VAL CG1 C 13 20.874 0.112 . 2 . . 226 . . 471 VAL CG1 . 50220 1
173 . 1 . 1 71 71 VAL CG2 C 13 20.777 0.021 . 2 . . 1331 . . 471 VAL CG2 . 50220 1
174 . 1 . 1 75 75 VAL HG11 H 1 0.816 0.029 . 2 . . 89 . . 475 VAL HG11 . 50220 1
175 . 1 . 1 75 75 VAL HG12 H 1 0.816 0.029 . 2 . . 89 . . 475 VAL HG12 . 50220 1
176 . 1 . 1 75 75 VAL HG13 H 1 0.816 0.029 . 2 . . 89 . . 475 VAL HG13 . 50220 1
177 . 1 . 1 75 75 VAL HG21 H 1 0.679 0.028 . 2 . . 179 . . 475 VAL HG21 . 50220 1
178 . 1 . 1 75 75 VAL HG22 H 1 0.679 0.028 . 2 . . 179 . . 475 VAL HG22 . 50220 1
179 . 1 . 1 75 75 VAL HG23 H 1 0.679 0.028 . 2 . . 179 . . 475 VAL HG23 . 50220 1
180 . 1 . 1 75 75 VAL CA C 13 60.654 0.018 . 1 . . 1357 . . 475 VAL CA . 50220 1
181 . 1 . 1 75 75 VAL CB C 13 33.674 0.065 . 1 . . 1358 . . 475 VAL CB . 50220 1
182 . 1 . 1 75 75 VAL CG1 C 13 18.474 0.106 . 2 . . 90 . . 475 VAL CG1 . 50220 1
183 . 1 . 1 75 75 VAL CG2 C 13 21.190 0.098 . 2 . . 180 . . 475 VAL CG2 . 50220 1
184 . 1 . 1 77 77 ALA H H 1 7.910 . . 1 . . 1683 . . 477 ALA H . 50220 1
185 . 1 . 1 77 77 ALA HB1 H 1 1.246 0.035 . 1 . . 14 . . 477 ALA HB1 . 50220 1
186 . 1 . 1 77 77 ALA HB2 H 1 1.246 0.035 . 1 . . 14 . . 477 ALA HB2 . 50220 1
187 . 1 . 1 77 77 ALA HB3 H 1 1.246 0.035 . 1 . . 14 . . 477 ALA HB3 . 50220 1
188 . 1 . 1 77 77 ALA CA C 13 49.060 . . 1 . . 1236 . . 477 ALA CA . 50220 1
189 . 1 . 1 77 77 ALA CB C 13 17.376 0.038 . 1 . . 13 . . 477 ALA CB . 50220 1
190 . 1 . 1 85 85 THR HG21 H 1 0.995 0.0 . 1 . . 57 . . 485 THR HG21 . 50220 1
191 . 1 . 1 85 85 THR HG22 H 1 0.995 0.0 . 1 . . 57 . . 485 THR HG22 . 50220 1
192 . 1 . 1 85 85 THR HG23 H 1 0.995 0.0 . 1 . . 57 . . 485 THR HG23 . 50220 1
193 . 1 . 1 85 85 THR CA C 13 61.136 . . 1 . . 1349 . . 485 THR CA . 50220 1
194 . 1 . 1 85 85 THR CB C 13 69.317 . . 1 . . 1348 . . 485 THR CB . 50220 1
195 . 1 . 1 85 85 THR CG2 C 13 21.014 0.021 . 1 . . 58 . . 485 THR CG2 . 50220 1
196 . 1 . 1 90 90 ALA H H 1 8.490 . . 1 . . 1690 . . 490 ALA H . 50220 1
197 . 1 . 1 90 90 ALA HB1 H 1 1.254 0.032 . 1 . . 30 . . 490 ALA HB1 . 50220 1
198 . 1 . 1 90 90 ALA HB2 H 1 1.254 0.032 . 1 . . 30 . . 490 ALA HB2 . 50220 1
199 . 1 . 1 90 90 ALA HB3 H 1 1.254 0.032 . 1 . . 30 . . 490 ALA HB3 . 50220 1
200 . 1 . 1 90 90 ALA CA C 13 52.314 . . 1 . . 1231 . . 490 ALA CA . 50220 1
201 . 1 . 1 90 90 ALA CB C 13 23.281 0.024 . 1 . . 29 . . 490 ALA CB . 50220 1
202 . 1 . 1 92 92 VAL HG11 H 1 1.134 0.029 . 2 . . 81 . . 492 VAL HG11 . 50220 1
203 . 1 . 1 92 92 VAL HG12 H 1 1.134 0.029 . 2 . . 81 . . 492 VAL HG12 . 50220 1
204 . 1 . 1 92 92 VAL HG13 H 1 1.134 0.029 . 2 . . 81 . . 492 VAL HG13 . 50220 1
205 . 1 . 1 92 92 VAL HG21 H 1 0.760 0.033 . 2 . . 145 . . 492 VAL HG21 . 50220 1
206 . 1 . 1 92 92 VAL HG22 H 1 0.760 0.033 . 2 . . 145 . . 492 VAL HG22 . 50220 1
207 . 1 . 1 92 92 VAL HG23 H 1 0.760 0.033 . 2 . . 145 . . 492 VAL HG23 . 50220 1
208 . 1 . 1 92 92 VAL CA C 13 58.796 0.03 . 1 . . 1250 . . 492 VAL CA . 50220 1
209 . 1 . 1 92 92 VAL CB C 13 35.490 0.017 . 1 . . 1248 . . 492 VAL CB . 50220 1
210 . 1 . 1 92 92 VAL CG1 C 13 18.641 0.099 . 2 . . 82 . . 492 VAL CG1 . 50220 1
211 . 1 . 1 92 92 VAL CG2 C 13 21.051 0.142 . 2 . . 146 . . 492 VAL CG2 . 50220 1
212 . 1 . 1 109 109 VAL HG11 H 1 1.218 0.03 . 2 . . 83 . . 509 VAL HG11 . 50220 1
213 . 1 . 1 109 109 VAL HG12 H 1 1.218 0.03 . 2 . . 83 . . 509 VAL HG12 . 50220 1
214 . 1 . 1 109 109 VAL HG13 H 1 1.218 0.03 . 2 . . 83 . . 509 VAL HG13 . 50220 1
215 . 1 . 1 109 109 VAL HG21 H 1 0.790 0.027 . 2 . . 109 . . 509 VAL HG21 . 50220 1
216 . 1 . 1 109 109 VAL HG22 H 1 0.790 0.027 . 2 . . 109 . . 509 VAL HG22 . 50220 1
217 . 1 . 1 109 109 VAL HG23 H 1 0.790 0.027 . 2 . . 109 . . 509 VAL HG23 . 50220 1
218 . 1 . 1 109 109 VAL CA C 13 57.780 0.026 . 1 . . 1253 . . 509 VAL CA . 50220 1
219 . 1 . 1 109 109 VAL CB C 13 34.792 0.087 . 1 . . 1252 . . 509 VAL CB . 50220 1
220 . 1 . 1 109 109 VAL CG1 C 13 23.245 0.098 . 2 . . 84 . . 509 VAL CG1 . 50220 1
221 . 1 . 1 109 109 VAL CG2 C 13 17.634 0.056 . 2 . . 110 . . 509 VAL CG2 . 50220 1
222 . 1 . 1 111 111 ILE HG21 H 1 -0.160 0.032 . 1 . . 71 . . 511 ILE HG21 . 50220 1
223 . 1 . 1 111 111 ILE HG22 H 1 -0.160 0.032 . 1 . . 71 . . 511 ILE HG22 . 50220 1
224 . 1 . 1 111 111 ILE HG23 H 1 -0.160 0.032 . 1 . . 71 . . 511 ILE HG23 . 50220 1
225 . 1 . 1 111 111 ILE HD11 H 1 0.750 0.026 . 1 . . 161 . . 511 ILE HD11 . 50220 1
226 . 1 . 1 111 111 ILE HD12 H 1 0.750 0.026 . 1 . . 161 . . 511 ILE HD12 . 50220 1
227 . 1 . 1 111 111 ILE HD13 H 1 0.750 0.026 . 1 . . 161 . . 511 ILE HD13 . 50220 1
228 . 1 . 1 111 111 ILE CA C 13 57.774 0.007 . 1 . . 1191 . . 511 ILE CA . 50220 1
229 . 1 . 1 111 111 ILE CB C 13 41.364 0.001 . 1 . . 1192 . . 511 ILE CB . 50220 1
230 . 1 . 1 111 111 ILE CG1 C 13 27.276 0.029 . 1 . . 1193 . . 511 ILE CG1 . 50220 1
231 . 1 . 1 111 111 ILE CG2 C 13 16.462 0.114 . 1 . . 72 . . 511 ILE CG2 . 50220 1
232 . 1 . 1 111 111 ILE CD1 C 13 12.795 0.082 . 1 . . 162 . . 511 ILE CD1 . 50220 1
233 . 1 . 1 114 114 THR HG21 H 1 1.166 0.0 . 1 . . 47 . . 514 THR HG21 . 50220 1
234 . 1 . 1 114 114 THR HG22 H 1 1.166 0.0 . 1 . . 47 . . 514 THR HG22 . 50220 1
235 . 1 . 1 114 114 THR HG23 H 1 1.166 0.0 . 1 . . 47 . . 514 THR HG23 . 50220 1
236 . 1 . 1 114 114 THR CA C 13 58.364 . . 1 . . 1350 . . 514 THR CA . 50220 1
237 . 1 . 1 114 114 THR CG2 C 13 20.372 0.036 . 1 . . 48 . . 514 THR CG2 . 50220 1
238 . 1 . 1 118 118 THR HG21 H 1 1.302 0.0 . 1 . . 43 . . 518 THR HG21 . 50220 1
239 . 1 . 1 118 118 THR HG22 H 1 1.302 0.0 . 1 . . 43 . . 518 THR HG22 . 50220 1
240 . 1 . 1 118 118 THR HG23 H 1 1.302 0.0 . 1 . . 43 . . 518 THR HG23 . 50220 1
241 . 1 . 1 118 118 THR CA C 13 63.748 . . 1 . . 1301 . . 518 THR CA . 50220 1
242 . 1 . 1 118 118 THR CB C 13 68.543 . . 1 . . 1302 . . 518 THR CB . 50220 1
243 . 1 . 1 118 118 THR CG2 C 13 20.897 0.035 . 1 . . 44 . . 518 THR CG2 . 50220 1
244 . 1 . 1 120 120 ALA H H 1 8.145 . . 1 . . 1689 . . 520 ALA H . 50220 1
245 . 1 . 1 120 120 ALA HB1 H 1 1.236 0.031 . 1 . . 20 . . 520 ALA HB1 . 50220 1
246 . 1 . 1 120 120 ALA HB2 H 1 1.236 0.031 . 1 . . 20 . . 520 ALA HB2 . 50220 1
247 . 1 . 1 120 120 ALA HB3 H 1 1.236 0.031 . 1 . . 20 . . 520 ALA HB3 . 50220 1
248 . 1 . 1 120 120 ALA CA C 13 52.524 . . 1 . . 1239 . . 520 ALA CA . 50220 1
249 . 1 . 1 120 120 ALA CB C 13 19.386 0.017 . 1 . . 19 . . 520 ALA CB . 50220 1
250 . 1 . 1 127 127 ALA H H 1 8.653 . . 1 . . 1687 . . 527 ALA H . 50220 1
251 . 1 . 1 127 127 ALA HB1 H 1 1.167 0.033 . 1 . . 18 . . 527 ALA HB1 . 50220 1
252 . 1 . 1 127 127 ALA HB2 H 1 1.167 0.033 . 1 . . 18 . . 527 ALA HB2 . 50220 1
253 . 1 . 1 127 127 ALA HB3 H 1 1.167 0.033 . 1 . . 18 . . 527 ALA HB3 . 50220 1
254 . 1 . 1 127 127 ALA CA C 13 49.804 . . 1 . . 1241 . . 527 ALA CA . 50220 1
255 . 1 . 1 127 127 ALA CB C 13 18.536 0.02 . 1 . . 17 . . 527 ALA CB . 50220 1
256 . 1 . 1 128 128 ILE HG21 H 1 0.826 0.043 . 1 . . 1097 . . 528 ILE HG21 . 50220 1
257 . 1 . 1 128 128 ILE HG22 H 1 0.826 0.043 . 1 . . 1097 . . 528 ILE HG22 . 50220 1
258 . 1 . 1 128 128 ILE HG23 H 1 0.826 0.043 . 1 . . 1097 . . 528 ILE HG23 . 50220 1
259 . 1 . 1 128 128 ILE HD11 H 1 0.350 0.029 . 1 . . 147 . . 528 ILE HD11 . 50220 1
260 . 1 . 1 128 128 ILE HD12 H 1 0.350 0.029 . 1 . . 147 . . 528 ILE HD12 . 50220 1
261 . 1 . 1 128 128 ILE HD13 H 1 0.350 0.029 . 1 . . 147 . . 528 ILE HD13 . 50220 1
262 . 1 . 1 128 128 ILE CA C 13 58.903 . . 1 . . 1184 . . 528 ILE CA . 50220 1
263 . 1 . 1 128 128 ILE CB C 13 34.436 . . 1 . . 1183 . . 528 ILE CB . 50220 1
264 . 1 . 1 128 128 ILE CG1 C 13 25.641 . . 1 . . 1182 . . 528 ILE CG1 . 50220 1
265 . 1 . 1 128 128 ILE CG2 C 13 16.646 0.101 . 1 . . 1096 . . 528 ILE CG2 . 50220 1
266 . 1 . 1 128 128 ILE CD1 C 13 8.572 0.072 . 1 . . 148 . . 528 ILE CD1 . 50220 1
267 . 1 . 1 129 129 VAL HG11 H 1 0.588 0.032 . 1 . . 105 . . 529 VAL HG11 . 50220 1
268 . 1 . 1 129 129 VAL HG12 H 1 0.588 0.032 . 1 . . 105 . . 529 VAL HG12 . 50220 1
269 . 1 . 1 129 129 VAL HG13 H 1 0.588 0.032 . 1 . . 105 . . 529 VAL HG13 . 50220 1
270 . 1 . 1 129 129 VAL CA C 13 60.149 . . 1 . . 1373 . . 529 VAL CA . 50220 1
271 . 1 . 1 129 129 VAL CB C 13 33.455 . . 1 . . 1374 . . 529 VAL CB . 50220 1
272 . 1 . 1 129 129 VAL CG1 C 13 20.412 0.108 . 1 . . 106 . . 529 VAL CG1 . 50220 1
273 . 1 . 1 132 132 VAL HG11 H 1 1.079 0.0 . 2 . . 1606 . . 532 VAL HG11 . 50220 1
274 . 1 . 1 132 132 VAL HG12 H 1 1.079 0.0 . 2 . . 1606 . . 532 VAL HG12 . 50220 1
275 . 1 . 1 132 132 VAL HG13 H 1 1.079 0.0 . 2 . . 1606 . . 532 VAL HG13 . 50220 1
276 . 1 . 1 132 132 VAL HG21 H 1 1.068 0.004 . 2 . . 1608 . . 532 VAL HG21 . 50220 1
277 . 1 . 1 132 132 VAL HG22 H 1 1.068 0.004 . 2 . . 1608 . . 532 VAL HG22 . 50220 1
278 . 1 . 1 132 132 VAL HG23 H 1 1.068 0.004 . 2 . . 1608 . . 532 VAL HG23 . 50220 1
279 . 1 . 1 132 132 VAL CA C 13 65.054 0.108 . 1 . . 1611 . . 532 VAL CA . 50220 1
280 . 1 . 1 132 132 VAL CB C 13 30.091 0.053 . 1 . . 1610 . . 532 VAL CB . 50220 1
281 . 1 . 1 132 132 VAL CG1 C 13 21.027 0.019 . 2 . . 1607 . . 532 VAL CG1 . 50220 1
282 . 1 . 1 132 132 VAL CG2 C 13 18.898 0.031 . 2 . . 1609 . . 532 VAL CG2 . 50220 1
283 . 1 . 1 133 133 VAL HG11 H 1 0.436 0.036 . 2 . . 97 . . 533 VAL HG11 . 50220 1
284 . 1 . 1 133 133 VAL HG12 H 1 0.436 0.036 . 2 . . 97 . . 533 VAL HG12 . 50220 1
285 . 1 . 1 133 133 VAL HG13 H 1 0.436 0.036 . 2 . . 97 . . 533 VAL HG13 . 50220 1
286 . 1 . 1 133 133 VAL HG21 H 1 0.955 0.03 . 2 . . 205 . . 533 VAL HG21 . 50220 1
287 . 1 . 1 133 133 VAL HG22 H 1 0.955 0.03 . 2 . . 205 . . 533 VAL HG22 . 50220 1
288 . 1 . 1 133 133 VAL HG23 H 1 0.955 0.03 . 2 . . 205 . . 533 VAL HG23 . 50220 1
289 . 1 . 1 133 133 VAL CA C 13 59.642 0.014 . 1 . . 1255 . . 533 VAL CA . 50220 1
290 . 1 . 1 133 133 VAL CB C 13 33.769 0.086 . 1 . . 1254 . . 533 VAL CB . 50220 1
291 . 1 . 1 133 133 VAL CG1 C 13 19.895 0.121 . 2 . . 98 . . 533 VAL CG1 . 50220 1
292 . 1 . 1 133 133 VAL CG2 C 13 21.042 0.107 . 2 . . 206 . . 533 VAL CG2 . 50220 1
293 . 1 . 1 138 138 ILE HG21 H 1 1.001 0.036 . 1 . . 201 . . 538 ILE HG21 . 50220 1
294 . 1 . 1 138 138 ILE HG22 H 1 1.001 0.036 . 1 . . 201 . . 538 ILE HG22 . 50220 1
295 . 1 . 1 138 138 ILE HG23 H 1 1.001 0.036 . 1 . . 201 . . 538 ILE HG23 . 50220 1
296 . 1 . 1 138 138 ILE HD11 H 1 0.616 0.027 . 1 . . 155 . . 538 ILE HD11 . 50220 1
297 . 1 . 1 138 138 ILE HD12 H 1 0.616 0.027 . 1 . . 155 . . 538 ILE HD12 . 50220 1
298 . 1 . 1 138 138 ILE HD13 H 1 0.616 0.027 . 1 . . 155 . . 538 ILE HD13 . 50220 1
299 . 1 . 1 138 138 ILE CA C 13 66.067 0.082 . 1 . . 1178 . . 538 ILE CA . 50220 1
300 . 1 . 1 138 138 ILE CB C 13 33.485 0.101 . 1 . . 1177 . . 538 ILE CB . 50220 1
301 . 1 . 1 138 138 ILE CG1 C 13 27.630 0.024 . 1 . . 1176 . . 538 ILE CG1 . 50220 1
302 . 1 . 1 138 138 ILE CG2 C 13 16.086 0.117 . 1 . . 202 . . 538 ILE CG2 . 50220 1
303 . 1 . 1 138 138 ILE CD1 C 13 10.253 0.081 . 1 . . 156 . . 538 ILE CD1 . 50220 1
304 . 1 . 1 143 143 ALA H H 1 8.116 . . 1 . . 1693 . . 543 ALA H . 50220 1
305 . 1 . 1 143 143 ALA HB1 H 1 1.366 0.032 . 1 . . 36 . . 543 ALA HB1 . 50220 1
306 . 1 . 1 143 143 ALA HB2 H 1 1.366 0.032 . 1 . . 36 . . 543 ALA HB2 . 50220 1
307 . 1 . 1 143 143 ALA HB3 H 1 1.366 0.032 . 1 . . 36 . . 543 ALA HB3 . 50220 1
308 . 1 . 1 143 143 ALA CA C 13 54.378 . . 1 . . 1692 . . 543 ALA CA . 50220 1
309 . 1 . 1 143 143 ALA CB C 13 17.773 0.029 . 1 . . 35 . . 543 ALA CB . 50220 1
310 . 1 . 1 145 145 LEU HD11 H 1 1.001 0.0 . 1 . . 1322 . . 545 LEU HD11 . 50220 1
311 . 1 . 1 145 145 LEU HD12 H 1 1.001 0.0 . 1 . . 1322 . . 545 LEU HD12 . 50220 1
312 . 1 . 1 145 145 LEU HD13 H 1 1.001 0.0 . 1 . . 1322 . . 545 LEU HD13 . 50220 1
313 . 1 . 1 145 145 LEU CA C 13 57.149 . . 1 . . 1323 . . 545 LEU CA . 50220 1
314 . 1 . 1 145 145 LEU CB C 13 40.955 . . 1 . . 1324 . . 545 LEU CB . 50220 1
315 . 1 . 1 145 145 LEU CG C 13 25.525 . . 1 . . 1325 . . 545 LEU CG . 50220 1
316 . 1 . 1 145 145 LEU CD1 C 13 23.320 0.037 . 1 . . 1321 . . 545 LEU CD1 . 50220 1
317 . 1 . 1 148 148 ALA H H 1 7.593 . . 1 . . 1681 . . 548 ALA H . 50220 1
318 . 1 . 1 148 148 ALA HB1 H 1 1.365 0.035 . 1 . . 38 . . 548 ALA HB1 . 50220 1
319 . 1 . 1 148 148 ALA HB2 H 1 1.365 0.035 . 1 . . 38 . . 548 ALA HB2 . 50220 1
320 . 1 . 1 148 148 ALA HB3 H 1 1.365 0.035 . 1 . . 38 . . 548 ALA HB3 . 50220 1
321 . 1 . 1 148 148 ALA CA C 13 54.067 . . 1 . . 1245 . . 548 ALA CA . 50220 1
322 . 1 . 1 148 148 ALA CB C 13 17.582 0.027 . 1 . . 37 . . 548 ALA CB . 50220 1
323 . 1 . 1 155 155 ALA HB1 H 1 1.209 0.0 . 1 . . 22 . . 555 ALA HB1 . 50220 1
324 . 1 . 1 155 155 ALA HB2 H 1 1.209 0.0 . 1 . . 22 . . 555 ALA HB2 . 50220 1
325 . 1 . 1 155 155 ALA HB3 H 1 1.209 0.0 . 1 . . 22 . . 555 ALA HB3 . 50220 1
326 . 1 . 1 155 155 ALA CA C 13 50.003 . . 1 . . 1238 . . 555 ALA CA . 50220 1
327 . 1 . 1 155 155 ALA CB C 13 20.487 0.035 . 1 . . 21 . . 555 ALA CB . 50220 1
328 . 1 . 1 159 159 LEU HD11 H 1 0.333 0.0 . 2 . . 1271 . . 559 LEU HD11 . 50220 1
329 . 1 . 1 159 159 LEU HD12 H 1 0.333 0.0 . 2 . . 1271 . . 559 LEU HD12 . 50220 1
330 . 1 . 1 159 159 LEU HD13 H 1 0.333 0.0 . 2 . . 1271 . . 559 LEU HD13 . 50220 1
331 . 1 . 1 159 159 LEU HD21 H 1 0.150 0.001 . 2 . . 1285 . . 559 LEU HD21 . 50220 1
332 . 1 . 1 159 159 LEU HD22 H 1 0.150 0.001 . 2 . . 1285 . . 559 LEU HD22 . 50220 1
333 . 1 . 1 159 159 LEU HD23 H 1 0.150 0.001 . 2 . . 1285 . . 559 LEU HD23 . 50220 1
334 . 1 . 1 159 159 LEU CA C 13 53.353 0.113 . 1 . . 1274 . . 559 LEU CA . 50220 1
335 . 1 . 1 159 159 LEU CB C 13 42.952 0.093 . 1 . . 1273 . . 559 LEU CB . 50220 1
336 . 1 . 1 159 159 LEU CG C 13 25.759 . . 1 . . 1272 . . 559 LEU CG . 50220 1
337 . 1 . 1 159 159 LEU CD1 C 13 24.490 0.047 . 2 . . 1270 . . 559 LEU CD1 . 50220 1
338 . 1 . 1 159 159 LEU CD2 C 13 25.574 0.016 . 2 . . 1284 . . 559 LEU CD2 . 50220 1
339 . 1 . 1 160 160 ILE HG21 H 1 0.678 0.034 . 1 . . 133 . . 560 ILE HG21 . 50220 1
340 . 1 . 1 160 160 ILE HG22 H 1 0.678 0.034 . 1 . . 133 . . 560 ILE HG22 . 50220 1
341 . 1 . 1 160 160 ILE HG23 H 1 0.678 0.034 . 1 . . 133 . . 560 ILE HG23 . 50220 1
342 . 1 . 1 160 160 ILE HD11 H 1 0.360 0.026 . 1 . . 233 . . 560 ILE HD11 . 50220 1
343 . 1 . 1 160 160 ILE HD12 H 1 0.360 0.026 . 1 . . 233 . . 560 ILE HD12 . 50220 1
344 . 1 . 1 160 160 ILE HD13 H 1 0.360 0.026 . 1 . . 233 . . 560 ILE HD13 . 50220 1
345 . 1 . 1 160 160 ILE CA C 13 58.335 0.099 . 1 . . 1205 . . 560 ILE CA . 50220 1
346 . 1 . 1 160 160 ILE CB C 13 41.968 0.109 . 1 . . 1206 . . 560 ILE CB . 50220 1
347 . 1 . 1 160 160 ILE CG1 C 13 23.683 0.019 . 1 . . 1207 . . 560 ILE CG1 . 50220 1
348 . 1 . 1 160 160 ILE CG2 C 13 16.841 0.117 . 1 . . 134 . . 560 ILE CG2 . 50220 1
349 . 1 . 1 160 160 ILE CD1 C 13 13.268 0.099 . 1 . . 234 . . 560 ILE CD1 . 50220 1
350 . 1 . 1 162 162 VAL HG11 H 1 0.988 0.001 . 2 . . 93 . . 562 VAL HG11 . 50220 1
351 . 1 . 1 162 162 VAL HG12 H 1 0.988 0.001 . 2 . . 93 . . 562 VAL HG12 . 50220 1
352 . 1 . 1 162 162 VAL HG13 H 1 0.988 0.001 . 2 . . 93 . . 562 VAL HG13 . 50220 1
353 . 1 . 1 162 162 VAL HG21 H 1 0.668 0.001 . 2 . . 1079 . . 562 VAL HG21 . 50220 1
354 . 1 . 1 162 162 VAL HG22 H 1 0.668 0.001 . 2 . . 1079 . . 562 VAL HG22 . 50220 1
355 . 1 . 1 162 162 VAL HG23 H 1 0.668 0.001 . 2 . . 1079 . . 562 VAL HG23 . 50220 1
356 . 1 . 1 162 162 VAL CA C 13 60.629 0.03 . 1 . . 1259 . . 562 VAL CA . 50220 1
357 . 1 . 1 162 162 VAL CB C 13 35.892 0.001 . 1 . . 1258 . . 562 VAL CB . 50220 1
358 . 1 . 1 162 162 VAL CG1 C 13 21.704 0.136 . 2 . . 94 . . 562 VAL CG1 . 50220 1
359 . 1 . 1 162 162 VAL CG2 C 13 20.555 0.15 . 2 . . 1077 . . 562 VAL CG2 . 50220 1
360 . 1 . 1 164 164 ALA H H 1 8.605 . . 1 . . 1686 . . 564 ALA H . 50220 1
361 . 1 . 1 164 164 ALA HB1 H 1 1.186 0.032 . 1 . . 113 . . 564 ALA HB1 . 50220 1
362 . 1 . 1 164 164 ALA HB2 H 1 1.186 0.032 . 1 . . 113 . . 564 ALA HB2 . 50220 1
363 . 1 . 1 164 164 ALA HB3 H 1 1.186 0.032 . 1 . . 113 . . 564 ALA HB3 . 50220 1
364 . 1 . 1 164 164 ALA CA C 13 49.238 . . 1 . . 1230 . . 564 ALA CA . 50220 1
365 . 1 . 1 164 164 ALA CB C 13 23.039 0.042 . 1 . . 114 . . 564 ALA CB . 50220 1
366 . 1 . 1 174 174 VAL HG11 H 1 0.992 0.031 . 2 . . 207 . . 574 VAL HG11 . 50220 1
367 . 1 . 1 174 174 VAL HG12 H 1 0.992 0.031 . 2 . . 207 . . 574 VAL HG12 . 50220 1
368 . 1 . 1 174 174 VAL HG13 H 1 0.992 0.031 . 2 . . 207 . . 574 VAL HG13 . 50220 1
369 . 1 . 1 174 174 VAL HG21 H 1 0.969 0.034 . 2 . . 231 . . 574 VAL HG21 . 50220 1
370 . 1 . 1 174 174 VAL HG22 H 1 0.969 0.034 . 2 . . 231 . . 574 VAL HG22 . 50220 1
371 . 1 . 1 174 174 VAL HG23 H 1 0.969 0.034 . 2 . . 231 . . 574 VAL HG23 . 50220 1
372 . 1 . 1 174 174 VAL CA C 13 63.465 0.014 . 1 . . 1261 . . 574 VAL CA . 50220 1
373 . 1 . 1 174 174 VAL CB C 13 33.135 0.038 . 1 . . 1260 . . 574 VAL CB . 50220 1
374 . 1 . 1 174 174 VAL CG1 C 13 20.768 0.137 . 2 . . 208 . . 574 VAL CG1 . 50220 1
375 . 1 . 1 174 174 VAL CG2 C 13 20.525 0.138 . 2 . . 232 . . 574 VAL CG2 . 50220 1
376 . 1 . 1 183 183 ILE HG21 H 1 -0.064 0.03 . 1 . . 69 . . 583 ILE HG21 . 50220 1
377 . 1 . 1 183 183 ILE HG22 H 1 -0.064 0.03 . 1 . . 69 . . 583 ILE HG22 . 50220 1
378 . 1 . 1 183 183 ILE HG23 H 1 -0.064 0.03 . 1 . . 69 . . 583 ILE HG23 . 50220 1
379 . 1 . 1 183 183 ILE HD11 H 1 0.140 0.026 . 1 . . 129 . . 583 ILE HD11 . 50220 1
380 . 1 . 1 183 183 ILE HD12 H 1 0.140 0.026 . 1 . . 129 . . 583 ILE HD12 . 50220 1
381 . 1 . 1 183 183 ILE HD13 H 1 0.140 0.026 . 1 . . 129 . . 583 ILE HD13 . 50220 1
382 . 1 . 1 183 183 ILE CA C 13 63.985 0.009 . 1 . . 1194 . . 583 ILE CA . 50220 1
383 . 1 . 1 183 183 ILE CB C 13 36.191 0.048 . 1 . . 1195 . . 583 ILE CB . 50220 1
384 . 1 . 1 183 183 ILE CG1 C 13 27.248 0.035 . 1 . . 1196 . . 583 ILE CG1 . 50220 1
385 . 1 . 1 183 183 ILE CG2 C 13 15.933 0.11 . 1 . . 70 . . 583 ILE CG2 . 50220 1
386 . 1 . 1 183 183 ILE CD1 C 13 12.057 0.103 . 1 . . 130 . . 583 ILE CD1 . 50220 1
387 . 1 . 1 184 184 ALA H H 1 8.201 . . 1 . . 1688 . . 584 ALA H . 50220 1
388 . 1 . 1 184 184 ALA HB1 H 1 1.252 0.035 . 1 . . 3 . . 584 ALA HB1 . 50220 1
389 . 1 . 1 184 184 ALA HB2 H 1 1.252 0.035 . 1 . . 3 . . 584 ALA HB2 . 50220 1
390 . 1 . 1 184 184 ALA HB3 H 1 1.252 0.035 . 1 . . 3 . . 584 ALA HB3 . 50220 1
391 . 1 . 1 184 184 ALA CA C 13 55.517 . . 1 . . 1235 . . 584 ALA CA . 50220 1
392 . 1 . 1 184 184 ALA CB C 13 16.261 0.033 . 1 . . 4 . . 584 ALA CB . 50220 1
393 . 1 . 1 185 185 ALA H H 1 7.862 . . 1 . . 1677 . . 585 ALA H . 50220 1
394 . 1 . 1 185 185 ALA HB1 H 1 1.592 0.03 . 1 . . 1 . . 585 ALA HB1 . 50220 1
395 . 1 . 1 185 185 ALA HB2 H 1 1.592 0.03 . 1 . . 1 . . 585 ALA HB2 . 50220 1
396 . 1 . 1 185 185 ALA HB3 H 1 1.592 0.03 . 1 . . 1 . . 585 ALA HB3 . 50220 1
397 . 1 . 1 185 185 ALA CA C 13 55.032 . . 1 . . 1240 . . 585 ALA CA . 50220 1
398 . 1 . 1 185 185 ALA CB C 13 18.613 0.061 . 1 . . 2 . . 585 ALA CB . 50220 1
399 . 1 . 1 187 187 LEU HD11 H 1 0.869 0.001 . 2 . . 115 . . 587 LEU HD11 . 50220 1
400 . 1 . 1 187 187 LEU HD12 H 1 0.869 0.001 . 2 . . 115 . . 587 LEU HD12 . 50220 1
401 . 1 . 1 187 187 LEU HD13 H 1 0.869 0.001 . 2 . . 115 . . 587 LEU HD13 . 50220 1
402 . 1 . 1 187 187 LEU HD21 H 1 0.801 0.0 . 2 . . 173 . . 587 LEU HD21 . 50220 1
403 . 1 . 1 187 187 LEU HD22 H 1 0.801 0.0 . 2 . . 173 . . 587 LEU HD22 . 50220 1
404 . 1 . 1 187 187 LEU HD23 H 1 0.801 0.0 . 2 . . 173 . . 587 LEU HD23 . 50220 1
405 . 1 . 1 187 187 LEU CA C 13 57.240 0.019 . 1 . . 1542 . . 587 LEU CA . 50220 1
406 . 1 . 1 187 187 LEU CB C 13 39.833 0.002 . 1 . . 1541 . . 587 LEU CB . 50220 1
407 . 1 . 1 187 187 LEU CG C 13 25.881 0.038 . 1 . . 1543 . . 587 LEU CG . 50220 1
408 . 1 . 1 187 187 LEU CD1 C 13 23.199 0.027 . 2 . . 116 . . 587 LEU CD1 . 50220 1
409 . 1 . 1 187 187 LEU CD2 C 13 23.348 0.051 . 2 . . 174 . . 587 LEU CD2 . 50220 1
410 . 1 . 1 188 188 ALA H H 1 8.135 . . 1 . . 1680 . . 588 ALA H . 50220 1
411 . 1 . 1 188 188 ALA HB1 H 1 1.467 0.032 . 1 . . 5 . . 588 ALA HB1 . 50220 1
412 . 1 . 1 188 188 ALA HB2 H 1 1.467 0.032 . 1 . . 5 . . 588 ALA HB2 . 50220 1
413 . 1 . 1 188 188 ALA HB3 H 1 1.467 0.032 . 1 . . 5 . . 588 ALA HB3 . 50220 1
414 . 1 . 1 188 188 ALA CA C 13 54.184 . . 1 . . 1234 . . 588 ALA CA . 50220 1
415 . 1 . 1 188 188 ALA CB C 13 16.524 0.049 . 1 . . 6 . . 588 ALA CB . 50220 1
416 . 1 . 1 189 189 LEU HD11 H 1 0.635 0.003 . 1 . . 1318 . . 589 LEU HD11 . 50220 1
417 . 1 . 1 189 189 LEU HD12 H 1 0.635 0.003 . 1 . . 1318 . . 589 LEU HD12 . 50220 1
418 . 1 . 1 189 189 LEU HD13 H 1 0.635 0.003 . 1 . . 1318 . . 589 LEU HD13 . 50220 1
419 . 1 . 1 189 189 LEU CA C 13 56.963 . . 1 . . 1592 . . 589 LEU CA . 50220 1
420 . 1 . 1 189 189 LEU CD1 C 13 22.714 0.064 . 1 . . 1317 . . 589 LEU CD1 . 50220 1
421 . 1 . 1 192 192 ALA H H 1 8.457 . . 1 . . 1685 . . 592 ALA H . 50220 1
422 . 1 . 1 192 192 ALA HB1 H 1 1.036 0.031 . 1 . . 16 . . 592 ALA HB1 . 50220 1
423 . 1 . 1 192 192 ALA HB2 H 1 1.036 0.031 . 1 . . 16 . . 592 ALA HB2 . 50220 1
424 . 1 . 1 192 192 ALA HB3 H 1 1.036 0.031 . 1 . . 16 . . 592 ALA HB3 . 50220 1
425 . 1 . 1 192 192 ALA CA C 13 54.102 . . 1 . . 1242 . . 592 ALA CA . 50220 1
426 . 1 . 1 192 192 ALA CB C 13 17.842 0.036 . 1 . . 15 . . 592 ALA CB . 50220 1
427 . 1 . 1 193 193 ALA H H 1 7.967 . . 1 . . 1678 . . 593 ALA H . 50220 1
428 . 1 . 1 193 193 ALA HB1 H 1 1.428 0.036 . 1 . . 9 . . 593 ALA HB1 . 50220 1
429 . 1 . 1 193 193 ALA HB2 H 1 1.428 0.036 . 1 . . 9 . . 593 ALA HB2 . 50220 1
430 . 1 . 1 193 193 ALA HB3 H 1 1.428 0.036 . 1 . . 9 . . 593 ALA HB3 . 50220 1
431 . 1 . 1 193 193 ALA CA C 13 54.249 . . 1 . . 1679 . . 593 ALA CA . 50220 1
432 . 1 . 1 193 193 ALA CB C 13 17.597 0.031 . 1 . . 10 . . 593 ALA CB . 50220 1
433 . 1 . 1 199 199 VAL HG11 H 1 0.618 0.037 . 2 . . 99 . . 599 VAL HG11 . 50220 1
434 . 1 . 1 199 199 VAL HG12 H 1 0.618 0.037 . 2 . . 99 . . 599 VAL HG12 . 50220 1
435 . 1 . 1 199 199 VAL HG13 H 1 0.618 0.037 . 2 . . 99 . . 599 VAL HG13 . 50220 1
436 . 1 . 1 199 199 VAL HG21 H 1 0.809 0.009 . 2 . . 1372 . . 599 VAL HG21 . 50220 1
437 . 1 . 1 199 199 VAL HG22 H 1 0.809 0.009 . 2 . . 1372 . . 599 VAL HG22 . 50220 1
438 . 1 . 1 199 199 VAL HG23 H 1 0.809 0.009 . 2 . . 1372 . . 599 VAL HG23 . 50220 1
439 . 1 . 1 199 199 VAL CA C 13 58.373 . . 1 . . 1360 . . 599 VAL CA . 50220 1
440 . 1 . 1 199 199 VAL CB C 13 35.529 0.011 . 1 . . 1359 . . 599 VAL CB . 50220 1
441 . 1 . 1 199 199 VAL CG1 C 13 17.480 0.116 . 2 . . 100 . . 599 VAL CG1 . 50220 1
442 . 1 . 1 199 199 VAL CG2 C 13 21.111 0.073 . 2 . . 1371 . . 599 VAL CG2 . 50220 1
443 . 1 . 1 200 200 ILE HG21 H 1 0.752 0.027 . 1 . . 1094 . . 600 ILE HG21 . 50220 1
444 . 1 . 1 200 200 ILE HG22 H 1 0.752 0.027 . 1 . . 1094 . . 600 ILE HG22 . 50220 1
445 . 1 . 1 200 200 ILE HG23 H 1 0.752 0.027 . 1 . . 1094 . . 600 ILE HG23 . 50220 1
446 . 1 . 1 200 200 ILE HD11 H 1 0.675 0.028 . 1 . . 163 . . 600 ILE HD11 . 50220 1
447 . 1 . 1 200 200 ILE HD12 H 1 0.675 0.028 . 1 . . 163 . . 600 ILE HD12 . 50220 1
448 . 1 . 1 200 200 ILE HD13 H 1 0.675 0.028 . 1 . . 163 . . 600 ILE HD13 . 50220 1
449 . 1 . 1 200 200 ILE CA C 13 59.720 0.047 . 1 . . 1210 . . 600 ILE CA . 50220 1
450 . 1 . 1 200 200 ILE CB C 13 37.602 0.027 . 1 . . 1209 . . 600 ILE CB . 50220 1
451 . 1 . 1 200 200 ILE CG1 C 13 27.153 0.108 . 1 . . 1208 . . 600 ILE CG1 . 50220 1
452 . 1 . 1 200 200 ILE CG2 C 13 17.323 0.024 . 1 . . 1225 . . 600 ILE CG2 . 50220 1
453 . 1 . 1 200 200 ILE CD1 C 13 12.825 0.102 . 1 . . 164 . . 600 ILE CD1 . 50220 1
454 . 1 . 1 201 201 LEU HD11 H 1 0.605 0.004 . 2 . . 213 . . 601 LEU HD11 . 50220 1
455 . 1 . 1 201 201 LEU HD12 H 1 0.605 0.004 . 2 . . 213 . . 601 LEU HD12 . 50220 1
456 . 1 . 1 201 201 LEU HD13 H 1 0.605 0.004 . 2 . . 213 . . 601 LEU HD13 . 50220 1
457 . 1 . 1 201 201 LEU HD21 H 1 0.555 0.038 . 2 . . 1304 . . 601 LEU HD21 . 50220 1
458 . 1 . 1 201 201 LEU HD22 H 1 0.555 0.038 . 2 . . 1304 . . 601 LEU HD22 . 50220 1
459 . 1 . 1 201 201 LEU HD23 H 1 0.555 0.038 . 2 . . 1304 . . 601 LEU HD23 . 50220 1
460 . 1 . 1 201 201 LEU CB C 13 45.135 0.048 . 1 . . 1282 . . 601 LEU CB . 50220 1
461 . 1 . 1 201 201 LEU CD1 C 13 23.768 0.025 . 2 . . 214 . . 601 LEU CD1 . 50220 1
462 . 1 . 1 201 201 LEU CD2 C 13 24.342 0.037 . 2 . . 1303 . . 601 LEU CD2 . 50220 1
463 . 1 . 1 207 207 VAL HG11 H 1 0.746 0.029 . 1 . . 203 . . 607 VAL HG11 . 50220 1
464 . 1 . 1 207 207 VAL HG12 H 1 0.746 0.029 . 1 . . 203 . . 607 VAL HG12 . 50220 1
465 . 1 . 1 207 207 VAL HG13 H 1 0.746 0.029 . 1 . . 203 . . 607 VAL HG13 . 50220 1
466 . 1 . 1 207 207 VAL CA C 13 60.209 . . 1 . . 1289 . . 607 VAL CA . 50220 1
467 . 1 . 1 207 207 VAL CB C 13 33.459 . . 1 . . 1288 . . 607 VAL CB . 50220 1
468 . 1 . 1 207 207 VAL CG1 C 13 20.167 0.15 . 1 . . 204 . . 607 VAL CG1 . 50220 1
469 . 1 . 1 209 209 ILE HG21 H 1 0.972 0.03 . 1 . . 137 . . 609 ILE HG21 . 50220 1
470 . 1 . 1 209 209 ILE HG22 H 1 0.972 0.03 . 1 . . 137 . . 609 ILE HG22 . 50220 1
471 . 1 . 1 209 209 ILE HG23 H 1 0.972 0.03 . 1 . . 137 . . 609 ILE HG23 . 50220 1
472 . 1 . 1 209 209 ILE HD11 H 1 0.487 0.024 . 1 . . 151 . . 609 ILE HD11 . 50220 1
473 . 1 . 1 209 209 ILE HD12 H 1 0.487 0.024 . 1 . . 151 . . 609 ILE HD12 . 50220 1
474 . 1 . 1 209 209 ILE HD13 H 1 0.487 0.024 . 1 . . 151 . . 609 ILE HD13 . 50220 1
475 . 1 . 1 209 209 ILE CA C 13 60.107 0.059 . 1 . . 1202 . . 609 ILE CA . 50220 1
476 . 1 . 1 209 209 ILE CB C 13 40.942 0.042 . 1 . . 1203 . . 609 ILE CB . 50220 1
477 . 1 . 1 209 209 ILE CG1 C 13 27.403 0.022 . 1 . . 1204 . . 609 ILE CG1 . 50220 1
478 . 1 . 1 209 209 ILE CG2 C 13 19.625 0.15 . 1 . . 138 . . 609 ILE CG2 . 50220 1
479 . 1 . 1 209 209 ILE CD1 C 13 14.301 0.132 . 1 . . 152 . . 609 ILE CD1 . 50220 1
480 . 1 . 1 219 219 ILE HG21 H 1 0.765 0.031 . 1 . . 77 . . 619 ILE HG21 . 50220 1
481 . 1 . 1 219 219 ILE HG22 H 1 0.765 0.031 . 1 . . 77 . . 619 ILE HG22 . 50220 1
482 . 1 . 1 219 219 ILE HG23 H 1 0.765 0.031 . 1 . . 77 . . 619 ILE HG23 . 50220 1
483 . 1 . 1 219 219 ILE HD11 H 1 0.585 0.03 . 1 . . 157 . . 619 ILE HD11 . 50220 1
484 . 1 . 1 219 219 ILE HD12 H 1 0.585 0.03 . 1 . . 157 . . 619 ILE HD12 . 50220 1
485 . 1 . 1 219 219 ILE HD13 H 1 0.585 0.03 . 1 . . 157 . . 619 ILE HD13 . 50220 1
486 . 1 . 1 219 219 ILE CA C 13 61.510 0.038 . 1 . . 1181 . . 619 ILE CA . 50220 1
487 . 1 . 1 219 219 ILE CB C 13 34.936 0.013 . 1 . . 1180 . . 619 ILE CB . 50220 1
488 . 1 . 1 219 219 ILE CG1 C 13 27.380 . . 1 . . 1179 . . 619 ILE CG1 . 50220 1
489 . 1 . 1 219 219 ILE CG2 C 13 17.430 0.118 . 1 . . 78 . . 619 ILE CG2 . 50220 1
490 . 1 . 1 219 219 ILE CD1 C 13 10.299 0.065 . 1 . . 158 . . 619 ILE CD1 . 50220 1
491 . 1 . 1 223 223 VAL HG11 H 1 0.725 0.035 . 2 . . 103 . . 623 VAL HG11 . 50220 1
492 . 1 . 1 223 223 VAL HG12 H 1 0.725 0.035 . 2 . . 103 . . 623 VAL HG12 . 50220 1
493 . 1 . 1 223 223 VAL HG13 H 1 0.725 0.035 . 2 . . 103 . . 623 VAL HG13 . 50220 1
494 . 1 . 1 223 223 VAL HG21 H 1 0.489 0.003 . 2 . . 1262 . . 623 VAL HG21 . 50220 1
495 . 1 . 1 223 223 VAL HG22 H 1 0.489 0.003 . 2 . . 1262 . . 623 VAL HG22 . 50220 1
496 . 1 . 1 223 223 VAL HG23 H 1 0.489 0.003 . 2 . . 1262 . . 623 VAL HG23 . 50220 1
497 . 1 . 1 223 223 VAL CA C 13 67.042 0.013 . 1 . . 1265 . . 623 VAL CA . 50220 1
498 . 1 . 1 223 223 VAL CB C 13 29.966 . . 1 . . 1264 . . 623 VAL CB . 50220 1
499 . 1 . 1 223 223 VAL CG1 C 13 21.959 0.096 . 2 . . 104 . . 623 VAL CG1 . 50220 1
500 . 1 . 1 223 223 VAL CG2 C 13 20.811 0.027 . 2 . . 1263 . . 623 VAL CG2 . 50220 1
501 . 1 . 1 224 224 THR HG21 H 1 1.235 0.0 . 1 . . 45 . . 624 THR HG21 . 50220 1
502 . 1 . 1 224 224 THR HG22 H 1 1.235 0.0 . 1 . . 45 . . 624 THR HG22 . 50220 1
503 . 1 . 1 224 224 THR HG23 H 1 1.235 0.0 . 1 . . 45 . . 624 THR HG23 . 50220 1
504 . 1 . 1 224 224 THR CA C 13 65.591 . . 1 . . 1353 . . 624 THR CA . 50220 1
505 . 1 . 1 224 224 THR CB C 13 67.871 . . 1 . . 1354 . . 624 THR CB . 50220 1
506 . 1 . 1 224 224 THR CG2 C 13 21.004 0.023 . 1 . . 46 . . 624 THR CG2 . 50220 1
507 . 1 . 1 230 230 VAL HG11 H 1 0.345 0.032 . 1 . . 181 . . 630 VAL HG11 . 50220 1
508 . 1 . 1 230 230 VAL HG12 H 1 0.345 0.032 . 1 . . 181 . . 630 VAL HG12 . 50220 1
509 . 1 . 1 230 230 VAL HG13 H 1 0.345 0.032 . 1 . . 181 . . 630 VAL HG13 . 50220 1
510 . 1 . 1 230 230 VAL CA C 13 62.177 . . 1 . . 1326 . . 630 VAL CA . 50220 1
511 . 1 . 1 230 230 VAL CB C 13 31.708 . . 1 . . 1327 . . 630 VAL CB . 50220 1
512 . 1 . 1 230 230 VAL CG1 C 13 20.406 0.114 . 1 . . 182 . . 630 VAL CG1 . 50220 1
513 . 1 . 1 239 239 ALA H H 1 7.957 . . 1 . . 1684 . . 639 ALA H . 50220 1
514 . 1 . 1 239 239 ALA HB1 H 1 1.318 0.033 . 1 . . 24 . . 639 ALA HB1 . 50220 1
515 . 1 . 1 239 239 ALA HB2 H 1 1.318 0.033 . 1 . . 24 . . 639 ALA HB2 . 50220 1
516 . 1 . 1 239 239 ALA HB3 H 1 1.318 0.033 . 1 . . 24 . . 639 ALA HB3 . 50220 1
517 . 1 . 1 239 239 ALA CA C 13 50.282 . . 1 . . 1237 . . 639 ALA CA . 50220 1
518 . 1 . 1 239 239 ALA CB C 13 20.828 0.033 . 1 . . 23 . . 639 ALA CB . 50220 1
519 . 1 . 1 241 241 VAL HG11 H 1 0.717 0.032 . 1 . . 209 . . 641 VAL HG11 . 50220 1
520 . 1 . 1 241 241 VAL HG12 H 1 0.717 0.032 . 1 . . 209 . . 641 VAL HG12 . 50220 1
521 . 1 . 1 241 241 VAL HG13 H 1 0.717 0.032 . 1 . . 209 . . 641 VAL HG13 . 50220 1
522 . 1 . 1 241 241 VAL CA C 13 60.001 . . 1 . . 1292 . . 641 VAL CA . 50220 1
523 . 1 . 1 241 241 VAL CB C 13 32.461 . . 1 . . 1293 . . 641 VAL CB . 50220 1
524 . 1 . 1 241 241 VAL CG1 C 13 20.551 0.111 . 1 . . 210 . . 641 VAL CG1 . 50220 1
525 . 1 . 1 244 244 ALA H H 1 9.303 . . 1 . . 1675 . . 644 ALA H . 50220 1
526 . 1 . 1 244 244 ALA HB1 H 1 0.978 0.035 . 1 . . 26 . . 644 ALA HB1 . 50220 1
527 . 1 . 1 244 244 ALA HB2 H 1 0.978 0.035 . 1 . . 26 . . 644 ALA HB2 . 50220 1
528 . 1 . 1 244 244 ALA HB3 H 1 0.978 0.035 . 1 . . 26 . . 644 ALA HB3 . 50220 1
529 . 1 . 1 244 244 ALA CA C 13 49.518 . . 1 . . 1232 . . 644 ALA CA . 50220 1
530 . 1 . 1 244 244 ALA CB C 13 22.653 0.015 . 1 . . 25 . . 644 ALA CB . 50220 1
531 . 1 . 1 246 246 VAL HG11 H 1 0.529 0.037 . 1 . . 135 . . 646 VAL HG11 . 50220 1
532 . 1 . 1 246 246 VAL HG12 H 1 0.529 0.037 . 1 . . 135 . . 646 VAL HG12 . 50220 1
533 . 1 . 1 246 246 VAL HG13 H 1 0.529 0.037 . 1 . . 135 . . 646 VAL HG13 . 50220 1
534 . 1 . 1 246 246 VAL CA C 13 58.035 . . 1 . . 1256 . . 646 VAL CA . 50220 1
535 . 1 . 1 246 246 VAL CB C 13 36.571 . . 1 . . 1257 . . 646 VAL CB . 50220 1
536 . 1 . 1 246 246 VAL CG1 C 13 20.557 0.144 . 1 . . 136 . . 646 VAL CG1 . 50220 1
537 . 1 . 1 255 255 ALA H H 1 8.755 . . 1 . . 1698 . . 655 ALA H . 50220 1
538 . 1 . 1 255 255 ALA HB1 H 1 1.596 0.035 . 1 . . 7 . . 655 ALA HB1 . 50220 1
539 . 1 . 1 255 255 ALA HB2 H 1 1.596 0.035 . 1 . . 7 . . 655 ALA HB2 . 50220 1
540 . 1 . 1 255 255 ALA HB3 H 1 1.596 0.035 . 1 . . 7 . . 655 ALA HB3 . 50220 1
541 . 1 . 1 255 255 ALA CA C 13 55.076 . . 1 . . 1243 . . 655 ALA CA . 50220 1
542 . 1 . 1 255 255 ALA CB C 13 17.463 0.055 . 1 . . 8 . . 655 ALA CB . 50220 1
543 . 1 . 1 256 256 THR HG21 H 1 1.108 0.001 . 1 . . 51 . . 656 THR HG21 . 50220 1
544 . 1 . 1 256 256 THR HG22 H 1 1.108 0.001 . 1 . . 51 . . 656 THR HG22 . 50220 1
545 . 1 . 1 256 256 THR HG23 H 1 1.108 0.001 . 1 . . 51 . . 656 THR HG23 . 50220 1
546 . 1 . 1 256 256 THR CA C 13 65.262 . . 1 . . 1295 . . 656 THR CA . 50220 1
547 . 1 . 1 256 256 THR CB C 13 67.810 . . 1 . . 1296 . . 656 THR CB . 50220 1
548 . 1 . 1 256 256 THR CG2 C 13 20.943 0.025 . 1 . . 52 . . 656 THR CG2 . 50220 1
549 . 1 . 1 258 258 LEU HD11 H 1 0.505 0.001 . 1 . . 1306 . . 658 LEU HD11 . 50220 1
550 . 1 . 1 258 258 LEU HD12 H 1 0.505 0.001 . 1 . . 1306 . . 658 LEU HD12 . 50220 1
551 . 1 . 1 258 258 LEU HD13 H 1 0.505 0.001 . 1 . . 1306 . . 658 LEU HD13 . 50220 1
552 . 1 . 1 258 258 LEU CA C 13 56.727 . . 1 . . 1307 . . 658 LEU CA . 50220 1
553 . 1 . 1 258 258 LEU CB C 13 39.823 . . 1 . . 1308 . . 658 LEU CB . 50220 1
554 . 1 . 1 258 258 LEU CG C 13 25.529 . . 1 . . 1309 . . 658 LEU CG . 50220 1
555 . 1 . 1 258 258 LEU CD1 C 13 23.108 0.038 . 1 . . 1305 . . 658 LEU CD1 . 50220 1
556 . 1 . 1 262 262 THR HG21 H 1 0.794 0.0 . 1 . . 61 . . 662 THR HG21 . 50220 1
557 . 1 . 1 262 262 THR HG22 H 1 0.794 0.0 . 1 . . 61 . . 662 THR HG22 . 50220 1
558 . 1 . 1 262 262 THR HG23 H 1 0.794 0.0 . 1 . . 61 . . 662 THR HG23 . 50220 1
559 . 1 . 1 262 262 THR CA C 13 69.256 . . 1 . . 1339 . . 662 THR CA . 50220 1
560 . 1 . 1 262 262 THR CG2 C 13 21.133 0.042 . 1 . . 62 . . 662 THR CG2 . 50220 1
561 . 1 . 1 267 267 THR HG21 H 1 1.062 0.0 . 1 . . 55 . . 667 THR HG21 . 50220 1
562 . 1 . 1 267 267 THR HG22 H 1 1.062 0.0 . 1 . . 55 . . 667 THR HG22 . 50220 1
563 . 1 . 1 267 267 THR HG23 H 1 1.062 0.0 . 1 . . 55 . . 667 THR HG23 . 50220 1
564 . 1 . 1 267 267 THR CA C 13 60.015 . . 1 . . 1352 . . 667 THR CA . 50220 1
565 . 1 . 1 267 267 THR CG2 C 13 20.421 0.016 . 1 . . 56 . . 667 THR CG2 . 50220 1
566 . 1 . 1 269 269 THR HG21 H 1 1.010 0.001 . 1 . . 59 . . 669 THR HG21 . 50220 1
567 . 1 . 1 269 269 THR HG22 H 1 1.010 0.001 . 1 . . 59 . . 669 THR HG22 . 50220 1
568 . 1 . 1 269 269 THR HG23 H 1 1.010 0.001 . 1 . . 59 . . 669 THR HG23 . 50220 1
569 . 1 . 1 269 269 THR CA C 13 59.788 . . 1 . . 1351 . . 669 THR CA . 50220 1
570 . 1 . 1 269 269 THR CG2 C 13 20.497 0.012 . 1 . . 60 . . 669 THR CG2 . 50220 1
571 . 1 . 1 276 276 ALA H H 1 8.971 . . 1 . . 1676 . . 676 ALA H . 50220 1
572 . 1 . 1 276 276 ALA HB1 H 1 1.518 0.03 . 1 . . 32 . . 676 ALA HB1 . 50220 1
573 . 1 . 1 276 276 ALA HB2 H 1 1.518 0.03 . 1 . . 32 . . 676 ALA HB2 . 50220 1
574 . 1 . 1 276 276 ALA HB3 H 1 1.518 0.03 . 1 . . 32 . . 676 ALA HB3 . 50220 1
575 . 1 . 1 276 276 ALA CA C 13 49.853 . . 1 . . 1229 . . 676 ALA CA . 50220 1
576 . 1 . 1 276 276 ALA CB C 13 23.395 0.028 . 1 . . 31 . . 676 ALA CB . 50220 1
577 . 1 . 1 278 278 VAL HG11 H 1 0.902 0.033 . 2 . . 101 . . 678 VAL HG11 . 50220 1
578 . 1 . 1 278 278 VAL HG12 H 1 0.902 0.033 . 2 . . 101 . . 678 VAL HG12 . 50220 1
579 . 1 . 1 278 278 VAL HG13 H 1 0.902 0.033 . 2 . . 101 . . 678 VAL HG13 . 50220 1
580 . 1 . 1 278 278 VAL HG21 H 1 0.941 0.001 . 2 . . 1366 . . 678 VAL HG21 . 50220 1
581 . 1 . 1 278 278 VAL HG22 H 1 0.941 0.001 . 2 . . 1366 . . 678 VAL HG22 . 50220 1
582 . 1 . 1 278 278 VAL HG23 H 1 0.941 0.001 . 2 . . 1366 . . 678 VAL HG23 . 50220 1
583 . 1 . 1 278 278 VAL CA C 13 59.558 0.06 . 1 . . 1356 . . 678 VAL CA . 50220 1
584 . 1 . 1 278 278 VAL CB C 13 31.481 0.043 . 1 . . 1355 . . 678 VAL CB . 50220 1
585 . 1 . 1 278 278 VAL CG1 C 13 21.515 0.129 . 2 . . 102 . . 678 VAL CG1 . 50220 1
586 . 1 . 1 278 278 VAL CG2 C 13 20.937 0.018 . 2 . . 1367 . . 678 VAL CG2 . 50220 1
587 . 1 . 1 282 282 ILE HG21 H 1 0.839 0.031 . 1 . . 223 . . 682 ILE HG21 . 50220 1
588 . 1 . 1 282 282 ILE HG22 H 1 0.839 0.031 . 1 . . 223 . . 682 ILE HG22 . 50220 1
589 . 1 . 1 282 282 ILE HG23 H 1 0.839 0.031 . 1 . . 223 . . 682 ILE HG23 . 50220 1
590 . 1 . 1 282 282 ILE HD11 H 1 0.782 0.034 . 1 . . 125 . . 682 ILE HD11 . 50220 1
591 . 1 . 1 282 282 ILE HD12 H 1 0.782 0.034 . 1 . . 125 . . 682 ILE HD12 . 50220 1
592 . 1 . 1 282 282 ILE HD13 H 1 0.782 0.034 . 1 . . 125 . . 682 ILE HD13 . 50220 1
593 . 1 . 1 282 282 ILE CA C 13 62.800 0.004 . 1 . . 1200 . . 682 ILE CA . 50220 1
594 . 1 . 1 282 282 ILE CB C 13 36.914 0.059 . 1 . . 1199 . . 682 ILE CB . 50220 1
595 . 1 . 1 282 282 ILE CG1 C 13 27.210 0.01 . 1 . . 1201 . . 682 ILE CG1 . 50220 1
596 . 1 . 1 282 282 ILE CG2 C 13 16.070 0.112 . 1 . . 224 . . 682 ILE CG2 . 50220 1
597 . 1 . 1 282 282 ILE CD1 C 13 11.119 0.109 . 1 . . 126 . . 682 ILE CD1 . 50220 1
598 . 1 . 1 283 283 ALA H H 1 8.270 . . 1 . . 1696 . . 683 ALA H . 50220 1
599 . 1 . 1 283 283 ALA HB1 H 1 1.381 0.032 . 1 . . 1695 . . 683 ALA HB1 . 50220 1
600 . 1 . 1 283 283 ALA HB2 H 1 1.381 0.032 . 1 . . 1695 . . 683 ALA HB2 . 50220 1
601 . 1 . 1 283 283 ALA HB3 H 1 1.381 0.032 . 1 . . 1695 . . 683 ALA HB3 . 50220 1
602 . 1 . 1 283 283 ALA CA C 13 54.819 . . 1 . . 1697 . . 683 ALA CA . 50220 1
603 . 1 . 1 283 283 ALA CB C 13 17.536 0.039 . 1 . . 1694 . . 683 ALA CB . 50220 1
604 . 1 . 1 286 286 ILE HG21 H 1 0.661 0.033 . 1 . . 217 . . 686 ILE HG21 . 50220 1
605 . 1 . 1 286 286 ILE HG22 H 1 0.661 0.033 . 1 . . 217 . . 686 ILE HG22 . 50220 1
606 . 1 . 1 286 286 ILE HG23 H 1 0.661 0.033 . 1 . . 217 . . 686 ILE HG23 . 50220 1
607 . 1 . 1 286 286 ILE HD11 H 1 0.216 0.026 . 1 . . 149 . . 686 ILE HD11 . 50220 1
608 . 1 . 1 286 286 ILE HD12 H 1 0.216 0.026 . 1 . . 149 . . 686 ILE HD12 . 50220 1
609 . 1 . 1 286 286 ILE HD13 H 1 0.216 0.026 . 1 . . 149 . . 686 ILE HD13 . 50220 1
610 . 1 . 1 286 286 ILE CA C 13 64.876 0.155 . 1 . . 1186 . . 686 ILE CA . 50220 1
611 . 1 . 1 286 286 ILE CB C 13 37.575 0.003 . 1 . . 1185 . . 686 ILE CB . 50220 1
612 . 1 . 1 286 286 ILE CG1 C 13 27.329 . . 1 . . 1187 . . 686 ILE CG1 . 50220 1
613 . 1 . 1 286 286 ILE CG2 C 13 16.855 0.12 . 1 . . 218 . . 686 ILE CG2 . 50220 1
614 . 1 . 1 286 286 ILE CD1 C 13 12.992 0.103 . 1 . . 150 . . 686 ILE CD1 . 50220 1
615 . 1 . 1 287 287 ILE HG21 H 1 0.838 0.034 . 1 . . 75 . . 687 ILE HG21 . 50220 1
616 . 1 . 1 287 287 ILE HG22 H 1 0.838 0.034 . 1 . . 75 . . 687 ILE HG22 . 50220 1
617 . 1 . 1 287 287 ILE HG23 H 1 0.838 0.034 . 1 . . 75 . . 687 ILE HG23 . 50220 1
618 . 1 . 1 287 287 ILE HD11 H 1 0.739 0.026 . 1 . . 167 . . 687 ILE HD11 . 50220 1
619 . 1 . 1 287 287 ILE HD12 H 1 0.739 0.026 . 1 . . 167 . . 687 ILE HD12 . 50220 1
620 . 1 . 1 287 287 ILE HD13 H 1 0.739 0.026 . 1 . . 167 . . 687 ILE HD13 . 50220 1
621 . 1 . 1 287 287 ILE CA C 13 65.086 0.001 . 1 . . 1189 . . 687 ILE CA . 50220 1
622 . 1 . 1 287 287 ILE CB C 13 37.627 0.03 . 1 . . 1188 . . 687 ILE CB . 50220 1
623 . 1 . 1 287 287 ILE CG1 C 13 28.671 . . 1 . . 1190 . . 687 ILE CG1 . 50220 1
624 . 1 . 1 287 287 ILE CG2 C 13 16.380 0.122 . 1 . . 76 . . 687 ILE CG2 . 50220 1
625 . 1 . 1 287 287 ILE CD1 C 13 13.047 0.121 . 1 . . 168 . . 687 ILE CD1 . 50220 1
stop_
save_