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 51825
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name Tsa1_WT_Red_ss_CS
_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 hNH' . . . 51825 1
2 '3D hCONH' . . . 51825 1
3 '3D hCOcaNH_horror' . . . 51825 1
4 '3D hCANH' . . . 51825 1
5 '3D hCAcoNH_BSH-CP' . . . 51825 1
6 '3D hcaCBcaNH_noD' . . . 51825 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 . . 51825 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 5 5 VAL H H 1 9.212704028 0.01188923073 . . . . . . . 5 VAL H . 51825 1
2 . 1 . 1 5 5 VAL C C 13 174.9792432 0 . . . . . . . 5 VAL C . 51825 1
3 . 1 . 1 5 5 VAL CA C 13 65.51813125 0 . . . . . . . 5 VAL CA . 51825 1
4 . 1 . 1 5 5 VAL CB C 13 30.63109597 0 . . . . . . . 5 VAL CB . 51825 1
5 . 1 . 1 5 5 VAL N N 15 124.2883295 0.05739450038 . . . . . . . 5 VAL N . 51825 1
6 . 1 . 1 6 6 GLN H H 1 8.710163735 0.01102612781 . . . . . . . 6 GLN H . 51825 1
7 . 1 . 1 6 6 GLN C C 13 174.4324268 0 . . . . . . . 6 GLN C . 51825 1
8 . 1 . 1 6 6 GLN CA C 13 60.35797669 0 . . . . . . . 6 GLN CA . 51825 1
9 . 1 . 1 6 6 GLN CB C 13 28.30221914 0 . . . . . . . 6 GLN CB . 51825 1
10 . 1 . 1 6 6 GLN N N 15 113.9509426 0.03629444486 . . . . . . . 6 GLN N . 51825 1
11 . 1 . 1 7 7 LYS H H 1 7.943106874 0.0104493808 . . . . . . . 7 LYS H . 51825 1
12 . 1 . 1 7 7 LYS C C 13 175.3176505 0 . . . . . . . 7 LYS C . 51825 1
13 . 1 . 1 7 7 LYS CA C 13 54.34577478 0 . . . . . . . 7 LYS CA . 51825 1
14 . 1 . 1 7 7 LYS CB C 13 34.0599494 0 . . . . . . . 7 LYS CB . 51825 1
15 . 1 . 1 7 7 LYS N N 15 118.8892799 0.04542547777 . . . . . . . 7 LYS N . 51825 1
16 . 1 . 1 8 8 GLN H H 1 8.480759375 0.0106857251 . . . . . . . 8 GLN H . 51825 1
17 . 1 . 1 8 8 GLN C C 13 176.2723488 0 . . . . . . . 8 GLN C . 51825 1
18 . 1 . 1 8 8 GLN CA C 13 56.55051069 0 . . . . . . . 8 GLN CA . 51825 1
19 . 1 . 1 8 8 GLN CB C 13 28.91855578 0 . . . . . . . 8 GLN CB . 51825 1
20 . 1 . 1 8 8 GLN N N 15 119.504897 0.0443546504 . . . . . . . 8 GLN N . 51825 1
21 . 1 . 1 9 9 ALA H H 1 9.439743419 0.0155931805 . . . . . . . 9 ALA H . 51825 1
22 . 1 . 1 9 9 ALA C C 13 174.793921 0 . . . . . . . 9 ALA C . 51825 1
23 . 1 . 1 9 9 ALA CA C 13 50.954272 0 . . . . . . . 9 ALA CA . 51825 1
24 . 1 . 1 9 9 ALA CB C 13 17.91837567 0 . . . . . . . 9 ALA CB . 51825 1
25 . 1 . 1 9 9 ALA N N 15 130.8621497 0.02725585526 . . . . . . . 9 ALA N . 51825 1
26 . 1 . 1 11 11 THR H H 1 8.106575709 0.008807573836 . . . . . . . 11 THR H . 51825 1
27 . 1 . 1 11 11 THR C C 13 173.1483991 0 . . . . . . . 11 THR C . 51825 1
28 . 1 . 1 11 11 THR CA C 13 62.72260379 0 . . . . . . . 11 THR CA . 51825 1
29 . 1 . 1 11 11 THR CB C 13 70.37510961 0 . . . . . . . 11 THR CB . 51825 1
30 . 1 . 1 11 11 THR N N 15 116.3007432 0.06325547385 . . . . . . . 11 THR N . 51825 1
31 . 1 . 1 12 12 PHE H H 1 7.116784551 0.00864193869 . . . . . . . 12 PHE H . 51825 1
32 . 1 . 1 12 12 PHE C C 13 172.7703276 0 . . . . . . . 12 PHE C . 51825 1
33 . 1 . 1 12 12 PHE CA C 13 56.50956489 0 . . . . . . . 12 PHE CA . 51825 1
34 . 1 . 1 12 12 PHE CB C 13 42.84523988 0 . . . . . . . 12 PHE CB . 51825 1
35 . 1 . 1 12 12 PHE N N 15 113.8766612 0.01676989897 . . . . . . . 12 PHE N . 51825 1
36 . 1 . 1 13 13 LYS H H 1 8.697951181 0.01156035428 . . . . . . . 13 LYS H . 51825 1
37 . 1 . 1 13 13 LYS C C 13 174.5865928 0 . . . . . . . 13 LYS C . 51825 1
38 . 1 . 1 13 13 LYS CA C 13 57.61316112 0 . . . . . . . 13 LYS CA . 51825 1
39 . 1 . 1 13 13 LYS CB C 13 33.93731013 0 . . . . . . . 13 LYS CB . 51825 1
40 . 1 . 1 13 13 LYS N N 15 121.1001254 0.1257925145 . . . . . . . 13 LYS N . 51825 1
41 . 1 . 1 14 14 LYS H H 1 8.838765549 0.01139882722 . . . . . . . 14 LYS H . 51825 1
42 . 1 . 1 14 14 LYS C C 13 174.5981145 0 . . . . . . . 14 LYS C . 51825 1
43 . 1 . 1 14 14 LYS CA C 13 53.07858682 0 . . . . . . . 14 LYS CA . 51825 1
44 . 1 . 1 14 14 LYS CB C 13 37.61133255 0 . . . . . . . 14 LYS CB . 51825 1
45 . 1 . 1 14 14 LYS N N 15 123.7091278 0.0603051642 . . . . . . . 14 LYS N . 51825 1
46 . 1 . 1 15 15 THR H H 1 8.950000689 0.004303525922 . . . . . . . 15 THR H . 51825 1
47 . 1 . 1 15 15 THR C C 13 170.7224925 0.01696064543 . . . . . . . 15 THR C . 51825 1
48 . 1 . 1 15 15 THR CA C 13 64.98552775 0 . . . . . . . 15 THR CA . 51825 1
49 . 1 . 1 15 15 THR CB C 13 69.03712637 0 . . . . . . . 15 THR CB . 51825 1
50 . 1 . 1 15 15 THR N N 15 120.2934293 0.06187701434 . . . . . . . 15 THR N . 51825 1
51 . 1 . 1 16 16 ALA H H 1 9.022226363 0.01624494087 . . . . . . . 16 ALA H . 51825 1
52 . 1 . 1 16 16 ALA C C 13 175.1277687 0 . . . . . . . 16 ALA C . 51825 1
53 . 1 . 1 16 16 ALA CA C 13 49.68565632 0.01224480521 . . . . . . . 16 ALA CA . 51825 1
54 . 1 . 1 16 16 ALA CB C 13 25.27475485 0 . . . . . . . 16 ALA CB . 51825 1
55 . 1 . 1 16 16 ALA N N 15 127.1640771 0.0635810506 . . . . . . . 16 ALA N . 51825 1
56 . 1 . 1 17 17 VAL H H 1 9.082746771 0.01195556161 . . . . . . . 17 VAL H . 51825 1
57 . 1 . 1 17 17 VAL C C 13 176.1364349 0 . . . . . . . 17 VAL C . 51825 1
58 . 1 . 1 17 17 VAL CA C 13 62.68316039 0 . . . . . . . 17 VAL CA . 51825 1
59 . 1 . 1 17 17 VAL CB C 13 32.67247172 0 . . . . . . . 17 VAL CB . 51825 1
60 . 1 . 1 17 17 VAL N N 15 119.5519262 0.01130142123 . . . . . . . 17 VAL N . 51825 1
61 . 1 . 1 18 18 VAL H H 1 9.357170727 0.01310473027 . . . . . . . 18 VAL H . 51825 1
62 . 1 . 1 18 18 VAL C C 13 174.0680188 0 . . . . . . . 18 VAL C . 51825 1
63 . 1 . 1 18 18 VAL CA C 13 62.34861924 0 . . . . . . . 18 VAL CA . 51825 1
64 . 1 . 1 18 18 VAL CB C 13 34.55205346 0 . . . . . . . 18 VAL CB . 51825 1
65 . 1 . 1 18 18 VAL N N 15 129.8981992 0.041313589 . . . . . . . 18 VAL N . 51825 1
66 . 1 . 1 19 19 ASP H H 1 9.188590067 0.01460309577 . . . . . . . 19 ASP H . 51825 1
67 . 1 . 1 19 19 ASP C C 13 175.5683534 0 . . . . . . . 19 ASP C . 51825 1
68 . 1 . 1 19 19 ASP CA C 13 56.02459504 0 . . . . . . . 19 ASP CA . 51825 1
69 . 1 . 1 19 19 ASP CB C 13 40.18012053 0 . . . . . . . 19 ASP CB . 51825 1
70 . 1 . 1 19 19 ASP N N 15 128.0441722 0.04788209581 . . . . . . . 19 ASP N . 51825 1
71 . 1 . 1 20 20 GLY H H 1 8.375824877 0.01123672966 . . . . . . . 20 GLY H . 51825 1
72 . 1 . 1 20 20 GLY C C 13 171.8232189 0 . . . . . . . 20 GLY C . 51825 1
73 . 1 . 1 20 20 GLY CA C 13 46.22238857 0.03626717375 . . . . . . . 20 GLY CA . 51825 1
74 . 1 . 1 20 20 GLY N N 15 101.6553461 0.03870523942 . . . . . . . 20 GLY N . 51825 1
75 . 1 . 1 21 21 VAL H H 1 7.552257109 0.009027735438 . . . . . . . 21 VAL H . 51825 1
76 . 1 . 1 21 21 VAL C C 13 172.973415 0 . . . . . . . 21 VAL C . 51825 1
77 . 1 . 1 21 21 VAL CA C 13 59.7278283 0 . . . . . . . 21 VAL CA . 51825 1
78 . 1 . 1 21 21 VAL CB C 13 35.51570968 0 . . . . . . . 21 VAL CB . 51825 1
79 . 1 . 1 21 21 VAL N N 15 114.4869483 0.04067409198 . . . . . . . 21 VAL N . 51825 1
80 . 1 . 1 22 22 PHE H H 1 7.873701347 0.005881451006 . . . . . . . 22 PHE H . 51825 1
81 . 1 . 1 22 22 PHE C C 13 175.4104643 0 . . . . . . . 22 PHE C . 51825 1
82 . 1 . 1 22 22 PHE CA C 13 54.47056762 0 . . . . . . . 22 PHE CA . 51825 1
83 . 1 . 1 22 22 PHE CB C 13 39.03139486 0 . . . . . . . 22 PHE CB . 51825 1
84 . 1 . 1 22 22 PHE N N 15 117.4265623 0.05284172718 . . . . . . . 22 PHE N . 51825 1
85 . 1 . 1 23 23 ASP H H 1 9.407626869 0.01444531476 . . . . . . . 23 ASP H . 51825 1
86 . 1 . 1 23 23 ASP C C 13 173.6842211 0 . . . . . . . 23 ASP C . 51825 1
87 . 1 . 1 23 23 ASP CA C 13 53.28415651 0 . . . . . . . 23 ASP CA . 51825 1
88 . 1 . 1 23 23 ASP CB C 13 45.47021126 0 . . . . . . . 23 ASP CB . 51825 1
89 . 1 . 1 23 23 ASP N N 15 123.1714892 0.05783864834 . . . . . . . 23 ASP N . 51825 1
90 . 1 . 1 24 24 GLU H H 1 8.772602721 0.01175598109 . . . . . . . 24 GLU H . 51825 1
91 . 1 . 1 24 24 GLU C C 13 175.2073768 0 . . . . . . . 24 GLU C . 51825 1
92 . 1 . 1 24 24 GLU CA C 13 56.61975551 0 . . . . . . . 24 GLU CA . 51825 1
93 . 1 . 1 24 24 GLU CB C 13 32.30291049 0 . . . . . . . 24 GLU CB . 51825 1
94 . 1 . 1 24 24 GLU N N 15 122.2458789 0.09945330683 . . . . . . . 24 GLU N . 51825 1
95 . 1 . 1 25 25 VAL H H 1 9.184323412 0.01015967242 . . . . . . . 25 VAL H . 51825 1
96 . 1 . 1 25 25 VAL C C 13 172.1108059 0 . . . . . . . 25 VAL C . 51825 1
97 . 1 . 1 25 25 VAL CA C 13 62.19665199 0 . . . . . . . 25 VAL CA . 51825 1
98 . 1 . 1 25 25 VAL CB C 13 35.15014815 0 . . . . . . . 25 VAL CB . 51825 1
99 . 1 . 1 25 25 VAL N N 15 122.889855 0.05607110318 . . . . . . . 25 VAL N . 51825 1
100 . 1 . 1 26 26 SER H H 1 6.999576663 0.01298287785 . . . . . . . 26 SER H . 51825 1
101 . 1 . 1 26 26 SER C C 13 173.4099744 0 . . . . . . . 26 SER C . 51825 1
102 . 1 . 1 26 26 SER CA C 13 56.18865102 0 . . . . . . . 26 SER CA . 51825 1
103 . 1 . 1 26 26 SER CB C 13 66.84180854 0 . . . . . . . 26 SER CB . 51825 1
104 . 1 . 1 26 26 SER N N 15 116.3180865 0.06153625226 . . . . . . . 26 SER N . 51825 1
105 . 1 . 1 27 27 LEU H H 1 7.528723798 0.006002146995 . . . . . . . 27 LEU H . 51825 1
106 . 1 . 1 27 27 LEU C C 13 178.2460047 0 . . . . . . . 27 LEU C . 51825 1
107 . 1 . 1 27 27 LEU CA C 13 58.77339316 0 . . . . . . . 27 LEU CA . 51825 1
108 . 1 . 1 27 27 LEU CB C 13 40.08222556 0 . . . . . . . 27 LEU CB . 51825 1
109 . 1 . 1 27 27 LEU N N 15 121.4555286 0.07647746594 . . . . . . . 27 LEU N . 51825 1
110 . 1 . 1 28 28 ASP H H 1 7.873662177 0.01147746514 . . . . . . . 28 ASP H . 51825 1
111 . 1 . 1 28 28 ASP C C 13 176.2593723 0 . . . . . . . 28 ASP C . 51825 1
112 . 1 . 1 28 28 ASP CA C 13 56.35907814 0 . . . . . . . 28 ASP CA . 51825 1
113 . 1 . 1 28 28 ASP CB C 13 40.5027456 0 . . . . . . . 28 ASP CB . 51825 1
114 . 1 . 1 28 28 ASP N N 15 115.3738671 0.1165611156 . . . . . . . 28 ASP N . 51825 1
115 . 1 . 1 29 29 LYS H H 1 7.127613634 0.01805300346 . . . . . . . 29 LYS H . 51825 1
116 . 1 . 1 29 29 LYS C C 13 176.2712637 0 . . . . . . . 29 LYS C . 51825 1
117 . 1 . 1 29 29 LYS CA C 13 58.37904461 0 . . . . . . . 29 LYS CA . 51825 1
118 . 1 . 1 29 29 LYS CB C 13 32.37964629 0 . . . . . . . 29 LYS CB . 51825 1
119 . 1 . 1 29 29 LYS N N 15 119.5439934 0.02070042699 . . . . . . . 29 LYS N . 51825 1
120 . 1 . 1 30 30 TYR H H 1 7.221836938 0.01380609744 . . . . . . . 30 TYR H . 51825 1
121 . 1 . 1 30 30 TYR C C 13 173.5183885 0 . . . . . . . 30 TYR C . 51825 1
122 . 1 . 1 30 30 TYR CA C 13 56.41014717 0 . . . . . . . 30 TYR CA . 51825 1
123 . 1 . 1 30 30 TYR CB C 13 38.25082495 0 . . . . . . . 30 TYR CB . 51825 1
124 . 1 . 1 30 30 TYR N N 15 116.875249 0.05083089956 . . . . . . . 30 TYR N . 51825 1
125 . 1 . 1 31 31 LYS H H 1 6.87273647 0.007796359362 . . . . . . . 31 LYS H . 51825 1
126 . 1 . 1 31 31 LYS C C 13 177.3397949 0 . . . . . . . 31 LYS C . 51825 1
127 . 1 . 1 31 31 LYS CA C 13 58.65712098 0 . . . . . . . 31 LYS CA . 51825 1
128 . 1 . 1 31 31 LYS CB C 13 32.22956858 0 . . . . . . . 31 LYS CB . 51825 1
129 . 1 . 1 31 31 LYS N N 15 120.0741282 0.04590918794 . . . . . . . 31 LYS N . 51825 1
130 . 1 . 1 32 32 GLY H H 1 9.067051573 0.01305251977 . . . . . . . 32 GLY H . 51825 1
131 . 1 . 1 32 32 GLY C C 13 172.6979985 0 . . . . . . . 32 GLY C . 51825 1
132 . 1 . 1 32 32 GLY CA C 13 45.95729506 0.01511477132 . . . . . . . 32 GLY CA . 51825 1
133 . 1 . 1 32 32 GLY N N 15 112.5731639 0.05149142253 . . . . . . . 32 GLY N . 51825 1
134 . 1 . 1 33 33 LYS H H 1 8.228071864 0.01869583751 . . . . . . . 33 LYS H . 51825 1
135 . 1 . 1 33 33 LYS C C 13 176.0133585 0 . . . . . . . 33 LYS C . 51825 1
136 . 1 . 1 33 33 LYS CA C 13 55.31787461 0 . . . . . . . 33 LYS CA . 51825 1
137 . 1 . 1 33 33 LYS CB C 13 34.01010182 0 . . . . . . . 33 LYS CB . 51825 1
138 . 1 . 1 33 33 LYS N N 15 120.1805952 0.07876585858 . . . . . . . 33 LYS N . 51825 1
139 . 1 . 1 45 45 THR C C 13 174.766402 0 . . . . . . . 45 THR C . 51825 1
140 . 1 . 1 45 45 THR CA C 13 61.36431888 0 . . . . . . . 45 THR CA . 51825 1
141 . 1 . 1 45 45 THR CB C 13 68.21659924 0 . . . . . . . 45 THR CB . 51825 1
142 . 1 . 1 45 45 THR N N 15 102.8074689 0.03616855238 . . . . . . . 45 THR N . 51825 1
143 . 1 . 1 46 46 PHE H H 1 7.056786931 0.006407137552 . . . . . . . 46 PHE H . 51825 1
144 . 1 . 1 46 46 PHE C C 13 173.2330975 0 . . . . . . . 46 PHE C . 51825 1
145 . 1 . 1 46 46 PHE CA C 13 61.27878249 0 . . . . . . . 46 PHE CA . 51825 1
146 . 1 . 1 46 46 PHE CB C 13 41.3483585 0 . . . . . . . 46 PHE CB . 51825 1
147 . 1 . 1 46 46 PHE N N 15 116.8289939 0.03538590623 . . . . . . . 46 PHE N . 51825 1
148 . 1 . 1 47 47 VAL H H 1 9.091439564 0.01248102678 . . . . . . . 47 VAL H . 51825 1
149 . 1 . 1 47 47 VAL C C 13 179.5737568 0 . . . . . . . 47 VAL C . 51825 1
150 . 1 . 1 47 47 VAL CA C 13 66.90393089 0 . . . . . . . 47 VAL CA . 51825 1
151 . 1 . 1 47 47 VAL CB C 13 32.68777759 0 . . . . . . . 47 VAL CB . 51825 1
152 . 1 . 1 47 47 VAL N N 15 119.5417348 0.06102516197 . . . . . . . 47 VAL N . 51825 1
153 . 1 . 1 50 50 THR H H 1 7.085450979 0.006244600901 . . . . . . . 50 THR H . 51825 1
154 . 1 . 1 50 50 THR C C 13 176.8320764 0 . . . . . . . 50 THR C . 51825 1
155 . 1 . 1 50 50 THR CA C 13 65.51507999 0 . . . . . . . 50 THR CA . 51825 1
156 . 1 . 1 50 50 THR CB C 13 69.69424983 0 . . . . . . . 50 THR CB . 51825 1
157 . 1 . 1 50 50 THR N N 15 106.1042888 0.04923478779 . . . . . . . 50 THR N . 51825 1
158 . 1 . 1 53 53 ILE H H 1 8.30619344 0.02069894678 . . . . . . . 53 ILE H . 51825 1
159 . 1 . 1 53 53 ILE C C 13 176.3961724 0 . . . . . . . 53 ILE C . 51825 1
160 . 1 . 1 53 53 ILE CA C 13 66.83694705 0 . . . . . . . 53 ILE CA . 51825 1
161 . 1 . 1 53 53 ILE CB C 13 38.65291035 0 . . . . . . . 53 ILE CB . 51825 1
162 . 1 . 1 53 53 ILE N N 15 117.0039898 0.03145488877 . . . . . . . 53 ILE N . 51825 1
163 . 1 . 1 54 54 ALA H H 1 7.296541488 0.01006003204 . . . . . . . 54 ALA H . 51825 1
164 . 1 . 1 54 54 ALA C C 13 180.9290687 0 . . . . . . . 54 ALA C . 51825 1
165 . 1 . 1 54 54 ALA CA C 13 56.11327718 0 . . . . . . . 54 ALA CA . 51825 1
166 . 1 . 1 54 54 ALA CB C 13 18.82561263 0 . . . . . . . 54 ALA CB . 51825 1
167 . 1 . 1 54 54 ALA N N 15 119.3565739 0.06697883781 . . . . . . . 54 ALA N . 51825 1
168 . 1 . 1 55 55 PHE H H 1 8.480910019 0.007362281372 . . . . . . . 55 PHE H . 51825 1
169 . 1 . 1 55 55 PHE C C 13 176.4344352 0 . . . . . . . 55 PHE C . 51825 1
170 . 1 . 1 55 55 PHE CA C 13 63.4898136 0 . . . . . . . 55 PHE CA . 51825 1
171 . 1 . 1 55 55 PHE CB C 13 39.36937898 0 . . . . . . . 55 PHE CB . 51825 1
172 . 1 . 1 55 55 PHE N N 15 116.0540666 0.04364121782 . . . . . . . 55 PHE N . 51825 1
173 . 1 . 1 56 56 SER H H 1 8.677958026 0.00973961488 . . . . . . . 56 SER H . 51825 1
174 . 1 . 1 56 56 SER C C 13 178.9770733 0 . . . . . . . 56 SER C . 51825 1
175 . 1 . 1 56 56 SER CA C 13 62.74333583 0 . . . . . . . 56 SER CA . 51825 1
176 . 1 . 1 56 56 SER CB C 13 64.00547115 0 . . . . . . . 56 SER CB . 51825 1
177 . 1 . 1 56 56 SER N N 15 112.9647877 0.04193536068 . . . . . . . 56 SER N . 51825 1
178 . 1 . 1 57 57 GLU H H 1 9.04206088 0.006015232421 . . . . . . . 57 GLU H . 51825 1
179 . 1 . 1 57 57 GLU C C 13 176.9780624 0 . . . . . . . 57 GLU C . 51825 1
180 . 1 . 1 57 57 GLU CA C 13 59.38023996 0 . . . . . . . 57 GLU CA . 51825 1
181 . 1 . 1 57 57 GLU CB C 13 29.60044117 0 . . . . . . . 57 GLU CB . 51825 1
182 . 1 . 1 57 57 GLU N N 15 119.8465787 0.0000013487 . . . . . . . 57 GLU N . 51825 1
183 . 1 . 1 58 58 ALA H H 1 7.238945453 0.01350271808 . . . . . . . 58 ALA H . 51825 1
184 . 1 . 1 58 58 ALA C C 13 177.101681 0 . . . . . . . 58 ALA C . 51825 1
185 . 1 . 1 58 58 ALA CA C 13 52.34116114 0 . . . . . . . 58 ALA CA . 51825 1
186 . 1 . 1 58 58 ALA CB C 13 20.047501 0 . . . . . . . 58 ALA CB . 51825 1
187 . 1 . 1 58 58 ALA N N 15 119.1634264 0.03971463928 . . . . . . . 58 ALA N . 51825 1
188 . 1 . 1 59 59 ALA H H 1 7.812466181 0.008644152675 . . . . . . . 59 ALA H . 51825 1
189 . 1 . 1 59 59 ALA C C 13 179.0660382 0 . . . . . . . 59 ALA C . 51825 1
190 . 1 . 1 59 59 ALA CA C 13 58.06081582 0 . . . . . . . 59 ALA CA . 51825 1
191 . 1 . 1 59 59 ALA CB C 13 18.84738448 0 . . . . . . . 59 ALA CB . 51825 1
192 . 1 . 1 59 59 ALA N N 15 124.6902756 0.047926787 . . . . . . . 59 ALA N . 51825 1
193 . 1 . 1 60 60 LYS H H 1 8.693071313 0.01149833175 . . . . . . . 60 LYS H . 51825 1
194 . 1 . 1 60 60 LYS C C 13 178.1116775 0 . . . . . . . 60 LYS C . 51825 1
195 . 1 . 1 60 60 LYS CA C 13 59.39364313 0 . . . . . . . 60 LYS CA . 51825 1
196 . 1 . 1 60 60 LYS CB C 13 31.84569029 0 . . . . . . . 60 LYS CB . 51825 1
197 . 1 . 1 60 60 LYS N N 15 116.5916006 0.07307019429 . . . . . . . 60 LYS N . 51825 1
198 . 1 . 1 61 61 LYS H H 1 7.696335912 0.007411891821 . . . . . . . 61 LYS H . 51825 1
199 . 1 . 1 61 61 LYS C C 13 179.4722131 0 . . . . . . . 61 LYS C . 51825 1
200 . 1 . 1 61 61 LYS CA C 13 59.56905485 0 . . . . . . . 61 LYS CA . 51825 1
201 . 1 . 1 61 61 LYS CB C 13 31.7265988 0 . . . . . . . 61 LYS CB . 51825 1
202 . 1 . 1 61 61 LYS N N 15 119.5088221 0.1105802011 . . . . . . . 61 LYS N . 51825 1
203 . 1 . 1 62 62 PHE H H 1 7.662034169 0.003922858973 . . . . . . . 62 PHE H . 51825 1
204 . 1 . 1 62 62 PHE C C 13 178.0126767 0 . . . . . . . 62 PHE C . 51825 1
205 . 1 . 1 62 62 PHE CA C 13 63.75514232 0 . . . . . . . 62 PHE CA . 51825 1
206 . 1 . 1 62 62 PHE CB C 13 40.36108572 0 . . . . . . . 62 PHE CB . 51825 1
207 . 1 . 1 62 62 PHE N N 15 118.5188857 0.0000013487 . . . . . . . 62 PHE N . 51825 1
208 . 1 . 1 63 63 GLU H H 1 8.846195021 0.0124037796 . . . . . . . 63 GLU H . 51825 1
209 . 1 . 1 63 63 GLU C C 13 180.6362209 0 . . . . . . . 63 GLU C . 51825 1
210 . 1 . 1 63 63 GLU CA C 13 60.5908057 0 . . . . . . . 63 GLU CA . 51825 1
211 . 1 . 1 63 63 GLU CB C 13 29.76934069 0 . . . . . . . 63 GLU CB . 51825 1
212 . 1 . 1 63 63 GLU N N 15 121.9994567 0.09297885932 . . . . . . . 63 GLU N . 51825 1
213 . 1 . 1 64 64 GLU H H 1 8.37692304 0.006695161496 . . . . . . . 64 GLU H . 51825 1
214 . 1 . 1 64 64 GLU C C 13 176.8320764 0 . . . . . . . 64 GLU C . 51825 1
215 . 1 . 1 64 64 GLU CA C 13 59.53910901 0 . . . . . . . 64 GLU CA . 51825 1
216 . 1 . 1 64 64 GLU CB C 13 29.7698431 0 . . . . . . . 64 GLU CB . 51825 1
217 . 1 . 1 64 64 GLU N N 15 120.5649828 0.06520940959 . . . . . . . 64 GLU N . 51825 1
218 . 1 . 1 65 65 GLN H H 1 7.226326492 0.005700563506 . . . . . . . 65 GLN H . 51825 1
219 . 1 . 1 65 65 GLN C C 13 174.4389851 0 . . . . . . . 65 GLN C . 51825 1
220 . 1 . 1 65 65 GLN CA C 13 54.34911154 0 . . . . . . . 65 GLN CA . 51825 1
221 . 1 . 1 65 65 GLN CB C 13 27.75335002 0 . . . . . . . 65 GLN CB . 51825 1
222 . 1 . 1 65 65 GLN N N 15 115.0977577 0.0610628478 . . . . . . . 65 GLN N . 51825 1
223 . 1 . 1 66 66 GLY H H 1 7.955008532 0.01088782545 . . . . . . . 66 GLY H . 51825 1
224 . 1 . 1 66 66 GLY C C 13 172.973415 0 . . . . . . . 66 GLY C . 51825 1
225 . 1 . 1 66 66 GLY CA C 13 47.34336574 0.02359253492 . . . . . . . 66 GLY CA . 51825 1
226 . 1 . 1 66 66 GLY N N 15 105.7971876 0.07111162824 . . . . . . . 66 GLY N . 51825 1
227 . 1 . 1 67 67 ALA H H 1 8.331529658 0.008344963421 . . . . . . . 67 ALA H . 51825 1
228 . 1 . 1 67 67 ALA C C 13 174.8009567 0 . . . . . . . 67 ALA C . 51825 1
229 . 1 . 1 67 67 ALA CA C 13 49.78417995 0 . . . . . . . 67 ALA CA . 51825 1
230 . 1 . 1 67 67 ALA CB C 13 24.05179025 0 . . . . . . . 67 ALA CB . 51825 1
231 . 1 . 1 67 67 ALA N N 15 120.2514138 0.04394375857 . . . . . . . 67 ALA N . 51825 1
232 . 1 . 1 68 68 GLN H H 1 8.736980579 0.01217639722 . . . . . . . 68 GLN H . 51825 1
233 . 1 . 1 68 68 GLN C C 13 172.973415 0 . . . . . . . 68 GLN C . 51825 1
234 . 1 . 1 68 68 GLN CA C 13 53.87083606 0 . . . . . . . 68 GLN CA . 51825 1
235 . 1 . 1 68 68 GLN CB C 13 31.97249222 0 . . . . . . . 68 GLN CB . 51825 1
236 . 1 . 1 68 68 GLN N N 15 120.927776 0.08494803195 . . . . . . . 68 GLN N . 51825 1
237 . 1 . 1 69 69 VAL H H 1 8.500646855 0.01494904981 . . . . . . . 69 VAL H . 51825 1
238 . 1 . 1 69 69 VAL C C 13 173.6563262 0 . . . . . . . 69 VAL C . 51825 1
239 . 1 . 1 69 69 VAL CA C 13 61.95411361 0 . . . . . . . 69 VAL CA . 51825 1
240 . 1 . 1 69 69 VAL CB C 13 32.20784666 0 . . . . . . . 69 VAL CB . 51825 1
241 . 1 . 1 69 69 VAL N N 15 127.5712653 0.05076904547 . . . . . . . 69 VAL N . 51825 1
242 . 1 . 1 74 74 THR H H 1 9.31400194 0.032749133 . . . . . . . 74 THR H . 51825 1
243 . 1 . 1 74 74 THR C C 13 172.0515148 0 . . . . . . . 74 THR C . 51825 1
244 . 1 . 1 74 74 THR CA C 13 62.32286301 0 . . . . . . . 74 THR CA . 51825 1
245 . 1 . 1 74 74 THR CB C 13 69.54815221 0 . . . . . . . 74 THR CB . 51825 1
246 . 1 . 1 74 74 THR N N 15 108.1161523 0.07386274977 . . . . . . . 74 THR N . 51825 1
247 . 1 . 1 75 75 ASP H H 1 7.900045728 0.006371629696 . . . . . . . 75 ASP H . 51825 1
248 . 1 . 1 75 75 ASP C C 13 172.1923277 0 . . . . . . . 75 ASP C . 51825 1
249 . 1 . 1 75 75 ASP CA C 13 54.63695734 0 . . . . . . . 75 ASP CA . 51825 1
250 . 1 . 1 75 75 ASP CB C 13 44.67273701 0 . . . . . . . 75 ASP CB . 51825 1
251 . 1 . 1 75 75 ASP N N 15 118.9758496 0.01080758058 . . . . . . . 75 ASP N . 51825 1
252 . 1 . 1 76 76 SER H H 1 8.261133813 0.0141270435 . . . . . . . 76 SER H . 51825 1
253 . 1 . 1 76 76 SER C C 13 174.5848367 0 . . . . . . . 76 SER C . 51825 1
254 . 1 . 1 76 76 SER CA C 13 58.58693202 0 . . . . . . . 76 SER CA . 51825 1
255 . 1 . 1 76 76 SER CB C 13 66.85135984 0 . . . . . . . 76 SER CB . 51825 1
256 . 1 . 1 76 76 SER N N 15 109.7131323 0.07818247106 . . . . . . . 76 SER N . 51825 1
257 . 1 . 1 77 77 GLU H H 1 11.06713899 0.02441749786 . . . . . . . 77 GLU H . 51825 1
258 . 1 . 1 77 77 GLU C C 13 175.9181829 0 . . . . . . . 77 GLU C . 51825 1
259 . 1 . 1 77 77 GLU CA C 13 59.40016916 0 . . . . . . . 77 GLU CA . 51825 1
260 . 1 . 1 77 77 GLU CB C 13 26.14368865 0 . . . . . . . 77 GLU CB . 51825 1
261 . 1 . 1 77 77 GLU N N 15 120.6060163 0.04055565181 . . . . . . . 77 GLU N . 51825 1
262 . 1 . 1 84 84 THR H H 1 7.693318281 0.005707130502 . . . . . . . 84 THR H . 51825 1
263 . 1 . 1 84 84 THR C C 13 174.2629761 0 . . . . . . . 84 THR C . 51825 1
264 . 1 . 1 84 84 THR CA C 13 64.62589473 0 . . . . . . . 84 THR CA . 51825 1
265 . 1 . 1 84 84 THR CB C 13 70.09956865 0 . . . . . . . 84 THR CB . 51825 1
266 . 1 . 1 84 84 THR N N 15 108.1648482 0.05392452801 . . . . . . . 84 THR N . 51825 1
267 . 1 . 1 85 85 ASN H H 1 7.314440485 0.01156546046 . . . . . . . 85 ASN H . 51825 1
268 . 1 . 1 85 85 ASN C C 13 173.6036002 0 . . . . . . . 85 ASN C . 51825 1
269 . 1 . 1 85 85 ASN CA C 13 54.17838203 0 . . . . . . . 85 ASN CA . 51825 1
270 . 1 . 1 85 85 ASN CB C 13 40.06365319 0 . . . . . . . 85 ASN CB . 51825 1
271 . 1 . 1 85 85 ASN N N 15 117.8255485 0.03600405117 . . . . . . . 85 ASN N . 51825 1
272 . 1 . 1 86 86 ILE H H 1 7.098061602 0.01085538048 . . . . . . . 86 ILE H . 51825 1
273 . 1 . 1 86 86 ILE C C 13 172.973415 0 . . . . . . . 86 ILE C . 51825 1
274 . 1 . 1 86 86 ILE CA C 13 58.33307361 0 . . . . . . . 86 ILE CA . 51825 1
275 . 1 . 1 86 86 ILE CB C 13 39.92432834 0 . . . . . . . 86 ILE CB . 51825 1
276 . 1 . 1 86 86 ILE N N 15 122.4795358 0.1186942501 . . . . . . . 86 ILE N . 51825 1
277 . 1 . 1 88 88 ARG H H 1 8.971062544 0.009425068155 . . . . . . . 88 ARG H . 51825 1
278 . 1 . 1 88 88 ARG C C 13 180.1990135 0 . . . . . . . 88 ARG C . 51825 1
279 . 1 . 1 88 88 ARG CA C 13 59.91653821 0 . . . . . . . 88 ARG CA . 51825 1
280 . 1 . 1 88 88 ARG CB C 13 29.601583 0 . . . . . . . 88 ARG CB . 51825 1
281 . 1 . 1 88 88 ARG N N 15 124.445033 0.08957507735 . . . . . . . 88 ARG N . 51825 1
282 . 1 . 1 89 89 LYS H H 1 8.726293392 0.01236144549 . . . . . . . 89 LYS H . 51825 1
283 . 1 . 1 89 89 LYS C C 13 173.9691292 0 . . . . . . . 89 LYS C . 51825 1
284 . 1 . 1 89 89 LYS CA C 13 59.53527252 0 . . . . . . . 89 LYS CA . 51825 1
285 . 1 . 1 89 89 LYS CB C 13 32.03513667 0 . . . . . . . 89 LYS CB . 51825 1
286 . 1 . 1 89 89 LYS N N 15 116.9776234 0.03330166858 . . . . . . . 89 LYS N . 51825 1
287 . 1 . 1 90 90 GLU H H 1 7.136688745 0.007596285311 . . . . . . . 90 GLU H . 51825 1
288 . 1 . 1 90 90 GLU C C 13 174.5583474 0 . . . . . . . 90 GLU C . 51825 1
289 . 1 . 1 90 90 GLU CA C 13 55.44472968 0 . . . . . . . 90 GLU CA . 51825 1
290 . 1 . 1 90 90 GLU CB C 13 30.52285497 0 . . . . . . . 90 GLU CB . 51825 1
291 . 1 . 1 90 90 GLU N N 15 114.9892199 0.01276703052 . . . . . . . 90 GLU N . 51825 1
292 . 1 . 1 91 91 GLY H H 1 7.547458685 0.007589726789 . . . . . . . 91 GLY H . 51825 1
293 . 1 . 1 91 91 GLY C C 13 173.8876339 0 . . . . . . . 91 GLY C . 51825 1
294 . 1 . 1 91 91 GLY CA C 13 44.1234476 0 . . . . . . . 91 GLY CA . 51825 1
295 . 1 . 1 91 91 GLY N N 15 106.8177245 0.01779280955 . . . . . . . 91 GLY N . 51825 1
296 . 1 . 1 92 92 GLY H H 1 7.511026132 0.004223762836 . . . . . . . 92 GLY H . 51825 1
297 . 1 . 1 92 92 GLY C C 13 171.1387123 0 . . . . . . . 92 GLY C . 51825 1
298 . 1 . 1 92 92 GLY CA C 13 44.12764376 0 . . . . . . . 92 GLY CA . 51825 1
299 . 1 . 1 92 92 GLY N N 15 106.8049013 0.05120825968 . . . . . . . 92 GLY N . 51825 1
300 . 1 . 1 93 93 LEU H H 1 6.557356234 0.009638377603 . . . . . . . 93 LEU H . 51825 1
301 . 1 . 1 93 93 LEU C C 13 177.090029 0 . . . . . . . 93 LEU C . 51825 1
302 . 1 . 1 93 93 LEU CA C 13 55.46639034 0 . . . . . . . 93 LEU CA . 51825 1
303 . 1 . 1 93 93 LEU CB C 13 42.83087781 0 . . . . . . . 93 LEU CB . 51825 1
304 . 1 . 1 93 93 LEU N N 15 111.5986702 0.03992154234 . . . . . . . 93 LEU N . 51825 1
305 . 1 . 1 94 94 GLY H H 1 7.056983056 0.01233198745 . . . . . . . 94 GLY H . 51825 1
306 . 1 . 1 94 94 GLY C C 13 180.6907377 0 . . . . . . . 94 GLY C . 51825 1
307 . 1 . 1 94 94 GLY CA C 13 45.83007668 0.01617111687 . . . . . . . 94 GLY CA . 51825 1
308 . 1 . 1 94 94 GLY N N 15 103.9235946 0.04653299533 . . . . . . . 94 GLY N . 51825 1
309 . 1 . 1 96 96 ILE H H 1 7.253716476 0.00374030521 . . . . . . . 96 ILE H . 51825 1
310 . 1 . 1 96 96 ILE C C 13 178.9848795 0 . . . . . . . 96 ILE C . 51825 1
311 . 1 . 1 96 96 ILE CA C 13 61.9241814 0 . . . . . . . 96 ILE CA . 51825 1
312 . 1 . 1 96 96 ILE CB C 13 38.45254668 0 . . . . . . . 96 ILE CB . 51825 1
313 . 1 . 1 96 96 ILE N N 15 119.3657431 0.05903658088 . . . . . . . 96 ILE N . 51825 1
314 . 1 . 1 102 102 ALA H H 1 9.546933797 0.01400587311 . . . . . . . 102 ALA H . 51825 1
315 . 1 . 1 102 102 ALA C C 13 176.5512317 0 . . . . . . . 102 ALA C . 51825 1
316 . 1 . 1 102 102 ALA CA C 13 51.70736006 0 . . . . . . . 102 ALA CA . 51825 1
317 . 1 . 1 102 102 ALA CB C 13 17.73389773 0 . . . . . . . 102 ALA CB . 51825 1
318 . 1 . 1 102 102 ALA N N 15 125.8530792 0.04723309644 . . . . . . . 102 ALA N . 51825 1
319 . 1 . 1 103 103 ASP H H 1 9.81547748 0.02799099842 . . . . . . . 103 ASP H . 51825 1
320 . 1 . 1 103 103 ASP C C 13 176.3099861 0 . . . . . . . 103 ASP C . 51825 1
321 . 1 . 1 103 103 ASP CA C 13 53.00342678 0 . . . . . . . 103 ASP CA . 51825 1
322 . 1 . 1 103 103 ASP CB C 13 43.08732824 0 . . . . . . . 103 ASP CB . 51825 1
323 . 1 . 1 103 103 ASP N N 15 127.8947372 0.0836361879 . . . . . . . 103 ASP N . 51825 1
324 . 1 . 1 104 104 THR H H 1 7.683600687 0.01086685255 . . . . . . . 104 THR H . 51825 1
325 . 1 . 1 104 104 THR C C 13 176.0197266 0 . . . . . . . 104 THR C . 51825 1
326 . 1 . 1 104 104 THR CA C 13 65.13725435 0 . . . . . . . 104 THR CA . 51825 1
327 . 1 . 1 104 104 THR CB C 13 68.67923125 0 . . . . . . . 104 THR CB . 51825 1
328 . 1 . 1 104 104 THR N N 15 116.4251539 0.1169537178 . . . . . . . 104 THR N . 51825 1
329 . 1 . 1 105 105 ASN H H 1 8.224412413 0.01065839144 . . . . . . . 105 ASN H . 51825 1
330 . 1 . 1 105 105 ASN C C 13 175.4104643 0 . . . . . . . 105 ASN C . 51825 1
331 . 1 . 1 105 105 ASN CA C 13 52.55531511 0 . . . . . . . 105 ASN CA . 51825 1
332 . 1 . 1 105 105 ASN CB C 13 37.91608277 0 . . . . . . . 105 ASN CB . 51825 1
333 . 1 . 1 105 105 ASN N N 15 112.8447758 0.05349043928 . . . . . . . 105 ASN N . 51825 1
334 . 1 . 1 106 106 HIS H H 1 7.968903594 0.02863734076 . . . . . . . 106 HIS H . 51825 1
335 . 1 . 1 106 106 HIS C C 13 173.9888522 0 . . . . . . . 106 HIS C . 51825 1
336 . 1 . 1 106 106 HIS CA C 13 57.14355536 0 . . . . . . . 106 HIS CA . 51825 1
337 . 1 . 1 106 106 HIS CB C 13 28.6436303 0 . . . . . . . 106 HIS CB . 51825 1
338 . 1 . 1 106 106 HIS N N 15 112.3472141 0.05699393398 . . . . . . . 106 HIS N . 51825 1
339 . 1 . 1 107 107 SER H H 1 8.638284252 0.01171684382 . . . . . . . 107 SER H . 51825 1
340 . 1 . 1 107 107 SER C C 13 175.0042894 0 . . . . . . . 107 SER C . 51825 1
341 . 1 . 1 107 107 SER CA C 13 62.83755863 0 . . . . . . . 107 SER CA . 51825 1
342 . 1 . 1 107 107 SER CB C 13 63.80934152 0 . . . . . . . 107 SER CB . 51825 1
343 . 1 . 1 107 107 SER N N 15 117.2779803 0.1264421168 . . . . . . . 107 SER N . 51825 1
344 . 1 . 1 108 108 LEU H H 1 9.904653987 0.01699515927 . . . . . . . 108 LEU H . 51825 1
345 . 1 . 1 108 108 LEU C C 13 178.1932131 0 . . . . . . . 108 LEU C . 51825 1
346 . 1 . 1 108 108 LEU CA C 13 58.57756184 0 . . . . . . . 108 LEU CA . 51825 1
347 . 1 . 1 108 108 LEU CB C 13 43.17679278 0 . . . . . . . 108 LEU CB . 51825 1
348 . 1 . 1 108 108 LEU N N 15 128.5517525 0.04352838527 . . . . . . . 108 LEU N . 51825 1
349 . 1 . 1 111 111 ASP H H 1 8.589024511 0.0300521224 . . . . . . . 111 ASP H . 51825 1
350 . 1 . 1 111 111 ASP CA C 13 57.98862662 0 . . . . . . . 111 ASP CA . 51825 1
351 . 1 . 1 111 111 ASP CB C 13 39.95233713 0 . . . . . . . 111 ASP CB . 51825 1
352 . 1 . 1 111 111 ASP N N 15 122.5923162 0.06087080035 . . . . . . . 111 ASP N . 51825 1
353 . 1 . 1 113 113 GLY H H 1 7.704154317 0.007027962473 . . . . . . . 113 GLY H . 51825 1
354 . 1 . 1 113 113 GLY C C 13 174.2677611 0.046835701 . . . . . . . 113 GLY C . 51825 1
355 . 1 . 1 113 113 GLY CA C 13 47.34539763 0 . . . . . . . 113 GLY CA . 51825 1
356 . 1 . 1 113 113 GLY N N 15 107.4806722 0.05586988469 . . . . . . . 113 GLY N . 51825 1
357 . 1 . 1 114 114 VAL H H 1 7.615789894 0.008638468702 . . . . . . . 114 VAL H . 51825 1
358 . 1 . 1 114 114 VAL C C 13 173.5826773 0 . . . . . . . 114 VAL C . 51825 1
359 . 1 . 1 114 114 VAL CA C 13 59.90238843 0 . . . . . . . 114 VAL CA . 51825 1
360 . 1 . 1 114 114 VAL CB C 13 32.82161748 0 . . . . . . . 114 VAL CB . 51825 1
361 . 1 . 1 115 115 LEU H H 1 6.854647884 0.006245058219 . . . . . . . 115 LEU H . 51825 1
362 . 1 . 1 115 115 LEU C C 13 175.2003489 0 . . . . . . . 115 LEU C . 51825 1
363 . 1 . 1 115 115 LEU CA C 13 56.00503725 0 . . . . . . . 115 LEU CA . 51825 1
364 . 1 . 1 115 115 LEU CB C 13 41.9720184 0 . . . . . . . 115 LEU CB . 51825 1
365 . 1 . 1 115 115 LEU N N 15 122.5282294 0.04105696445 . . . . . . . 115 LEU N . 51825 1
366 . 1 . 1 116 116 ILE H H 1 9.104783621 0.01399165783 . . . . . . . 116 ILE H . 51825 1
367 . 1 . 1 116 116 ILE C C 13 176.4682784 0 . . . . . . . 116 ILE C . 51825 1
368 . 1 . 1 116 116 ILE CA C 13 61.19541446 0 . . . . . . . 116 ILE CA . 51825 1
369 . 1 . 1 116 116 ILE CB C 13 37.2508626 0 . . . . . . . 116 ILE CB . 51825 1
370 . 1 . 1 116 116 ILE N N 15 129.0356463 0.04415564897 . . . . . . . 116 ILE N . 51825 1
371 . 1 . 1 117 117 GLU H H 1 9.067675975 0.01311932604 . . . . . . . 117 GLU H . 51825 1
372 . 1 . 1 117 117 GLU C C 13 177.7384348 0 . . . . . . . 117 GLU C . 51825 1
373 . 1 . 1 117 117 GLU CA C 13 61.4648431 0 . . . . . . . 117 GLU CA . 51825 1
374 . 1 . 1 117 117 GLU CB C 13 29.48029048 0 . . . . . . . 117 GLU CB . 51825 1
375 . 1 . 1 117 117 GLU N N 15 131.2146226 0.03758831482 . . . . . . . 117 GLU N . 51825 1
376 . 1 . 1 118 118 GLU H H 1 9.567391597 0.009925279168 . . . . . . . 118 GLU H . 51825 1
377 . 1 . 1 118 118 GLU C C 13 176.2733539 0 . . . . . . . 118 GLU C . 51825 1
378 . 1 . 1 118 118 GLU CA C 13 59.63539067 0 . . . . . . . 118 GLU CA . 51825 1
379 . 1 . 1 118 118 GLU CB C 13 29.44082909 0 . . . . . . . 118 GLU CB . 51825 1
380 . 1 . 1 118 118 GLU N N 15 114.9213022 0.04077082129 . . . . . . . 118 GLU N . 51825 1
381 . 1 . 1 119 119 GLU H H 1 7.177950035 0.009947420678 . . . . . . . 119 GLU H . 51825 1
382 . 1 . 1 119 119 GLU C C 13 175.8166392 0 . . . . . . . 119 GLU C . 51825 1
383 . 1 . 1 119 119 GLU CA C 13 56.45160471 0 . . . . . . . 119 GLU CA . 51825 1
384 . 1 . 1 119 119 GLU CB C 13 33.40722185 0 . . . . . . . 119 GLU CB . 51825 1
385 . 1 . 1 119 119 GLU N N 15 113.672253 0.05248534284 . . . . . . . 119 GLU N . 51825 1
386 . 1 . 1 120 120 GLY H H 1 8.317752973 0.00976901773 . . . . . . . 120 GLY H . 51825 1
387 . 1 . 1 120 120 GLY C C 13 171.5359972 0 . . . . . . . 120 GLY C . 51825 1
388 . 1 . 1 120 120 GLY CA C 13 46.85874824 0.001913456079 . . . . . . . 120 GLY CA . 51825 1
389 . 1 . 1 120 120 GLY N N 15 105.8545614 0.04264274874 . . . . . . . 120 GLY N . 51825 1
390 . 1 . 1 121 121 VAL H H 1 6.605508287 0.00598888057 . . . . . . . 121 VAL H . 51825 1
391 . 1 . 1 121 121 VAL C C 13 171.6285544 0 . . . . . . . 121 VAL C . 51825 1
392 . 1 . 1 121 121 VAL CA C 13 58.2433243 0 . . . . . . . 121 VAL CA . 51825 1
393 . 1 . 1 121 121 VAL CB C 13 35.73232897 0 . . . . . . . 121 VAL CB . 51825 1
394 . 1 . 1 121 121 VAL N N 15 107.0766113 0.04188888152 . . . . . . . 121 VAL N . 51825 1
395 . 1 . 1 122 122 ALA H H 1 9.008025375 0.01550035069 . . . . . . . 122 ALA H . 51825 1
396 . 1 . 1 122 122 ALA C C 13 175.7856198 0 . . . . . . . 122 ALA C . 51825 1
397 . 1 . 1 122 122 ALA CA C 13 51.47092879 0 . . . . . . . 122 ALA CA . 51825 1
398 . 1 . 1 122 122 ALA CB C 13 21.17548352 0 . . . . . . . 122 ALA CB . 51825 1
399 . 1 . 1 122 122 ALA N N 15 125.5207809 0.05095491829 . . . . . . . 122 ALA N . 51825 1
400 . 1 . 1 123 123 LEU H H 1 8.012647281 0.01018594672 . . . . . . . 123 LEU H . 51825 1
401 . 1 . 1 123 123 LEU C C 13 175.9831981 0 . . . . . . . 123 LEU C . 51825 1
402 . 1 . 1 123 123 LEU CA C 13 55.01542672 0 . . . . . . . 123 LEU CA . 51825 1
403 . 1 . 1 123 123 LEU CB C 13 45.20374802 0 . . . . . . . 123 LEU CB . 51825 1
404 . 1 . 1 123 123 LEU N N 15 113.1476508 0.03357478683 . . . . . . . 123 LEU N . 51825 1
405 . 1 . 1 124 124 ARG H H 1 6.352801372 0.005751492825 . . . . . . . 124 ARG H . 51825 1
406 . 1 . 1 124 124 ARG C C 13 177.159249 0 . . . . . . . 124 ARG C . 51825 1
407 . 1 . 1 124 124 ARG CA C 13 56.13494926 0 . . . . . . . 124 ARG CA . 51825 1
408 . 1 . 1 124 124 ARG CB C 13 27.47684088 0 . . . . . . . 124 ARG CB . 51825 1
409 . 1 . 1 124 124 ARG N N 15 112.7965554 0.04835207288 . . . . . . . 124 ARG N . 51825 1
410 . 1 . 1 125 125 GLY H H 1 8.557699665 0.01171959304 . . . . . . . 125 GLY H . 51825 1
411 . 1 . 1 125 125 GLY C C 13 170.377288 0 . . . . . . . 125 GLY C . 51825 1
412 . 1 . 1 125 125 GLY CA C 13 44.91802618 0.009612575056 . . . . . . . 125 GLY CA . 51825 1
413 . 1 . 1 125 125 GLY N N 15 110.6960998 0.05510993146 . . . . . . . 125 GLY N . 51825 1
414 . 1 . 1 127 127 PHE H H 1 8.94129018 0.01185107892 . . . . . . . 127 PHE H . 51825 1
415 . 1 . 1 127 127 PHE C C 13 176.7305326 0 . . . . . . . 127 PHE C . 51825 1
416 . 1 . 1 127 127 PHE CA C 13 59.5036441 0 . . . . . . . 127 PHE CA . 51825 1
417 . 1 . 1 127 127 PHE CB C 13 39.22162627 0 . . . . . . . 127 PHE CB . 51825 1
418 . 1 . 1 127 127 PHE N N 15 118.0194319 0.04640111819 . . . . . . . 127 PHE N . 51825 1
419 . 1 . 1 129 129 ILE H H 1 9.657998025 0.01081686934 . . . . . . . 129 ILE H . 51825 1
420 . 1 . 1 129 129 ILE C C 13 173.3852814 0 . . . . . . . 129 ILE C . 51825 1
421 . 1 . 1 129 129 ILE CA C 13 62.37959157 0 . . . . . . . 129 ILE CA . 51825 1
422 . 1 . 1 129 129 ILE CB C 13 41.24781951 0 . . . . . . . 129 ILE CB . 51825 1
423 . 1 . 1 129 129 ILE N N 15 123.7665389 0.05964317065 . . . . . . . 129 ILE N . 51825 1
424 . 1 . 1 130 130 ASP H H 1 7.981804792 0.008207642993 . . . . . . . 130 ASP H . 51825 1
425 . 1 . 1 130 130 ASP C C 13 174.4965708 0 . . . . . . . 130 ASP C . 51825 1
426 . 1 . 1 130 130 ASP CA C 13 52.00351512 0 . . . . . . . 130 ASP CA . 51825 1
427 . 1 . 1 130 130 ASP CB C 13 41.16339741 0 . . . . . . . 130 ASP CB . 51825 1
428 . 1 . 1 130 130 ASP N N 15 125.1340813 0.04801408547 . . . . . . . 130 ASP N . 51825 1
429 . 1 . 1 132 132 LYS H H 1 7.836633005 0.008328866185 . . . . . . . 132 LYS H . 51825 1
430 . 1 . 1 132 132 LYS C C 13 175.878013 0 . . . . . . . 132 LYS C . 51825 1
431 . 1 . 1 132 132 LYS CA C 13 56.35585771 0 . . . . . . . 132 LYS CA . 51825 1
432 . 1 . 1 132 132 LYS CB C 13 32.11716578 0 . . . . . . . 132 LYS CB . 51825 1
433 . 1 . 1 132 132 LYS N N 15 115.4149425 0.02479789855 . . . . . . . 132 LYS N . 51825 1
434 . 1 . 1 133 133 GLY H H 1 8.593000943 0.005077862691 . . . . . . . 133 GLY H . 51825 1
435 . 1 . 1 133 133 GLY C C 13 171.9659508 0 . . . . . . . 133 GLY C . 51825 1
436 . 1 . 1 133 133 GLY CA C 13 45.88107705 0 . . . . . . . 133 GLY CA . 51825 1
437 . 1 . 1 133 133 GLY N N 15 109.0543453 0.04458155437 . . . . . . . 133 GLY N . 51825 1
438 . 1 . 1 134 134 VAL H H 1 8.282015153 0.008831300736 . . . . . . . 134 VAL H . 51825 1
439 . 1 . 1 134 134 VAL C C 13 176.1212703 0 . . . . . . . 134 VAL C . 51825 1
440 . 1 . 1 134 134 VAL CA C 13 62.99795659 0 . . . . . . . 134 VAL CA . 51825 1
441 . 1 . 1 134 134 VAL CB C 13 32.47281684 0 . . . . . . . 134 VAL CB . 51825 1
442 . 1 . 1 134 134 VAL N N 15 123.1343729 0.07190884728 . . . . . . . 134 VAL N . 51825 1
443 . 1 . 1 135 135 ILE H H 1 8.180965723 0.008388857934 . . . . . . . 135 ILE H . 51825 1
444 . 1 . 1 135 135 ILE CA C 13 63.65406311 0 . . . . . . . 135 ILE CA . 51825 1
445 . 1 . 1 135 135 ILE CB C 13 35.8956977 0 . . . . . . . 135 ILE CB . 51825 1
446 . 1 . 1 135 135 ILE N N 15 125.5825855 0.04353286256 . . . . . . . 135 ILE N . 51825 1
447 . 1 . 1 141 141 ASN H H 1 7.722625076 0.007459497671 . . . . . . . 141 ASN H . 51825 1
448 . 1 . 1 141 141 ASN C C 13 174.4637325 0 . . . . . . . 141 ASN C . 51825 1
449 . 1 . 1 141 141 ASN CA C 13 52.05483171 0 . . . . . . . 141 ASN CA . 51825 1
450 . 1 . 1 141 141 ASN CB C 13 40.36359658 0 . . . . . . . 141 ASN CB . 51825 1
451 . 1 . 1 141 141 ASN N N 15 125.4009205 0.04411209375 . . . . . . . 141 ASN N . 51825 1
452 . 1 . 1 142 142 ASP H H 1 7.909750933 0.01181868369 . . . . . . . 142 ASP H . 51825 1
453 . 1 . 1 142 142 ASP C C 13 174.2648124 0 . . . . . . . 142 ASP C . 51825 1
454 . 1 . 1 142 142 ASP CA C 13 54.29529564 0 . . . . . . . 142 ASP CA . 51825 1
455 . 1 . 1 142 142 ASP CB C 13 42.3546259 0 . . . . . . . 142 ASP CB . 51825 1
456 . 1 . 1 142 142 ASP N N 15 114.8113633 0.03800253738 . . . . . . . 142 ASP N . 51825 1
457 . 1 . 1 145 145 VAL H H 1 6.799941642 0.007867737596 . . . . . . . 145 VAL H . 51825 1
458 . 1 . 1 145 145 VAL C C 13 175.0260269 0 . . . . . . . 145 VAL C . 51825 1
459 . 1 . 1 145 145 VAL CA C 13 62.25772061 0 . . . . . . . 145 VAL CA . 51825 1
460 . 1 . 1 145 145 VAL CB C 13 36.09845331 0 . . . . . . . 145 VAL CB . 51825 1
461 . 1 . 1 145 145 VAL N N 15 114.8885338 0.05142771785 . . . . . . . 145 VAL N . 51825 1
462 . 1 . 1 146 146 GLY H H 1 8.310073352 0.008099114019 . . . . . . . 146 GLY H . 51825 1
463 . 1 . 1 146 146 GLY C C 13 173.4549824 0 . . . . . . . 146 GLY C . 51825 1
464 . 1 . 1 146 146 GLY CA C 13 45.25942535 0 . . . . . . . 146 GLY CA . 51825 1
465 . 1 . 1 146 146 GLY N N 15 112.563529 0 . . . . . . . 146 GLY N . 51825 1
466 . 1 . 1 147 147 ARG H H 1 9.537634787 0.0158979806 . . . . . . . 147 ARG H . 51825 1
467 . 1 . 1 147 147 ARG C C 13 171.3487155 0 . . . . . . . 147 ARG C . 51825 1
468 . 1 . 1 147 147 ARG CA C 13 56.78519332 0 . . . . . . . 147 ARG CA . 51825 1
469 . 1 . 1 147 147 ARG CB C 13 30.02962598 0 . . . . . . . 147 ARG CB . 51825 1
470 . 1 . 1 147 147 ARG N N 15 121.0149106 0.08121679388 . . . . . . . 147 ARG N . 51825 1
471 . 1 . 1 148 148 ASN H H 1 8.603850333 0.008956341638 . . . . . . . 148 ASN H . 51825 1
472 . 1 . 1 148 148 ASN C C 13 176.4606948 0 . . . . . . . 148 ASN C . 51825 1
473 . 1 . 1 148 148 ASN CA C 13 52.47888186 0 . . . . . . . 148 ASN CA . 51825 1
474 . 1 . 1 148 148 ASN CB C 13 40.71293936 0 . . . . . . . 148 ASN CB . 51825 1
475 . 1 . 1 148 148 ASN N N 15 116.586805 0.08458298687 . . . . . . . 148 ASN N . 51825 1
476 . 1 . 1 149 149 VAL H H 1 9.040937187 0.004279958036 . . . . . . . 149 VAL H . 51825 1
477 . 1 . 1 149 149 VAL C C 13 175.1058331 0 . . . . . . . 149 VAL C . 51825 1
478 . 1 . 1 149 149 VAL CA C 13 65.84668319 0 . . . . . . . 149 VAL CA . 51825 1
479 . 1 . 1 149 149 VAL CB C 13 32.19334132 0 . . . . . . . 149 VAL CB . 51825 1
480 . 1 . 1 149 149 VAL N N 15 127.2137983 0.04275315166 . . . . . . . 149 VAL N . 51825 1
481 . 1 . 1 150 150 ASP H H 1 7.562425522 0.005298639299 . . . . . . . 150 ASP H . 51825 1
482 . 1 . 1 150 150 ASP C C 13 177.9199988 0 . . . . . . . 150 ASP C . 51825 1
483 . 1 . 1 150 150 ASP CA C 13 57.82881142 0 . . . . . . . 150 ASP CA . 51825 1
484 . 1 . 1 150 150 ASP CB C 13 40.36418334 0 . . . . . . . 150 ASP CB . 51825 1
485 . 1 . 1 150 150 ASP N N 15 118.579693 0.05741208575 . . . . . . . 150 ASP N . 51825 1
486 . 1 . 1 151 151 GLU H H 1 7.043261193 0.01065283718 . . . . . . . 151 GLU H . 51825 1
487 . 1 . 1 151 151 GLU C C 13 176.4277634 0 . . . . . . . 151 GLU C . 51825 1
488 . 1 . 1 151 151 GLU CA C 13 57.16221275 0 . . . . . . . 151 GLU CA . 51825 1
489 . 1 . 1 151 151 GLU CB C 13 28.66677535 0 . . . . . . . 151 GLU CB . 51825 1
490 . 1 . 1 151 151 GLU N N 15 121.4639225 0.05651953185 . . . . . . . 151 GLU N . 51825 1
491 . 1 . 1 152 152 ALA H H 1 7.323574285 0.01031608287 . . . . . . . 152 ALA H . 51825 1
492 . 1 . 1 152 152 ALA C C 13 177.8475135 0 . . . . . . . 152 ALA C . 51825 1
493 . 1 . 1 152 152 ALA CA C 13 56.33841573 0 . . . . . . . 152 ALA CA . 51825 1
494 . 1 . 1 152 152 ALA CB C 13 17.73807371 0 . . . . . . . 152 ALA CB . 51825 1
495 . 1 . 1 152 152 ALA N N 15 120.4481281 0.04611426358 . . . . . . . 152 ALA N . 51825 1
496 . 1 . 1 153 153 LEU H H 1 7.868550294 0.006612834023 . . . . . . . 153 LEU H . 51825 1
497 . 1 . 1 153 153 LEU C C 13 176.9434447 0 . . . . . . . 153 LEU C . 51825 1
498 . 1 . 1 153 153 LEU CA C 13 58.62542118 0 . . . . . . . 153 LEU CA . 51825 1
499 . 1 . 1 153 153 LEU CB C 13 38.957994 0 . . . . . . . 153 LEU CB . 51825 1
500 . 1 . 1 153 153 LEU N N 15 116.9683557 0.01618597234 . . . . . . . 153 LEU N . 51825 1
501 . 1 . 1 154 154 ARG H H 1 7.65718898 0.0155714614 . . . . . . . 154 ARG H . 51825 1
502 . 1 . 1 154 154 ARG C C 13 178.4089037 0 . . . . . . . 154 ARG C . 51825 1
503 . 1 . 1 154 154 ARG CA C 13 59.68915625 0 . . . . . . . 154 ARG CA . 51825 1
504 . 1 . 1 154 154 ARG CB C 13 30.24045278 0 . . . . . . . 154 ARG CB . 51825 1
505 . 1 . 1 154 154 ARG N N 15 116.790359 0.0773525083 . . . . . . . 154 ARG N . 51825 1
506 . 1 . 1 156 156 VAL H H 1 8.579697648 0.0108989501 . . . . . . . 156 VAL H . 51825 1
507 . 1 . 1 156 156 VAL C C 13 177.4625836 0 . . . . . . . 156 VAL C . 51825 1
508 . 1 . 1 156 156 VAL CA C 13 64.32275745 0 . . . . . . . 156 VAL CA . 51825 1
509 . 1 . 1 156 156 VAL CB C 13 36.97249492 0 . . . . . . . 156 VAL CB . 51825 1
510 . 1 . 1 156 156 VAL N N 15 116.9754638 0.05095491825 . . . . . . . 156 VAL N . 51825 1
511 . 1 . 1 157 157 GLU H H 1 8.181909984 0.01274957933 . . . . . . . 157 GLU H . 51825 1
512 . 1 . 1 157 157 GLU C C 13 178.7669501 0 . . . . . . . 157 GLU C . 51825 1
513 . 1 . 1 157 157 GLU CA C 13 60.53185491 0 . . . . . . . 157 GLU CA . 51825 1
514 . 1 . 1 157 157 GLU CB C 13 28.92225799 0 . . . . . . . 157 GLU CB . 51825 1
515 . 1 . 1 157 157 GLU N N 15 117.1552619 0 . . . . . . . 157 GLU N . 51825 1
516 . 1 . 1 158 158 ALA H H 1 9.028258789 0.01494447767 . . . . . . . 158 ALA H . 51825 1
517 . 1 . 1 158 158 ALA C C 13 177.9663553 0 . . . . . . . 158 ALA C . 51825 1
518 . 1 . 1 158 158 ALA CA C 13 55.11808885 0 . . . . . . . 158 ALA CA . 51825 1
519 . 1 . 1 158 158 ALA CB C 13 19.95127051 0 . . . . . . . 158 ALA CB . 51825 1
520 . 1 . 1 158 158 ALA N N 15 123.6739362 0.04874441241 . . . . . . . 158 ALA N . 51825 1
521 . 1 . 1 161 161 TRP H H 1 8.251226937 0.009302094071 . . . . . . . 161 TRP H . 51825 1
522 . 1 . 1 161 161 TRP C C 13 179.0513979 0 . . . . . . . 161 TRP C . 51825 1
523 . 1 . 1 161 161 TRP CA C 13 61.97496646 0 . . . . . . . 161 TRP CA . 51825 1
524 . 1 . 1 161 161 TRP CB C 13 28.17937892 0 . . . . . . . 161 TRP CB . 51825 1
525 . 1 . 1 161 161 TRP N N 15 120.1324163 0.06446658403 . . . . . . . 161 TRP N . 51825 1
526 . 1 . 1 162 162 THR H H 1 8.722039813 0.008328959395 . . . . . . . 162 THR H . 51825 1
527 . 1 . 1 162 162 THR C C 13 176.8320764 0 . . . . . . . 162 THR C . 51825 1
528 . 1 . 1 162 162 THR CA C 13 66.42295497 0 . . . . . . . 162 THR CA . 51825 1
529 . 1 . 1 162 162 THR CB C 13 69.20072762 0 . . . . . . . 162 THR CB . 51825 1
530 . 1 . 1 162 162 THR N N 15 113.4883784 0.03787201242 . . . . . . . 162 THR N . 51825 1
531 . 1 . 1 163 163 ASP H H 1 8.502199457 0.01240270312 . . . . . . . 163 ASP H . 51825 1
532 . 1 . 1 163 163 ASP C C 13 177.3448912 0 . . . . . . . 163 ASP C . 51825 1
533 . 1 . 1 163 163 ASP CA C 13 57.96759142 0 . . . . . . . 163 ASP CA . 51825 1
534 . 1 . 1 163 163 ASP CB C 13 40.79251019 0 . . . . . . . 163 ASP CB . 51825 1
535 . 1 . 1 163 163 ASP N N 15 123.8152225 0.03194915243 . . . . . . . 163 ASP N . 51825 1
536 . 1 . 1 166 166 GLY H H 1 7.742244121 0.01239696842 . . . . . . . 166 GLY H . 51825 1
537 . 1 . 1 166 166 GLY CA C 13 46.44974227 0 . . . . . . . 166 GLY CA . 51825 1
538 . 1 . 1 166 166 GLY N N 15 100.8044461 0.02412339906 . . . . . . . 166 GLY N . 51825 1
539 . 1 . 1 167 167 THR H H 1 6.927277057 0.005668645125 . . . . . . . 167 THR H . 51825 1
540 . 1 . 1 167 167 THR C C 13 172.851286 0 . . . . . . . 167 THR C . 51825 1
541 . 1 . 1 167 167 THR CA C 13 60.13320414 0 . . . . . . . 167 THR CA . 51825 1
542 . 1 . 1 167 167 THR CB C 13 71.42948193 0 . . . . . . . 167 THR CB . 51825 1
543 . 1 . 1 167 167 THR N N 15 107.5158992 0.0515556593 . . . . . . . 167 THR N . 51825 1
544 . 1 . 1 168 168 VAL H H 1 8.901961911 0.01163750654 . . . . . . . 168 VAL H . 51825 1
545 . 1 . 1 168 168 VAL C C 13 174.3528841 0 . . . . . . . 168 VAL C . 51825 1
546 . 1 . 1 168 168 VAL CA C 13 60.48576923 0 . . . . . . . 168 VAL CA . 51825 1
547 . 1 . 1 168 168 VAL CB C 13 32.93102062 0 . . . . . . . 168 VAL CB . 51825 1
548 . 1 . 1 168 168 VAL N N 15 110.8076575 0.04063136764 . . . . . . . 168 VAL N . 51825 1
549 . 1 . 1 169 169 LEU H H 1 7.975703388 0.01304532844 . . . . . . . 169 LEU H . 51825 1
550 . 1 . 1 169 169 LEU C C 13 172.4656964 0 . . . . . . . 169 LEU C . 51825 1
551 . 1 . 1 169 169 LEU CA C 13 51.74220148 0 . . . . . . . 169 LEU CA . 51825 1
552 . 1 . 1 169 169 LEU CB C 13 41.94245754 0 . . . . . . . 169 LEU CB . 51825 1
553 . 1 . 1 169 169 LEU N N 15 120.8631222 0.04547463922 . . . . . . . 169 LEU N . 51825 1
554 . 1 . 1 171 171 CYS H H 1 7.441438048 0.01847891848 . . . . . . . 171 CYS H . 51825 1
555 . 1 . 1 171 171 CYS C C 13 173.891221 0 . . . . . . . 171 CYS C . 51825 1
556 . 1 . 1 171 171 CYS CA C 13 62.62720166 0 . . . . . . . 171 CYS CA . 51825 1
557 . 1 . 1 171 171 CYS CB C 13 29.26176598 0 . . . . . . . 171 CYS CB . 51825 1
558 . 1 . 1 171 171 CYS N N 15 120.2636766 0.07248311174 . . . . . . . 171 CYS N . 51825 1
559 . 1 . 1 173 173 TRP H H 1 6.552473926 0.01267543609 . . . . . . . 173 TRP H . 51825 1
560 . 1 . 1 173 173 TRP C C 13 177.0351638 0 . . . . . . . 173 TRP C . 51825 1
561 . 1 . 1 173 173 TRP CA C 13 56.33079299 0 . . . . . . . 173 TRP CA . 51825 1
562 . 1 . 1 173 173 TRP CB C 13 28.71769856 0 . . . . . . . 173 TRP CB . 51825 1
563 . 1 . 1 173 173 TRP N N 15 114.4225662 0.06819605582 . . . . . . . 173 TRP N . 51825 1
564 . 1 . 1 176 176 GLY H H 1 8.002440956 0.01184549717 . . . . . . . 176 GLY H . 51825 1
565 . 1 . 1 176 176 GLY C C 13 173.6928823 0 . . . . . . . 176 GLY C . 51825 1
566 . 1 . 1 176 176 GLY CA C 13 45.1749714 0 . . . . . . . 176 GLY CA . 51825 1
567 . 1 . 1 176 176 GLY N N 15 114.198524 0.04206446273 . . . . . . . 176 GLY N . 51825 1
568 . 1 . 1 177 177 ALA H H 1 7.771946885 0.01001399287 . . . . . . . 177 ALA H . 51825 1
569 . 1 . 1 177 177 ALA C C 13 176.1212703 0 . . . . . . . 177 ALA C . 51825 1
570 . 1 . 1 177 177 ALA CA C 13 51.91355959 0 . . . . . . . 177 ALA CA . 51825 1
571 . 1 . 1 177 177 ALA CB C 13 19.79364578 0 . . . . . . . 177 ALA CB . 51825 1
572 . 1 . 1 177 177 ALA N N 15 123.6308288 0.04559743625 . . . . . . . 177 ALA N . 51825 1
573 . 1 . 1 178 178 ALA H H 1 8.301564479 0.009963429161 . . . . . . . 178 ALA H . 51825 1
574 . 1 . 1 178 178 ALA C C 13 176.2045183 0 . . . . . . . 178 ALA C . 51825 1
575 . 1 . 1 178 178 ALA CA C 13 54.09249851 0 . . . . . . . 178 ALA CA . 51825 1
576 . 1 . 1 178 178 ALA CB C 13 19.83520082 0 . . . . . . . 178 ALA CB . 51825 1
577 . 1 . 1 178 178 ALA N N 15 122.1819818 0.03731516323 . . . . . . . 178 ALA N . 51825 1
578 . 1 . 1 179 179 THR H H 1 7.95876576 0.009780255429 . . . . . . . 179 THR H . 51825 1
579 . 1 . 1 179 179 THR C C 13 171.0440844 0 . . . . . . . 179 THR C . 51825 1
580 . 1 . 1 179 179 THR CA C 13 60.5483782 0 . . . . . . . 179 THR CA . 51825 1
581 . 1 . 1 179 179 THR CB C 13 72.65819162 0 . . . . . . . 179 THR CB . 51825 1
582 . 1 . 1 179 179 THR N N 15 107.7431175 0.05225863102 . . . . . . . 179 THR N . 51825 1
583 . 1 . 1 180 180 ILE H H 1 8.114290847 0.008888064951 . . . . . . . 180 ILE H . 51825 1
584 . 1 . 1 180 180 ILE C C 13 174.6375343 0 . . . . . . . 180 ILE C . 51825 1
585 . 1 . 1 180 180 ILE CA C 13 60.794063 0 . . . . . . . 180 ILE CA . 51825 1
586 . 1 . 1 180 180 ILE CB C 13 39.97717581 0 . . . . . . . 180 ILE CB . 51825 1
587 . 1 . 1 180 180 ILE N N 15 115.5644188 0.0674963879 . . . . . . . 180 ILE N . 51825 1
588 . 1 . 1 181 181 LYS H H 1 9.004354819 0.0115565693 . . . . . . . 181 LYS H . 51825 1
589 . 1 . 1 181 181 LYS C C 13 174.8110134 0 . . . . . . . 181 LYS C . 51825 1
590 . 1 . 1 181 181 LYS CA C 13 54.18148837 0 . . . . . . . 181 LYS CA . 51825 1
591 . 1 . 1 181 181 LYS CB C 13 33.11818365 0 . . . . . . . 181 LYS CB . 51825 1
592 . 1 . 1 181 181 LYS N N 15 129.8264717 0.05969902897 . . . . . . . 181 LYS N . 51825 1
593 . 1 . 1 183 183 THR H H 1 8.459764862 0.009491961414 . . . . . . . 183 THR H . 51825 1
594 . 1 . 1 183 183 THR C C 13 174.3950271 0 . . . . . . . 183 THR C . 51825 1
595 . 1 . 1 183 183 THR CA C 13 60.13490295 0 . . . . . . . 183 THR CA . 51825 1
596 . 1 . 1 183 183 THR CB C 13 72.55858805 0 . . . . . . . 183 THR CB . 51825 1
597 . 1 . 1 183 183 THR N N 15 114.0875415 0.05280262177 . . . . . . . 183 THR N . 51825 1
598 . 1 . 1 184 184 VAL H H 1 9.462746547 0.01491137605 . . . . . . . 184 VAL H . 51825 1
599 . 1 . 1 184 184 VAL C C 13 177.5536521 0 . . . . . . . 184 VAL C . 51825 1
600 . 1 . 1 184 184 VAL CA C 13 68.7303001 0 . . . . . . . 184 VAL CA . 51825 1
601 . 1 . 1 184 184 VAL N N 15 124.6285078 0.05190901482 . . . . . . . 184 VAL N . 51825 1
602 . 1 . 1 185 185 GLU H H 1 9.00096335 0.01349802364 . . . . . . . 185 GLU H . 51825 1
603 . 1 . 1 185 185 GLU C C 13 178.8629507 0 . . . . . . . 185 GLU C . 51825 1
604 . 1 . 1 185 185 GLU CA C 13 59.95159313 0.01695857614 . . . . . . . 185 GLU CA . 51825 1
605 . 1 . 1 185 185 GLU CB C 13 29.94528082 0 . . . . . . . 185 GLU CB . 51825 1
606 . 1 . 1 185 185 GLU N N 15 115.404496 0.05266934756 . . . . . . . 185 GLU N . 51825 1
607 . 1 . 1 192 192 GLU H H 1 8.726926459 0.0133167962 . . . . . . . 192 GLU H . 51825 1
608 . 1 . 1 192 192 GLU C C 13 176.9336201 0 . . . . . . . 192 GLU C . 51825 1
609 . 1 . 1 192 192 GLU CA C 13 59.89566102 0 . . . . . . . 192 GLU CA . 51825 1
610 . 1 . 1 192 192 GLU CB C 13 29.62580842 0 . . . . . . . 192 GLU CB . 51825 1
611 . 1 . 1 192 192 GLU N N 15 117.7032714 0.08915122504 . . . . . . . 192 GLU N . 51825 1
612 . 1 . 1 193 193 ALA H H 1 7.007056972 0.009931841413 . . . . . . . 193 ALA H . 51825 1
613 . 1 . 1 193 193 ALA C C 13 178.8857616 0 . . . . . . . 193 ALA C . 51825 1
614 . 1 . 1 193 193 ALA CA C 13 54.7606397 0 . . . . . . . 193 ALA CA . 51825 1
615 . 1 . 1 193 193 ALA CB C 13 18.80490694 0 . . . . . . . 193 ALA CB . 51825 1
616 . 1 . 1 193 193 ALA N N 15 119.5207586 0.04205044068 . . . . . . . 193 ALA N . 51825 1
617 . 1 . 1 194 194 ALA H H 1 8.150931035 0.01247760196 . . . . . . . 194 ALA H . 51825 1
618 . 1 . 1 194 194 ALA C C 13 176.7305326 0 . . . . . . . 194 ALA C . 51825 1
619 . 1 . 1 194 194 ALA CA C 13 53.92640008 0 . . . . . . . 194 ALA CA . 51825 1
620 . 1 . 1 194 194 ALA CB C 13 18.7960342 0 . . . . . . . 194 ALA CB . 51825 1
621 . 1 . 1 194 194 ALA N N 15 117.9194684 0.02362022173 . . . . . . . 194 ALA N . 51825 1
622 . 1 . 1 195 195 ASN H H 1 6.889616546 0.008197066063 . . . . . . . 195 ASN H . 51825 1
623 . 1 . 1 195 195 ASN C C 13 171.9776717 0 . . . . . . . 195 ASN C . 51825 1
624 . 1 . 1 195 195 ASN CA C 13 53.55787926 0 . . . . . . . 195 ASN CA . 51825 1
625 . 1 . 1 195 195 ASN CB C 13 41.24958467 0 . . . . . . . 195 ASN CB . 51825 1
626 . 1 . 1 195 195 ASN N N 15 114.289882 0.01735772912 . . . . . . . 195 ASN N . 51825 1
627 . 1 . 1 196 196 LYS H H 1 7.503460601 0.01625690479 . . . . . . . 196 LYS H . 51825 1
628 . 1 . 1 196 196 LYS CA C 13 58.95024322 0 . . . . . . . 196 LYS CA . 51825 1
629 . 1 . 1 196 196 LYS CB C 13 33.19804269 0 . . . . . . . 196 LYS CB . 51825 1
630 . 1 . 1 196 196 LYS N N 15 125.5546533 0.06312459578 . . . . . . . 196 LYS N . 51825 1
stop_
save_