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 50334
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name CS_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 .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
2 '3D 1H-15N NOESY' . . . 50334 1
3 '2D 1H-15N HSQC' . . . 50334 1
4 '3D HNCACB' . . . 50334 1
5 '3D HN(COCA)CB' . . . 50334 1
6 '3D HNCACO' . . . 50334 1
7 '3D HNCO' . . . 50334 1
8 '2D BEST-TROSY' . . . 50334 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 . . 50334 1
2 $software_2 . . 50334 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 2 2 ALA C C 13 175.074 0.000 . 1 . . . . . -2 ALA C . 50334 1
2 . 1 . 1 2 2 ALA CA C 13 52.699 0.000 . 1 . . . . . -2 ALA CA . 50334 1
3 . 1 . 1 2 2 ALA CB C 13 19.324 0.000 . 1 . . . . . -2 ALA CB . 50334 1
4 . 1 . 1 3 3 MET H H 1 8.500 0.004 . 1 . . . . . -1 MET H . 50334 1
5 . 1 . 1 3 3 MET C C 13 173.856 0.001 . 1 . . . . . -1 MET C . 50334 1
6 . 1 . 1 3 3 MET CA C 13 55.541 0.021 . 1 . . . . . -1 MET CA . 50334 1
7 . 1 . 1 3 3 MET CB C 13 32.814 0.032 . 1 . . . . . -1 MET CB . 50334 1
8 . 1 . 1 3 3 MET N N 15 119.641 0.033 . 1 . . . . . -1 MET N . 50334 1
9 . 1 . 1 4 4 GLY H H 1 8.291 0.002 . 1 . . . . . 0 GLY H . 50334 1
10 . 1 . 1 4 4 GLY C C 13 170.716 0.005 . 1 . . . . . 0 GLY C . 50334 1
11 . 1 . 1 4 4 GLY CA C 13 45.172 0.003 . 1 . . . . . 0 GLY CA . 50334 1
12 . 1 . 1 4 4 GLY N N 15 109.866 0.020 . 1 . . . . . 0 GLY N . 50334 1
13 . 1 . 1 5 5 TYR H H 1 7.963 0.001 . 1 . . . . . 1 TYR H . 50334 1
14 . 1 . 1 5 5 TYR C C 13 172.707 0.012 . 1 . . . . . 1 TYR C . 50334 1
15 . 1 . 1 5 5 TYR CA C 13 57.771 0.028 . 1 . . . . . 1 TYR CA . 50334 1
16 . 1 . 1 5 5 TYR CB C 13 38.932 0.065 . 1 . . . . . 1 TYR CB . 50334 1
17 . 1 . 1 5 5 TYR N N 15 120.005 0.029 . 1 . . . . . 1 TYR N . 50334 1
18 . 1 . 1 6 6 PHE H H 1 8.178 0.002 . 1 . . . . . 2 PHE H . 50334 1
19 . 1 . 1 6 6 PHE C C 13 172.778 0.001 . 1 . . . . . 2 PHE C . 50334 1
20 . 1 . 1 6 6 PHE CA C 13 57.611 0.027 . 1 . . . . . 2 PHE CA . 50334 1
21 . 1 . 1 6 6 PHE CB C 13 39.744 0.007 . 1 . . . . . 2 PHE CB . 50334 1
22 . 1 . 1 6 6 PHE N N 15 121.952 0.023 . 1 . . . . . 2 PHE N . 50334 1
23 . 1 . 1 7 7 THR H H 1 8.000 0.003 . 1 . . . . . 3 THR H . 50334 1
24 . 1 . 1 7 7 THR C C 13 171.375 0.005 . 1 . . . . . 3 THR C . 50334 1
25 . 1 . 1 7 7 THR CA C 13 61.800 0.006 . 1 . . . . . 3 THR CA . 50334 1
26 . 1 . 1 7 7 THR CB C 13 69.808 0.007 . 1 . . . . . 3 THR CB . 50334 1
27 . 1 . 1 7 7 THR N N 15 115.705 0.056 . 1 . . . . . 3 THR N . 50334 1
28 . 1 . 1 8 8 GLU H H 1 8.372 0.001 . 1 . . . . . 4 GLU H . 50334 1
29 . 1 . 1 8 8 GLU C C 13 173.205 0.004 . 1 . . . . . 4 GLU C . 50334 1
30 . 1 . 1 8 8 GLU CA C 13 56.606 0.005 . 1 . . . . . 4 GLU CA . 50334 1
31 . 1 . 1 8 8 GLU CB C 13 30.370 0.005 . 1 . . . . . 4 GLU CB . 50334 1
32 . 1 . 1 8 8 GLU N N 15 123.053 0.021 . 1 . . . . . 4 GLU N . 50334 1
33 . 1 . 1 9 9 GLN H H 1 8.355 0.000 . 1 . . . . . 5 GLN H . 50334 1
34 . 1 . 1 9 9 GLN HE21 H 1 7.601 0.002 . 1 . . . . . 5 GLN HE21 . 50334 1
35 . 1 . 1 9 9 GLN HE22 H 1 6.900 0.002 . 1 . . . . . 5 GLN HE22 . 50334 1
36 . 1 . 1 9 9 GLN C C 13 171.015 0.000 . 1 . . . . . 5 GLN C . 50334 1
37 . 1 . 1 9 9 GLN CA C 13 53.397 0.000 . 1 . . . . . 5 GLN CA . 50334 1
38 . 1 . 1 9 9 GLN CB C 13 29.441 0.000 . 1 . . . . . 5 GLN CB . 50334 1
39 . 1 . 1 9 9 GLN CG C 13 33.414 0.000 . 1 . . . . . 5 GLN CG . 50334 1
40 . 1 . 1 9 9 GLN N N 15 122.186 0.017 . 1 . . . . . 5 GLN N . 50334 1
41 . 1 . 1 9 9 GLN NE2 N 15 112.941 0.025 . 1 . . . . . 5 GLN NE2 . 50334 1
42 . 1 . 1 10 10 PRO C C 13 173.628 0.000 . 1 . . . . . 6 PRO C . 50334 1
43 . 1 . 1 10 10 PRO CA C 13 62.669 0.006 . 1 . . . . . 6 PRO CA . 50334 1
44 . 1 . 1 10 10 PRO CB C 13 31.456 0.017 . 1 . . . . . 6 PRO CB . 50334 1
45 . 1 . 1 11 11 ILE H H 1 8.196 0.003 . 1 . . . . . 7 ILE H . 50334 1
46 . 1 . 1 11 11 ILE C C 13 172.801 0.012 . 1 . . . . . 7 ILE C . 50334 1
47 . 1 . 1 11 11 ILE CA C 13 61.125 0.017 . 1 . . . . . 7 ILE CA . 50334 1
48 . 1 . 1 11 11 ILE CB C 13 38.750 0.017 . 1 . . . . . 7 ILE CB . 50334 1
49 . 1 . 1 11 11 ILE N N 15 121.597 0.032 . 1 . . . . . 7 ILE N . 50334 1
50 . 1 . 1 12 12 ASP H H 1 7.987 0.013 . 1 . . . . . 8 ASP H . 50334 1
51 . 1 . 1 12 12 ASP C C 13 171.895 0.005 . 1 . . . . . 8 ASP C . 50334 1
52 . 1 . 1 12 12 ASP CA C 13 53.987 0.041 . 1 . . . . . 8 ASP CA . 50334 1
53 . 1 . 1 12 12 ASP CB C 13 40.375 0.038 . 1 . . . . . 8 ASP CB . 50334 1
54 . 1 . 1 12 12 ASP N N 15 125.481 0.114 . 1 . . . . . 8 ASP N . 50334 1
55 . 1 . 1 13 13 LEU H H 1 7.549 0.002 . 1 . . . . . 9 LEU H . 50334 1
56 . 1 . 1 13 13 LEU C C 13 174.174 0.004 . 1 . . . . . 9 LEU C . 50334 1
57 . 1 . 1 13 13 LEU CA C 13 54.419 0.012 . 1 . . . . . 9 LEU CA . 50334 1
58 . 1 . 1 13 13 LEU CB C 13 44.085 0.006 . 1 . . . . . 9 LEU CB . 50334 1
59 . 1 . 1 13 13 LEU N N 15 122.261 0.029 . 1 . . . . . 9 LEU N . 50334 1
60 . 1 . 1 14 14 VAL H H 1 8.854 0.005 . 1 . . . . . 10 VAL H . 50334 1
61 . 1 . 1 14 14 VAL C C 13 170.874 0.000 . 1 . . . . . 10 VAL C . 50334 1
62 . 1 . 1 14 14 VAL CA C 13 58.300 0.000 . 1 . . . . . 10 VAL CA . 50334 1
63 . 1 . 1 14 14 VAL CB C 13 34.147 0.000 . 1 . . . . . 10 VAL CB . 50334 1
64 . 1 . 1 14 14 VAL N N 15 119.229 0.013 . 1 . . . . . 10 VAL N . 50334 1
65 . 1 . 1 15 15 PRO C C 13 171.730 0.000 . 1 . . . . . 11 PRO C . 50334 1
66 . 1 . 1 15 15 PRO CA C 13 63.707 0.001 . 1 . . . . . 11 PRO CA . 50334 1
67 . 1 . 1 15 15 PRO CB C 13 32.732 0.003 . 1 . . . . . 11 PRO CB . 50334 1
68 . 1 . 1 16 16 ASN H H 1 7.538 0.004 . 1 . . . . . 12 ASN H . 50334 1
69 . 1 . 1 16 16 ASN C C 13 178.600 0.004 . 1 . . . . . 12 ASN C . 50334 1
70 . 1 . 1 16 16 ASN CA C 13 49.832 0.003 . 1 . . . . . 12 ASN CA . 50334 1
71 . 1 . 1 16 16 ASN CB C 13 42.072 0.003 . 1 . . . . . 12 ASN CB . 50334 1
72 . 1 . 1 16 16 ASN N N 15 118.386 0.021 . 1 . . . . . 12 ASN N . 50334 1
73 . 1 . 1 17 17 GLN H H 1 7.360 0.005 . 1 . . . . . 13 GLN H . 50334 1
74 . 1 . 1 17 17 GLN HE21 H 1 7.500 0.002 . 1 . . . . . 13 GLN HE21 . 50334 1
75 . 1 . 1 17 17 GLN HE22 H 1 6.801 0.001 . 1 . . . . . 13 GLN HE22 . 50334 1
76 . 1 . 1 17 17 GLN C C 13 170.419 0.000 . 1 . . . . . 13 GLN C . 50334 1
77 . 1 . 1 17 17 GLN CA C 13 53.787 0.000 . 1 . . . . . 13 GLN CA . 50334 1
78 . 1 . 1 17 17 GLN CB C 13 29.116 0.000 . 1 . . . . . 13 GLN CB . 50334 1
79 . 1 . 1 17 17 GLN CG C 13 32.124 0.000 . 1 . . . . . 13 GLN CG . 50334 1
80 . 1 . 1 17 17 GLN N N 15 112.497 0.033 . 1 . . . . . 13 GLN N . 50334 1
81 . 1 . 1 17 17 GLN NE2 N 15 112.649 0.027 . 1 . . . . . 13 GLN NE2 . 50334 1
82 . 1 . 1 18 18 PRO C C 13 174.034 0.000 . 1 . . . . . 14 PRO C . 50334 1
83 . 1 . 1 18 18 PRO CA C 13 62.806 0.002 . 1 . . . . . 14 PRO CA . 50334 1
84 . 1 . 1 18 18 PRO CB C 13 32.388 0.002 . 1 . . . . . 14 PRO CB . 50334 1
85 . 1 . 1 19 19 TYR H H 1 8.920 0.002 . 1 . . . . . 15 TYR H . 50334 1
86 . 1 . 1 19 19 TYR C C 13 172.806 0.000 . 1 . . . . . 15 TYR C . 50334 1
87 . 1 . 1 19 19 TYR CA C 13 56.804 0.000 . 1 . . . . . 15 TYR CA . 50334 1
88 . 1 . 1 19 19 TYR CB C 13 38.177 0.000 . 1 . . . . . 15 TYR CB . 50334 1
89 . 1 . 1 19 19 TYR N N 15 123.871 0.025 . 1 . . . . . 15 TYR N . 50334 1
90 . 1 . 1 20 20 PRO C C 13 174.358 0.000 . 1 . . . . . 16 PRO C . 50334 1
91 . 1 . 1 20 20 PRO CA C 13 64.263 0.010 . 1 . . . . . 16 PRO CA . 50334 1
92 . 1 . 1 20 20 PRO CB C 13 31.846 0.007 . 1 . . . . . 16 PRO CB . 50334 1
93 . 1 . 1 21 21 ASN H H 1 8.597 0.003 . 1 . . . . . 17 ASN H . 50334 1
94 . 1 . 1 21 21 ASN HD21 H 1 7.641 0.007 . 1 . . . . . 17 ASN HD21 . 50334 1
95 . 1 . 1 21 21 ASN HD22 H 1 6.986 0.002 . 1 . . . . . 17 ASN HD22 . 50334 1
96 . 1 . 1 21 21 ASN C C 13 171.600 0.005 . 1 . . . . . 17 ASN C . 50334 1
97 . 1 . 1 21 21 ASN CA C 13 53.358 0.007 . 1 . . . . . 17 ASN CA . 50334 1
98 . 1 . 1 21 21 ASN CB C 13 37.559 0.004 . 1 . . . . . 17 ASN CB . 50334 1
99 . 1 . 1 21 21 ASN N N 15 114.516 0.021 . 1 . . . . . 17 ASN N . 50334 1
100 . 1 . 1 21 21 ASN ND2 N 15 113.981 0.042 . 1 . . . . . 17 ASN ND2 . 50334 1
101 . 1 . 1 22 22 ALA H H 1 7.482 0.004 . 1 . . . . . 18 ALA H . 50334 1
102 . 1 . 1 22 22 ALA C C 13 174.077 0.006 . 1 . . . . . 18 ALA C . 50334 1
103 . 1 . 1 22 22 ALA CA C 13 52.326 0.002 . 1 . . . . . 18 ALA CA . 50334 1
104 . 1 . 1 22 22 ALA CB C 13 21.522 0.007 . 1 . . . . . 18 ALA CB . 50334 1
105 . 1 . 1 22 22 ALA N N 15 121.847 0.025 . 1 . . . . . 18 ALA N . 50334 1
106 . 1 . 1 23 23 SER H H 1 8.919 0.003 . 1 . . . . . 19 SER H . 50334 1
107 . 1 . 1 23 23 SER C C 13 170.129 0.004 . 1 . . . . . 19 SER C . 50334 1
108 . 1 . 1 23 23 SER CA C 13 57.247 0.011 . 1 . . . . . 19 SER CA . 50334 1
109 . 1 . 1 23 23 SER CB C 13 65.830 0.007 . 1 . . . . . 19 SER CB . 50334 1
110 . 1 . 1 23 23 SER N N 15 113.623 0.028 . 1 . . . . . 19 SER N . 50334 1
111 . 1 . 1 24 24 PHE H H 1 7.860 0.002 . 1 . . . . . 20 PHE H . 50334 1
112 . 1 . 1 24 24 PHE C C 13 172.661 0.005 . 1 . . . . . 20 PHE C . 50334 1
113 . 1 . 1 24 24 PHE CA C 13 58.240 0.009 . 1 . . . . . 20 PHE CA . 50334 1
114 . 1 . 1 24 24 PHE CB C 13 38.433 0.010 . 1 . . . . . 20 PHE CB . 50334 1
115 . 1 . 1 24 24 PHE N N 15 124.148 0.034 . 1 . . . . . 20 PHE N . 50334 1
116 . 1 . 1 25 25 ASP H H 1 8.342 0.005 . 1 . . . . . 21 ASP H . 50334 1
117 . 1 . 1 25 25 ASP C C 13 173.679 0.000 . 1 . . . . . 21 ASP C . 50334 1
118 . 1 . 1 25 25 ASP CA C 13 52.531 0.000 . 1 . . . . . 21 ASP CA . 50334 1
119 . 1 . 1 25 25 ASP CB C 13 39.271 0.000 . 1 . . . . . 21 ASP CB . 50334 1
120 . 1 . 1 25 25 ASP N N 15 126.962 0.029 . 1 . . . . . 21 ASP N . 50334 1
121 . 1 . 1 27 27 PHE H H 1 5.560 0.002 . 1 . . . . . 23 PHE H . 50334 1
122 . 1 . 1 27 27 PHE C C 13 169.306 0.000 . 1 . . . . . 23 PHE C . 50334 1
123 . 1 . 1 27 27 PHE CA C 13 55.369 0.000 . 1 . . . . . 23 PHE CA . 50334 1
124 . 1 . 1 27 27 PHE CB C 13 40.639 0.004 . 1 . . . . . 23 PHE CB . 50334 1
125 . 1 . 1 27 27 PHE N N 15 113.772 0.013 . 1 . . . . . 23 PHE N . 50334 1
126 . 1 . 1 28 28 LYS H H 1 8.105 0.002 . 1 . . . . . 24 LYS H . 50334 1
127 . 1 . 1 28 28 LYS C C 13 172.052 0.006 . 1 . . . . . 24 LYS C . 50334 1
128 . 1 . 1 28 28 LYS CA C 13 53.730 0.002 . 1 . . . . . 24 LYS CA . 50334 1
129 . 1 . 1 28 28 LYS CB C 13 36.306 0.003 . 1 . . . . . 24 LYS CB . 50334 1
130 . 1 . 1 28 28 LYS N N 15 115.261 0.009 . 1 . . . . . 24 LYS N . 50334 1
131 . 1 . 1 29 29 PHE H H 1 9.942 0.004 . 1 . . . . . 25 PHE H . 50334 1
132 . 1 . 1 29 29 PHE C C 13 173.967 0.005 . 1 . . . . . 25 PHE C . 50334 1
133 . 1 . 1 29 29 PHE CA C 13 58.092 0.004 . 1 . . . . . 25 PHE CA . 50334 1
134 . 1 . 1 29 29 PHE CB C 13 40.583 0.001 . 1 . . . . . 25 PHE CB . 50334 1
135 . 1 . 1 29 29 PHE N N 15 122.485 0.020 . 1 . . . . . 25 PHE N . 50334 1
136 . 1 . 1 30 30 VAL H H 1 8.985 0.005 . 1 . . . . . 26 VAL H . 50334 1
137 . 1 . 1 30 30 VAL C C 13 171.111 0.004 . 1 . . . . . 26 VAL C . 50334 1
138 . 1 . 1 30 30 VAL CA C 13 60.489 0.006 . 1 . . . . . 26 VAL CA . 50334 1
139 . 1 . 1 30 30 VAL CB C 13 35.109 0.001 . 1 . . . . . 26 VAL CB . 50334 1
140 . 1 . 1 30 30 VAL N N 15 117.738 0.021 . 1 . . . . . 26 VAL N . 50334 1
141 . 1 . 1 31 31 CYS H H 1 8.593 0.012 . 1 . . . . . 27 CYS H . 50334 1
142 . 1 . 1 31 31 CYS C C 13 169.757 0.001 . 1 . . . . . 27 CYS C . 50334 1
143 . 1 . 1 31 31 CYS CA C 13 58.398 0.006 . 1 . . . . . 27 CYS CA . 50334 1
144 . 1 . 1 31 31 CYS CB C 13 30.393 0.002 . 1 . . . . . 27 CYS CB . 50334 1
145 . 1 . 1 31 31 CYS N N 15 123.290 0.166 . 1 . . . . . 27 CYS N . 50334 1
146 . 1 . 1 32 32 ASP H H 1 9.292 0.003 . 1 . . . . . 28 ASP H . 50334 1
147 . 1 . 1 32 32 ASP C C 13 174.487 0.002 . 1 . . . . . 28 ASP C . 50334 1
148 . 1 . 1 32 32 ASP CA C 13 57.418 0.013 . 1 . . . . . 28 ASP CA . 50334 1
149 . 1 . 1 32 32 ASP CB C 13 40.198 0.004 . 1 . . . . . 28 ASP CB . 50334 1
150 . 1 . 1 32 32 ASP N N 15 129.249 0.031 . 1 . . . . . 28 ASP N . 50334 1
151 . 1 . 1 33 33 ASN H H 1 7.880 0.004 . 1 . . . . . 29 ASN H . 50334 1
152 . 1 . 1 33 33 ASN C C 13 171.283 0.003 . 1 . . . . . 29 ASN C . 50334 1
153 . 1 . 1 33 33 ASN CA C 13 52.753 0.002 . 1 . . . . . 29 ASN CA . 50334 1
154 . 1 . 1 33 33 ASN CB C 13 37.449 0.059 . 1 . . . . . 29 ASN CB . 50334 1
155 . 1 . 1 33 33 ASN N N 15 118.141 0.029 . 1 . . . . . 29 ASN N . 50334 1
156 . 1 . 1 34 34 ILE H H 1 7.930 0.003 . 1 . . . . . 30 ILE H . 50334 1
157 . 1 . 1 34 34 ILE C C 13 174.903 0.004 . 1 . . . . . 30 ILE C . 50334 1
158 . 1 . 1 34 34 ILE CA C 13 64.174 0.011 . 1 . . . . . 30 ILE CA . 50334 1
159 . 1 . 1 34 34 ILE CB C 13 37.984 0.040 . 1 . . . . . 30 ILE CB . 50334 1
160 . 1 . 1 34 34 ILE N N 15 126.289 0.020 . 1 . . . . . 30 ILE N . 50334 1
161 . 1 . 1 35 35 LYS H H 1 8.144 0.002 . 1 . . . . . 31 LYS H . 50334 1
162 . 1 . 1 35 35 LYS C C 13 174.627 0.004 . 1 . . . . . 31 LYS C . 50334 1
163 . 1 . 1 35 35 LYS CA C 13 58.792 0.007 . 1 . . . . . 31 LYS CA . 50334 1
164 . 1 . 1 35 35 LYS CB C 13 32.255 0.004 . 1 . . . . . 31 LYS CB . 50334 1
165 . 1 . 1 35 35 LYS N N 15 120.579 0.030 . 1 . . . . . 31 LYS N . 50334 1
166 . 1 . 1 36 36 PHE H H 1 7.894 0.002 . 1 . . . . . 32 PHE H . 50334 1
167 . 1 . 1 36 36 PHE C C 13 174.912 0.004 . 1 . . . . . 32 PHE C . 50334 1
168 . 1 . 1 36 36 PHE CA C 13 61.049 0.008 . 1 . . . . . 32 PHE CA . 50334 1
169 . 1 . 1 36 36 PHE CB C 13 39.096 0.006 . 1 . . . . . 32 PHE CB . 50334 1
170 . 1 . 1 36 36 PHE N N 15 119.464 0.024 . 1 . . . . . 32 PHE N . 50334 1
171 . 1 . 1 37 37 ALA H H 1 7.275 0.005 . 1 . . . . . 33 ALA H . 50334 1
172 . 1 . 1 37 37 ALA C C 13 175.781 0.004 . 1 . . . . . 33 ALA C . 50334 1
173 . 1 . 1 37 37 ALA CA C 13 55.475 0.003 . 1 . . . . . 33 ALA CA . 50334 1
174 . 1 . 1 37 37 ALA CB C 13 17.925 0.001 . 1 . . . . . 33 ALA CB . 50334 1
175 . 1 . 1 37 37 ALA N N 15 116.833 0.032 . 1 . . . . . 33 ALA N . 50334 1
176 . 1 . 1 38 38 ASP H H 1 8.881 0.003 . 1 . . . . . 34 ASP H . 50334 1
177 . 1 . 1 38 38 ASP C C 13 177.026 0.004 . 1 . . . . . 34 ASP C . 50334 1
178 . 1 . 1 38 38 ASP CA C 13 57.742 0.019 . 1 . . . . . 34 ASP CA . 50334 1
179 . 1 . 1 38 38 ASP CB C 13 40.299 0.015 . 1 . . . . . 34 ASP CB . 50334 1
180 . 1 . 1 38 38 ASP N N 15 118.401 0.028 . 1 . . . . . 34 ASP N . 50334 1
181 . 1 . 1 39 39 ASP H H 1 8.918 0.001 . 1 . . . . . 35 ASP H . 50334 1
182 . 1 . 1 39 39 ASP C C 13 177.804 0.005 . 1 . . . . . 35 ASP C . 50334 1
183 . 1 . 1 39 39 ASP CA C 13 57.513 0.032 . 1 . . . . . 35 ASP CA . 50334 1
184 . 1 . 1 39 39 ASP CB C 13 39.974 0.015 . 1 . . . . . 35 ASP CB . 50334 1
185 . 1 . 1 39 39 ASP N N 15 121.906 0.026 . 1 . . . . . 35 ASP N . 50334 1
186 . 1 . 1 40 40 LEU H H 1 8.133 0.002 . 1 . . . . . 36 LEU H . 50334 1
187 . 1 . 1 40 40 LEU C C 13 176.802 0.005 . 1 . . . . . 36 LEU C . 50334 1
188 . 1 . 1 40 40 LEU CA C 13 58.042 0.008 . 1 . . . . . 36 LEU CA . 50334 1
189 . 1 . 1 40 40 LEU CB C 13 42.299 0.004 . 1 . . . . . 36 LEU CB . 50334 1
190 . 1 . 1 40 40 LEU N N 15 121.785 0.016 . 1 . . . . . 36 LEU N . 50334 1
191 . 1 . 1 41 41 ASN H H 1 9.062 0.005 . 1 . . . . . 37 ASN H . 50334 1
192 . 1 . 1 41 41 ASN C C 13 176.469 0.003 . 1 . . . . . 37 ASN C . 50334 1
193 . 1 . 1 41 41 ASN CA C 13 55.368 0.001 . 1 . . . . . 37 ASN CA . 50334 1
194 . 1 . 1 41 41 ASN CB C 13 37.862 0.005 . 1 . . . . . 37 ASN CB . 50334 1
195 . 1 . 1 41 41 ASN N N 15 117.108 0.032 . 1 . . . . . 37 ASN N . 50334 1
196 . 1 . 1 42 42 GLN H H 1 8.184 0.003 . 1 . . . . . 38 GLN H . 50334 1
197 . 1 . 1 42 42 GLN HE21 H 1 7.537 0.001 . 1 . . . . . 38 GLN HE21 . 50334 1
198 . 1 . 1 42 42 GLN HE22 H 1 6.852 0.004 . 1 . . . . . 38 GLN HE22 . 50334 1
199 . 1 . 1 42 42 GLN C C 13 175.424 0.006 . 1 . . . . . 38 GLN C . 50334 1
200 . 1 . 1 42 42 GLN CA C 13 58.518 0.003 . 1 . . . . . 38 GLN CA . 50334 1
201 . 1 . 1 42 42 GLN CB C 13 28.455 0.003 . 1 . . . . . 38 GLN CB . 50334 1
202 . 1 . 1 42 42 GLN CG C 13 34.052 0.000 . 1 . . . . . 38 GLN CG . 50334 1
203 . 1 . 1 42 42 GLN N N 15 121.580 0.037 . 1 . . . . . 38 GLN N . 50334 1
204 . 1 . 1 42 42 GLN NE2 N 15 113.062 0.028 . 1 . . . . . 38 GLN NE2 . 50334 1
205 . 1 . 1 43 43 LEU H H 1 7.611 0.005 . 1 . . . . . 39 LEU H . 50334 1
206 . 1 . 1 43 43 LEU C C 13 176.998 0.004 . 1 . . . . . 39 LEU C . 50334 1
207 . 1 . 1 43 43 LEU CA C 13 57.378 0.002 . 1 . . . . . 39 LEU CA . 50334 1
208 . 1 . 1 43 43 LEU CB C 13 42.284 0.008 . 1 . . . . . 39 LEU CB . 50334 1
209 . 1 . 1 43 43 LEU N N 15 119.107 0.022 . 1 . . . . . 39 LEU N . 50334 1
210 . 1 . 1 44 44 THR H H 1 7.865 0.004 . 1 . . . . . 40 THR H . 50334 1
211 . 1 . 1 44 44 THR C C 13 173.283 0.005 . 1 . . . . . 40 THR C . 50334 1
212 . 1 . 1 44 44 THR CA C 13 62.944 0.008 . 1 . . . . . 40 THR CA . 50334 1
213 . 1 . 1 44 44 THR CB C 13 69.433 0.005 . 1 . . . . . 40 THR CB . 50334 1
214 . 1 . 1 44 44 THR N N 15 108.059 0.033 . 1 . . . . . 40 THR N . 50334 1
215 . 1 . 1 45 45 GLY H H 1 7.403 0.007 . 1 . . . . . 41 GLY H . 50334 1
216 . 1 . 1 45 45 GLY C C 13 172.433 0.006 . 1 . . . . . 41 GLY C . 50334 1
217 . 1 . 1 45 45 GLY CA C 13 45.964 0.006 . 1 . . . . . 41 GLY CA . 50334 1
218 . 1 . 1 45 45 GLY N N 15 106.298 0.033 . 1 . . . . . 41 GLY N . 50334 1
219 . 1 . 1 46 46 TYR H H 1 8.063 0.002 . 1 . . . . . 42 TYR H . 50334 1
220 . 1 . 1 46 46 TYR C C 13 170.855 0.001 . 1 . . . . . 42 TYR C . 50334 1
221 . 1 . 1 46 46 TYR CA C 13 58.263 0.003 . 1 . . . . . 42 TYR CA . 50334 1
222 . 1 . 1 46 46 TYR CB C 13 38.730 0.014 . 1 . . . . . 42 TYR CB . 50334 1
223 . 1 . 1 46 46 TYR N N 15 121.993 0.013 . 1 . . . . . 42 TYR N . 50334 1
224 . 1 . 1 47 47 LYS H H 1 8.805 0.008 . 1 . . . . . 43 LYS H . 50334 1
225 . 1 . 1 47 47 LYS C C 13 171.593 0.003 . 1 . . . . . 43 LYS C . 50334 1
226 . 1 . 1 47 47 LYS CA C 13 53.737 0.003 . 1 . . . . . 43 LYS CA . 50334 1
227 . 1 . 1 47 47 LYS CB C 13 35.293 0.005 . 1 . . . . . 43 LYS CB . 50334 1
228 . 1 . 1 47 47 LYS N N 15 127.073 0.009 . 1 . . . . . 43 LYS N . 50334 1
229 . 1 . 1 48 48 LYS H H 1 8.118 0.001 . 1 . . . . . 44 LYS H . 50334 1
230 . 1 . 1 48 48 LYS C C 13 172.059 0.000 . 1 . . . . . 44 LYS C . 50334 1
231 . 1 . 1 48 48 LYS CA C 13 55.197 0.000 . 1 . . . . . 44 LYS CA . 50334 1
232 . 1 . 1 48 48 LYS CB C 13 32.225 0.000 . 1 . . . . . 44 LYS CB . 50334 1
233 . 1 . 1 48 48 LYS N N 15 124.015 0.015 . 1 . . . . . 44 LYS N . 50334 1
234 . 1 . 1 49 49 PRO C C 13 172.878 0.000 . 1 . . . . . 45 PRO C . 50334 1
235 . 1 . 1 49 49 PRO CA C 13 61.761 0.010 . 1 . . . . . 45 PRO CA . 50334 1
236 . 1 . 1 49 49 PRO CB C 13 34.094 0.010 . 1 . . . . . 45 PRO CB . 50334 1
237 . 1 . 1 50 50 ALA H H 1 8.733 0.001 . 1 . . . . . 46 ALA H . 50334 1
238 . 1 . 1 50 50 ALA C C 13 175.964 0.005 . 1 . . . . . 46 ALA C . 50334 1
239 . 1 . 1 50 50 ALA CA C 13 51.718 0.009 . 1 . . . . . 46 ALA CA . 50334 1
240 . 1 . 1 50 50 ALA CB C 13 20.473 0.004 . 1 . . . . . 46 ALA CB . 50334 1
241 . 1 . 1 50 50 ALA N N 15 124.192 0.032 . 1 . . . . . 46 ALA N . 50334 1
242 . 1 . 1 51 51 SER H H 1 8.677 0.005 . 1 . . . . . 47 SER H . 50334 1
243 . 1 . 1 51 51 SER C C 13 171.809 0.007 . 1 . . . . . 47 SER C . 50334 1
244 . 1 . 1 51 51 SER CA C 13 59.456 0.008 . 1 . . . . . 47 SER CA . 50334 1
245 . 1 . 1 51 51 SER CB C 13 63.178 0.006 . 1 . . . . . 47 SER CB . 50334 1
246 . 1 . 1 51 51 SER N N 15 117.461 0.023 . 1 . . . . . 47 SER N . 50334 1
247 . 1 . 1 52 52 ARG H H 1 7.280 0.005 . 1 . . . . . 48 ARG H . 50334 1
248 . 1 . 1 52 52 ARG C C 13 170.487 0.000 . 1 . . . . . 48 ARG C . 50334 1
249 . 1 . 1 52 52 ARG CA C 13 54.823 0.007 . 1 . . . . . 48 ARG CA . 50334 1
250 . 1 . 1 52 52 ARG CB C 13 30.613 0.002 . 1 . . . . . 48 ARG CB . 50334 1
251 . 1 . 1 52 52 ARG N N 15 115.580 0.008 . 1 . . . . . 48 ARG N . 50334 1
252 . 1 . 1 53 53 GLU H H 1 8.643 0.000 . 1 . . . . . 49 GLU H . 50334 1
253 . 1 . 1 53 53 GLU C C 13 173.106 0.004 . 1 . . . . . 49 GLU C . 50334 1
254 . 1 . 1 53 53 GLU CA C 13 54.161 0.011 . 1 . . . . . 49 GLU CA . 50334 1
255 . 1 . 1 53 53 GLU CB C 13 32.555 0.004 . 1 . . . . . 49 GLU CB . 50334 1
256 . 1 . 1 53 53 GLU N N 15 118.900 0.034 . 1 . . . . . 49 GLU N . 50334 1
257 . 1 . 1 54 54 LEU H H 1 8.899 0.004 . 1 . . . . . 50 LEU H . 50334 1
258 . 1 . 1 54 54 LEU C C 13 172.178 0.003 . 1 . . . . . 50 LEU C . 50334 1
259 . 1 . 1 54 54 LEU CA C 13 53.046 0.005 . 1 . . . . . 50 LEU CA . 50334 1
260 . 1 . 1 54 54 LEU CB C 13 44.198 0.006 . 1 . . . . . 50 LEU CB . 50334 1
261 . 1 . 1 54 54 LEU N N 15 124.013 0.025 . 1 . . . . . 50 LEU N . 50334 1
262 . 1 . 1 55 55 LYS H H 1 9.964 0.004 . 1 . . . . . 51 LYS H . 50334 1
263 . 1 . 1 55 55 LYS C C 13 173.979 0.004 . 1 . . . . . 51 LYS C . 50334 1
264 . 1 . 1 55 55 LYS CA C 13 55.511 0.004 . 1 . . . . . 51 LYS CA . 50334 1
265 . 1 . 1 55 55 LYS CB C 13 33.244 0.037 . 1 . . . . . 51 LYS CB . 50334 1
266 . 1 . 1 55 55 LYS N N 15 126.585 0.032 . 1 . . . . . 51 LYS N . 50334 1
267 . 1 . 1 56 56 VAL H H 1 9.055 0.003 . 1 . . . . . 52 VAL H . 50334 1
268 . 1 . 1 56 56 VAL C C 13 173.694 0.005 . 1 . . . . . 52 VAL C . 50334 1
269 . 1 . 1 56 56 VAL CA C 13 60.153 0.012 . 1 . . . . . 52 VAL CA . 50334 1
270 . 1 . 1 56 56 VAL CB C 13 33.549 0.027 . 1 . . . . . 52 VAL CB . 50334 1
271 . 1 . 1 56 56 VAL N N 15 128.377 0.029 . 1 . . . . . 52 VAL N . 50334 1
272 . 1 . 1 57 57 THR H H 1 8.459 0.005 . 1 . . . . . 53 THR H . 50334 1
273 . 1 . 1 57 57 THR C C 13 169.815 0.003 . 1 . . . . . 53 THR C . 50334 1
274 . 1 . 1 57 57 THR CA C 13 59.329 0.000 . 1 . . . . . 53 THR CA . 50334 1
275 . 1 . 1 57 57 THR CB C 13 71.283 0.005 . 1 . . . . . 53 THR CB . 50334 1
276 . 1 . 1 57 57 THR N N 15 117.806 0.024 . 1 . . . . . 53 THR N . 50334 1
277 . 1 . 1 58 58 PHE H H 1 9.095 0.004 . 1 . . . . . 54 PHE H . 50334 1
278 . 1 . 1 58 58 PHE C C 13 173.000 0.005 . 1 . . . . . 54 PHE C . 50334 1
279 . 1 . 1 58 58 PHE CA C 13 57.486 0.005 . 1 . . . . . 54 PHE CA . 50334 1
280 . 1 . 1 58 58 PHE CB C 13 39.450 0.003 . 1 . . . . . 54 PHE CB . 50334 1
281 . 1 . 1 58 58 PHE N N 15 119.246 0.031 . 1 . . . . . 54 PHE N . 50334 1
282 . 1 . 1 59 59 PHE H H 1 9.068 0.003 . 1 . . . . . 55 PHE H . 50334 1
283 . 1 . 1 59 59 PHE C C 13 172.149 0.000 . 1 . . . . . 55 PHE C . 50334 1
284 . 1 . 1 59 59 PHE CA C 13 58.480 0.000 . 1 . . . . . 55 PHE CA . 50334 1
285 . 1 . 1 59 59 PHE CB C 13 40.389 0.000 . 1 . . . . . 55 PHE CB . 50334 1
286 . 1 . 1 59 59 PHE N N 15 127.651 0.038 . 1 . . . . . 55 PHE N . 50334 1
287 . 1 . 1 60 60 PRO C C 13 171.090 0.052 . 1 . . . . . 56 PRO C . 50334 1
288 . 1 . 1 60 60 PRO CA C 13 63.282 0.001 . 1 . . . . . 56 PRO CA . 50334 1
289 . 1 . 1 60 60 PRO CB C 13 33.186 0.005 . 1 . . . . . 56 PRO CB . 50334 1
290 . 1 . 1 61 61 ASP H H 1 9.090 0.007 . 1 . . . . . 57 ASP H . 50334 1
291 . 1 . 1 61 61 ASP C C 13 173.445 0.011 . 1 . . . . . 57 ASP C . 50334 1
292 . 1 . 1 61 61 ASP CA C 13 54.464 0.013 . 1 . . . . . 57 ASP CA . 50334 1
293 . 1 . 1 61 61 ASP CB C 13 40.751 0.006 . 1 . . . . . 57 ASP CB . 50334 1
294 . 1 . 1 61 61 ASP N N 15 127.774 0.042 . 1 . . . . . 57 ASP N . 50334 1
295 . 1 . 1 62 62 LEU H H 1 8.471 0.011 . 1 . . . . . 58 LEU H . 50334 1
296 . 1 . 1 62 62 LEU C C 13 174.511 0.009 . 1 . . . . . 58 LEU C . 50334 1
297 . 1 . 1 62 62 LEU CA C 13 53.263 0.003 . 1 . . . . . 58 LEU CA . 50334 1
298 . 1 . 1 62 62 LEU CB C 13 40.875 0.001 . 1 . . . . . 58 LEU CB . 50334 1
299 . 1 . 1 62 62 LEU N N 15 127.903 0.023 . 1 . . . . . 58 LEU N . 50334 1
300 . 1 . 1 63 63 ASN H H 1 8.545 0.004 . 1 . . . . . 59 ASN H . 50334 1
301 . 1 . 1 63 63 ASN C C 13 173.752 0.007 . 1 . . . . . 59 ASN C . 50334 1
302 . 1 . 1 63 63 ASN CA C 13 55.434 0.009 . 1 . . . . . 59 ASN CA . 50334 1
303 . 1 . 1 63 63 ASN CB C 13 38.802 0.013 . 1 . . . . . 59 ASN CB . 50334 1
304 . 1 . 1 63 63 ASN N N 15 116.630 0.033 . 1 . . . . . 59 ASN N . 50334 1
305 . 1 . 1 64 64 GLY H H 1 8.109 0.004 . 1 . . . . . 60 GLY H . 50334 1
306 . 1 . 1 64 64 GLY C C 13 169.687 0.013 . 1 . . . . . 60 GLY C . 50334 1
307 . 1 . 1 64 64 GLY CA C 13 45.316 0.004 . 1 . . . . . 60 GLY CA . 50334 1
308 . 1 . 1 64 64 GLY N N 15 108.850 0.020 . 1 . . . . . 60 GLY N . 50334 1
309 . 1 . 1 65 65 ASP H H 1 8.513 0.004 . 1 . . . . . 61 ASP H . 50334 1
310 . 1 . 1 65 65 ASP C C 13 172.722 0.005 . 1 . . . . . 61 ASP C . 50334 1
311 . 1 . 1 65 65 ASP CA C 13 57.207 0.007 . 1 . . . . . 61 ASP CA . 50334 1
312 . 1 . 1 65 65 ASP CB C 13 43.619 0.003 . 1 . . . . . 61 ASP CB . 50334 1
313 . 1 . 1 65 65 ASP N N 15 119.065 0.038 . 1 . . . . . 61 ASP N . 50334 1
314 . 1 . 1 66 66 VAL H H 1 8.021 0.004 . 1 . . . . . 62 VAL H . 50334 1
315 . 1 . 1 66 66 VAL C C 13 171.033 0.003 . 1 . . . . . 62 VAL C . 50334 1
316 . 1 . 1 66 66 VAL CA C 13 59.582 0.083 . 1 . . . . . 62 VAL CA . 50334 1
317 . 1 . 1 66 66 VAL CB C 13 36.136 0.001 . 1 . . . . . 62 VAL CB . 50334 1
318 . 1 . 1 66 66 VAL N N 15 116.286 0.023 . 1 . . . . . 62 VAL N . 50334 1
319 . 1 . 1 67 67 VAL H H 1 8.228 0.005 . 1 . . . . . 63 VAL H . 50334 1
320 . 1 . 1 67 67 VAL C C 13 171.351 0.005 . 1 . . . . . 63 VAL C . 50334 1
321 . 1 . 1 67 67 VAL CA C 13 59.784 0.029 . 1 . . . . . 63 VAL CA . 50334 1
322 . 1 . 1 67 67 VAL CB C 13 34.378 0.002 . 1 . . . . . 63 VAL CB . 50334 1
323 . 1 . 1 67 67 VAL N N 15 125.776 0.030 . 1 . . . . . 63 VAL N . 50334 1
324 . 1 . 1 68 68 ALA H H 1 9.288 0.004 . 1 . . . . . 64 ALA H . 50334 1
325 . 1 . 1 68 68 ALA C C 13 173.891 0.004 . 1 . . . . . 64 ALA C . 50334 1
326 . 1 . 1 68 68 ALA CA C 13 49.791 0.005 . 1 . . . . . 64 ALA CA . 50334 1
327 . 1 . 1 68 68 ALA CB C 13 20.381 0.002 . 1 . . . . . 64 ALA CB . 50334 1
328 . 1 . 1 68 68 ALA N N 15 128.366 0.031 . 1 . . . . . 64 ALA N . 50334 1
329 . 1 . 1 69 69 ILE H H 1 9.402 0.004 . 1 . . . . . 65 ILE H . 50334 1
330 . 1 . 1 69 69 ILE C C 13 172.022 0.004 . 1 . . . . . 65 ILE C . 50334 1
331 . 1 . 1 69 69 ILE CA C 13 57.064 0.105 . 1 . . . . . 65 ILE CA . 50334 1
332 . 1 . 1 69 69 ILE CB C 13 38.552 0.030 . 1 . . . . . 65 ILE CB . 50334 1
333 . 1 . 1 69 69 ILE N N 15 126.550 0.032 . 1 . . . . . 65 ILE N . 50334 1
334 . 1 . 1 70 70 ASP H H 1 9.204 0.003 . 1 . . . . . 66 ASP H . 50334 1
335 . 1 . 1 70 70 ASP C C 13 174.621 0.000 . 1 . . . . . 66 ASP C . 50334 1
336 . 1 . 1 70 70 ASP CA C 13 54.995 0.028 . 1 . . . . . 66 ASP CA . 50334 1
337 . 1 . 1 70 70 ASP CB C 13 42.577 0.037 . 1 . . . . . 66 ASP CB . 50334 1
338 . 1 . 1 70 70 ASP N N 15 128.469 0.036 . 1 . . . . . 66 ASP N . 50334 1
339 . 1 . 1 71 71 TYR H H 1 9.209 0.001 . 1 . . . . . 67 TYR H . 50334 1
340 . 1 . 1 71 71 TYR C C 13 173.547 0.001 . 1 . . . . . 67 TYR C . 50334 1
341 . 1 . 1 71 71 TYR CA C 13 59.609 0.009 . 1 . . . . . 67 TYR CA . 50334 1
342 . 1 . 1 71 71 TYR CB C 13 40.203 0.037 . 1 . . . . . 67 TYR CB . 50334 1
343 . 1 . 1 71 71 TYR N N 15 128.445 0.007 . 1 . . . . . 67 TYR N . 50334 1
344 . 1 . 1 72 72 LYS H H 1 9.558 0.002 . 1 . . . . . 68 LYS H . 50334 1
345 . 1 . 1 72 72 LYS C C 13 174.549 0.002 . 1 . . . . . 68 LYS C . 50334 1
346 . 1 . 1 72 72 LYS CA C 13 58.418 0.009 . 1 . . . . . 68 LYS CA . 50334 1
347 . 1 . 1 72 72 LYS CB C 13 30.683 0.085 . 1 . . . . . 68 LYS CB . 50334 1
348 . 1 . 1 72 72 LYS N N 15 121.879 0.028 . 1 . . . . . 68 LYS N . 50334 1
349 . 1 . 1 73 73 HIS H H 1 8.245 0.004 . 1 . . . . . 69 HIS H . 50334 1
350 . 1 . 1 73 73 HIS HE2 H 1 11.630 0.000 . 1 . . . . . 69 HIS HE2 . 50334 1
351 . 1 . 1 73 73 HIS C C 13 171.528 0.004 . 1 . . . . . 69 HIS C . 50334 1
352 . 1 . 1 73 73 HIS CA C 13 56.252 0.003 . 1 . . . . . 69 HIS CA . 50334 1
353 . 1 . 1 73 73 HIS CB C 13 30.394 0.035 . 1 . . . . . 69 HIS CB . 50334 1
354 . 1 . 1 73 73 HIS N N 15 117.892 0.029 . 1 . . . . . 69 HIS N . 50334 1
355 . 1 . 1 74 74 TYR H H 1 7.536 0.004 . 1 . . . . . 70 TYR H . 50334 1
356 . 1 . 1 74 74 TYR C C 13 172.990 0.005 . 1 . . . . . 70 TYR C . 50334 1
357 . 1 . 1 74 74 TYR CA C 13 60.953 0.024 . 1 . . . . . 70 TYR CA . 50334 1
358 . 1 . 1 74 74 TYR CB C 13 38.430 0.049 . 1 . . . . . 70 TYR CB . 50334 1
359 . 1 . 1 74 74 TYR N N 15 121.755 0.023 . 1 . . . . . 70 TYR N . 50334 1
360 . 1 . 1 75 75 THR H H 1 6.071 0.014 . 1 . . . . . 71 THR H . 50334 1
361 . 1 . 1 75 75 THR C C 13 169.095 0.000 . 1 . . . . . 71 THR C . 50334 1
362 . 1 . 1 75 75 THR CA C 13 58.211 0.000 . 1 . . . . . 71 THR CA . 50334 1
363 . 1 . 1 75 75 THR CB C 13 69.625 0.000 . 1 . . . . . 71 THR CB . 50334 1
364 . 1 . 1 75 75 THR N N 15 118.977 0.064 . 1 . . . . . 71 THR N . 50334 1
365 . 1 . 1 77 77 SER C C 13 172.665 0.000 . 1 . . . . . 73 SER C . 50334 1
366 . 1 . 1 77 77 SER CA C 13 60.767 0.012 . 1 . . . . . 73 SER CA . 50334 1
367 . 1 . 1 77 77 SER CB C 13 62.291 0.001 . 1 . . . . . 73 SER CB . 50334 1
368 . 1 . 1 78 78 PHE H H 1 7.706 0.005 . 1 . . . . . 74 PHE H . 50334 1
369 . 1 . 1 78 78 PHE C C 13 173.829 0.002 . 1 . . . . . 74 PHE C . 50334 1
370 . 1 . 1 78 78 PHE CA C 13 53.759 0.001 . 1 . . . . . 74 PHE CA . 50334 1
371 . 1 . 1 78 78 PHE CB C 13 38.535 0.004 . 1 . . . . . 74 PHE CB . 50334 1
372 . 1 . 1 78 78 PHE N N 15 118.932 0.029 . 1 . . . . . 74 PHE N . 50334 1
373 . 1 . 1 79 79 LYS H H 1 7.301 0.004 . 1 . . . . . 75 LYS H . 50334 1
374 . 1 . 1 79 79 LYS C C 13 173.842 0.008 . 1 . . . . . 75 LYS C . 50334 1
375 . 1 . 1 79 79 LYS CA C 13 59.535 0.006 . 1 . . . . . 75 LYS CA . 50334 1
376 . 1 . 1 79 79 LYS CB C 13 32.575 0.040 . 1 . . . . . 75 LYS CB . 50334 1
377 . 1 . 1 79 79 LYS N N 15 121.160 0.020 . 1 . . . . . 75 LYS N . 50334 1
378 . 1 . 1 80 80 LYS H H 1 7.876 0.006 . 1 . . . . . 76 LYS H . 50334 1
379 . 1 . 1 80 80 LYS C C 13 170.196 0.007 . 1 . . . . . 76 LYS C . 50334 1
380 . 1 . 1 80 80 LYS CA C 13 55.827 0.004 . 1 . . . . . 76 LYS CA . 50334 1
381 . 1 . 1 80 80 LYS CB C 13 32.919 0.037 . 1 . . . . . 76 LYS CB . 50334 1
382 . 1 . 1 80 80 LYS N N 15 113.706 0.039 . 1 . . . . . 76 LYS N . 50334 1
383 . 1 . 1 81 81 GLY H H 1 7.303 0.006 . 1 . . . . . 77 GLY H . 50334 1
384 . 1 . 1 81 81 GLY C C 13 170.882 0.006 . 1 . . . . . 77 GLY C . 50334 1
385 . 1 . 1 81 81 GLY CA C 13 44.296 0.009 . 1 . . . . . 77 GLY CA . 50334 1
386 . 1 . 1 81 81 GLY N N 15 103.093 0.026 . 1 . . . . . 77 GLY N . 50334 1
387 . 1 . 1 82 82 ALA H H 1 6.925 0.007 . 1 . . . . . 78 ALA H . 50334 1
388 . 1 . 1 82 82 ALA C C 13 172.740 0.001 . 1 . . . . . 78 ALA C . 50334 1
389 . 1 . 1 82 82 ALA CA C 13 51.135 0.003 . 1 . . . . . 78 ALA CA . 50334 1
390 . 1 . 1 82 82 ALA CB C 13 22.699 0.002 . 1 . . . . . 78 ALA CB . 50334 1
391 . 1 . 1 82 82 ALA N N 15 115.774 0.072 . 1 . . . . . 78 ALA N . 50334 1
392 . 1 . 1 83 83 LYS H H 1 9.025 0.005 . 1 . . . . . 79 LYS H . 50334 1
393 . 1 . 1 83 83 LYS C C 13 170.840 0.003 . 1 . . . . . 79 LYS C . 50334 1
394 . 1 . 1 83 83 LYS CA C 13 55.310 0.005 . 1 . . . . . 79 LYS CA . 50334 1
395 . 1 . 1 83 83 LYS CB C 13 37.362 0.006 . 1 . . . . . 79 LYS CB . 50334 1
396 . 1 . 1 83 83 LYS N N 15 119.280 0.027 . 1 . . . . . 79 LYS N . 50334 1
397 . 1 . 1 84 84 LEU H H 1 8.939 0.004 . 1 . . . . . 80 LEU H . 50334 1
398 . 1 . 1 84 84 LEU C C 13 172.906 0.002 . 1 . . . . . 80 LEU C . 50334 1
399 . 1 . 1 84 84 LEU CA C 13 53.429 0.009 . 1 . . . . . 80 LEU CA . 50334 1
400 . 1 . 1 84 84 LEU CB C 13 43.253 0.002 . 1 . . . . . 80 LEU CB . 50334 1
401 . 1 . 1 84 84 LEU N N 15 123.015 0.049 . 1 . . . . . 80 LEU N . 50334 1
402 . 1 . 1 85 85 LEU H H 1 8.811 0.001 . 1 . . . . . 81 LEU H . 50334 1
403 . 1 . 1 85 85 LEU C C 13 172.682 0.000 . 1 . . . . . 81 LEU C . 50334 1
404 . 1 . 1 85 85 LEU CA C 13 57.703 0.000 . 1 . . . . . 81 LEU CA . 50334 1
405 . 1 . 1 85 85 LEU CB C 13 39.436 0.000 . 1 . . . . . 81 LEU CB . 50334 1
406 . 1 . 1 85 85 LEU N N 15 125.921 0.011 . 1 . . . . . 81 LEU N . 50334 1
407 . 1 . 1 86 86 HIS H H 1 8.446 0.008 . 1 . . . . . 82 HIS H . 50334 1
408 . 1 . 1 86 86 HIS C C 13 172.916 0.000 . 1 . . . . . 82 HIS C . 50334 1
409 . 1 . 1 86 86 HIS CA C 13 56.702 0.012 . 1 . . . . . 82 HIS CA . 50334 1
410 . 1 . 1 86 86 HIS CB C 13 30.348 0.015 . 1 . . . . . 82 HIS CB . 50334 1
411 . 1 . 1 86 86 HIS N N 15 114.851 0.134 . 1 . . . . . 82 HIS N . 50334 1
412 . 1 . 1 87 87 LYS H H 1 8.340 0.003 . 1 . . . . . 83 LYS H . 50334 1
413 . 1 . 1 87 87 LYS C C 13 170.316 0.000 . 1 . . . . . 83 LYS C . 50334 1
414 . 1 . 1 87 87 LYS CA C 13 52.966 0.000 . 1 . . . . . 83 LYS CA . 50334 1
415 . 1 . 1 87 87 LYS CB C 13 32.788 0.000 . 1 . . . . . 83 LYS CB . 50334 1
416 . 1 . 1 87 87 LYS N N 15 123.739 0.026 . 1 . . . . . 83 LYS N . 50334 1
417 . 1 . 1 88 88 PRO C C 13 172.651 0.000 . 1 . . . . . 84 PRO C . 50334 1
418 . 1 . 1 88 88 PRO CA C 13 63.040 0.005 . 1 . . . . . 84 PRO CA . 50334 1
419 . 1 . 1 88 88 PRO CB C 13 33.095 0.001 . 1 . . . . . 84 PRO CB . 50334 1
420 . 1 . 1 89 89 ILE H H 1 6.175 0.006 . 1 . . . . . 85 ILE H . 50334 1
421 . 1 . 1 89 89 ILE C C 13 174.335 0.005 . 1 . . . . . 85 ILE C . 50334 1
422 . 1 . 1 89 89 ILE CA C 13 57.830 0.004 . 1 . . . . . 85 ILE CA . 50334 1
423 . 1 . 1 89 89 ILE CB C 13 41.504 0.008 . 1 . . . . . 85 ILE CB . 50334 1
424 . 1 . 1 89 89 ILE N N 15 108.884 0.029 . 1 . . . . . 85 ILE N . 50334 1
425 . 1 . 1 90 90 VAL H H 1 7.631 0.005 . 1 . . . . . 86 VAL H . 50334 1
426 . 1 . 1 90 90 VAL C C 13 170.510 0.000 . 1 . . . . . 86 VAL C . 50334 1
427 . 1 . 1 90 90 VAL CA C 13 60.079 0.005 . 1 . . . . . 86 VAL CA . 50334 1
428 . 1 . 1 90 90 VAL CB C 13 35.567 0.019 . 1 . . . . . 86 VAL CB . 50334 1
429 . 1 . 1 90 90 VAL N N 15 109.240 0.035 . 1 . . . . . 86 VAL N . 50334 1
430 . 1 . 1 91 91 TRP H H 1 10.082 0.002 . 1 . . . . . 87 TRP H . 50334 1
431 . 1 . 1 91 91 TRP HE1 H 1 10.716 0.003 . 1 . . . . . 87 TRP HE1 . 50334 1
432 . 1 . 1 91 91 TRP C C 13 174.270 0.006 . 1 . . . . . 87 TRP C . 50334 1
433 . 1 . 1 91 91 TRP CA C 13 55.782 0.004 . 1 . . . . . 87 TRP CA . 50334 1
434 . 1 . 1 91 91 TRP CB C 13 33.286 0.007 . 1 . . . . . 87 TRP CB . 50334 1
435 . 1 . 1 91 91 TRP N N 15 122.190 0.031 . 1 . . . . . 87 TRP N . 50334 1
436 . 1 . 1 91 91 TRP NE1 N 15 129.507 0.027 . 1 . . . . . 87 TRP NE1 . 50334 1
437 . 1 . 1 92 92 HIS H H 1 8.789 0.004 . 1 . . . . . 88 HIS H . 50334 1
438 . 1 . 1 92 92 HIS C C 13 170.111 0.002 . 1 . . . . . 88 HIS C . 50334 1
439 . 1 . 1 92 92 HIS CA C 13 54.408 0.003 . 1 . . . . . 88 HIS CA . 50334 1
440 . 1 . 1 92 92 HIS CB C 13 37.810 0.005 . 1 . . . . . 88 HIS CB . 50334 1
441 . 1 . 1 92 92 HIS N N 15 116.522 0.031 . 1 . . . . . 88 HIS N . 50334 1
442 . 1 . 1 93 93 VAL H H 1 9.248 0.004 . 1 . . . . . 89 VAL H . 50334 1
443 . 1 . 1 93 93 VAL C C 13 174.732 0.003 . 1 . . . . . 89 VAL C . 50334 1
444 . 1 . 1 93 93 VAL CA C 13 62.177 0.010 . 1 . . . . . 89 VAL CA . 50334 1
445 . 1 . 1 93 93 VAL CB C 13 34.178 0.001 . 1 . . . . . 89 VAL CB . 50334 1
446 . 1 . 1 93 93 VAL N N 15 118.834 0.029 . 1 . . . . . 89 VAL N . 50334 1
447 . 1 . 1 94 94 ASN H H 1 9.852 0.001 . 1 . . . . . 90 ASN H . 50334 1
448 . 1 . 1 94 94 ASN HD21 H 1 7.563 0.000 . 1 . . . . . 90 ASN HD21 . 50334 1
449 . 1 . 1 94 94 ASN HD22 H 1 6.858 0.012 . 1 . . . . . 90 ASN HD22 . 50334 1
450 . 1 . 1 94 94 ASN C C 13 171.656 0.002 . 1 . . . . . 90 ASN C . 50334 1
451 . 1 . 1 94 94 ASN CA C 13 54.546 0.037 . 1 . . . . . 90 ASN CA . 50334 1
452 . 1 . 1 94 94 ASN CB C 13 37.418 0.005 . 1 . . . . . 90 ASN CB . 50334 1
453 . 1 . 1 94 94 ASN N N 15 127.802 0.016 . 1 . . . . . 90 ASN N . 50334 1
454 . 1 . 1 94 94 ASN ND2 N 15 113.124 0.036 . 1 . . . . . 90 ASN ND2 . 50334 1
455 . 1 . 1 95 95 ASN H H 1 10.687 0.005 . 1 . . . . . 91 ASN H . 50334 1
456 . 1 . 1 95 95 ASN C C 13 169.755 0.004 . 1 . . . . . 91 ASN C . 50334 1
457 . 1 . 1 95 95 ASN CA C 13 53.857 0.006 . 1 . . . . . 91 ASN CA . 50334 1
458 . 1 . 1 95 95 ASN CB C 13 35.605 0.002 . 1 . . . . . 91 ASN CB . 50334 1
459 . 1 . 1 95 95 ASN N N 15 112.503 0.030 . 1 . . . . . 91 ASN N . 50334 1
460 . 1 . 1 96 96 ALA H H 1 7.845 0.006 . 1 . . . . . 92 ALA H . 50334 1
461 . 1 . 1 96 96 ALA C C 13 173.736 0.004 . 1 . . . . . 92 ALA C . 50334 1
462 . 1 . 1 96 96 ALA CA C 13 50.845 0.005 . 1 . . . . . 92 ALA CA . 50334 1
463 . 1 . 1 96 96 ALA CB C 13 22.807 0.004 . 1 . . . . . 92 ALA CB . 50334 1
464 . 1 . 1 96 96 ALA N N 15 119.219 0.021 . 1 . . . . . 92 ALA N . 50334 1
465 . 1 . 1 97 97 THR H H 1 8.857 0.002 . 1 . . . . . 93 THR H . 50334 1
466 . 1 . 1 97 97 THR C C 13 170.271 0.005 . 1 . . . . . 93 THR C . 50334 1
467 . 1 . 1 97 97 THR CA C 13 59.406 0.007 . 1 . . . . . 93 THR CA . 50334 1
468 . 1 . 1 97 97 THR CB C 13 71.199 0.003 . 1 . . . . . 93 THR CB . 50334 1
469 . 1 . 1 97 97 THR N N 15 113.026 0.017 . 1 . . . . . 93 THR N . 50334 1
470 . 1 . 1 98 98 ASN H H 1 8.590 0.000 . 1 . . . . . 94 ASN H . 50334 1
471 . 1 . 1 98 98 ASN C C 13 174.111 0.000 . 1 . . . . . 94 ASN C . 50334 1
472 . 1 . 1 98 98 ASN CA C 13 51.617 0.000 . 1 . . . . . 94 ASN CA . 50334 1
473 . 1 . 1 98 98 ASN CB C 13 39.709 0.000 . 1 . . . . . 94 ASN CB . 50334 1
474 . 1 . 1 98 98 ASN N N 15 127.811 0.016 . 1 . . . . . 94 ASN N . 50334 1
475 . 1 . 1 99 99 LYS H H 1 7.496 0.003 . 1 . . . . . 95 LYS H . 50334 1
476 . 1 . 1 99 99 LYS C C 13 175.473 0.000 . 1 . . . . . 95 LYS C . 50334 1
477 . 1 . 1 99 99 LYS CA C 13 59.883 0.003 . 1 . . . . . 95 LYS CA . 50334 1
478 . 1 . 1 99 99 LYS CB C 13 31.938 0.005 . 1 . . . . . 95 LYS CB . 50334 1
479 . 1 . 1 99 99 LYS N N 15 108.588 0.032 . 1 . . . . . 95 LYS N . 50334 1
480 . 1 . 1 100 100 ALA H H 1 7.647 0.004 . 1 . . . . . 96 ALA H . 50334 1
481 . 1 . 1 100 100 ALA C C 13 175.982 0.005 . 1 . . . . . 96 ALA C . 50334 1
482 . 1 . 1 100 100 ALA CA C 13 54.448 0.001 . 1 . . . . . 96 ALA CA . 50334 1
483 . 1 . 1 100 100 ALA CB C 13 17.955 0.007 . 1 . . . . . 96 ALA CB . 50334 1
484 . 1 . 1 100 100 ALA N N 15 121.641 0.025 . 1 . . . . . 96 ALA N . 50334 1
485 . 1 . 1 101 101 THR H H 1 7.486 0.003 . 1 . . . . . 97 THR H . 50334 1
486 . 1 . 1 101 101 THR C C 13 172.641 0.006 . 1 . . . . . 97 THR C . 50334 1
487 . 1 . 1 101 101 THR CA C 13 62.247 0.016 . 1 . . . . . 97 THR CA . 50334 1
488 . 1 . 1 101 101 THR CB C 13 69.143 0.008 . 1 . . . . . 97 THR CB . 50334 1
489 . 1 . 1 101 101 THR N N 15 102.343 0.024 . 1 . . . . . 97 THR N . 50334 1
490 . 1 . 1 102 102 TYR H H 1 7.412 0.005 . 1 . . . . . 98 TYR H . 50334 1
491 . 1 . 1 102 102 TYR C C 13 173.990 0.005 . 1 . . . . . 98 TYR C . 50334 1
492 . 1 . 1 102 102 TYR CA C 13 62.402 0.014 . 1 . . . . . 98 TYR CA . 50334 1
493 . 1 . 1 102 102 TYR CB C 13 38.520 0.004 . 1 . . . . . 98 TYR CB . 50334 1
494 . 1 . 1 102 102 TYR N N 15 125.806 0.021 . 1 . . . . . 98 TYR N . 50334 1
495 . 1 . 1 103 103 LYS H H 1 9.278 0.001 . 1 . . . . . 99 LYS H . 50334 1
496 . 1 . 1 103 103 LYS C C 13 174.910 0.000 . 1 . . . . . 99 LYS C . 50334 1
497 . 1 . 1 103 103 LYS CA C 13 60.979 0.000 . 1 . . . . . 99 LYS CA . 50334 1
498 . 1 . 1 103 103 LYS CB C 13 29.097 0.000 . 1 . . . . . 99 LYS CB . 50334 1
499 . 1 . 1 103 103 LYS N N 15 120.042 0.016 . 1 . . . . . 99 LYS N . 50334 1
500 . 1 . 1 104 104 PRO C C 13 177.401 0.000 . 1 . . . . . 100 PRO C . 50334 1
501 . 1 . 1 104 104 PRO CA C 13 67.124 0.000 . 1 . . . . . 100 PRO CA . 50334 1
502 . 1 . 1 104 104 PRO CB C 13 32.231 0.002 . 1 . . . . . 100 PRO CB . 50334 1
503 . 1 . 1 105 105 ASN H H 1 8.755 0.003 . 1 . . . . . 101 ASN H . 50334 1
504 . 1 . 1 105 105 ASN HD21 H 1 8.488 0.000 . 1 . . . . . 101 ASN HD21 . 50334 1
505 . 1 . 1 105 105 ASN HD22 H 1 6.983 0.000 . 1 . . . . . 101 ASN HD22 . 50334 1
506 . 1 . 1 105 105 ASN C C 13 175.947 0.004 . 1 . . . . . 101 ASN C . 50334 1
507 . 1 . 1 105 105 ASN CA C 13 55.432 0.001 . 1 . . . . . 101 ASN CA . 50334 1
508 . 1 . 1 105 105 ASN CB C 13 36.512 0.001 . 1 . . . . . 101 ASN CB . 50334 1
509 . 1 . 1 105 105 ASN N N 15 115.906 0.030 . 1 . . . . . 101 ASN N . 50334 1
510 . 1 . 1 105 105 ASN ND2 N 15 105.345 0.005 . 1 . . . . . 101 ASN ND2 . 50334 1
511 . 1 . 1 106 106 THR H H 1 8.636 0.004 . 1 . . . . . 102 THR H . 50334 1
512 . 1 . 1 106 106 THR C C 13 174.732 0.001 . 1 . . . . . 102 THR C . 50334 1
513 . 1 . 1 106 106 THR CA C 13 67.402 0.015 . 1 . . . . . 102 THR CA . 50334 1
514 . 1 . 1 106 106 THR CB C 13 68.317 0.013 . 1 . . . . . 102 THR CB . 50334 1
515 . 1 . 1 106 106 THR N N 15 118.613 0.015 . 1 . . . . . 102 THR N . 50334 1
516 . 1 . 1 107 107 TRP H H 1 7.504 0.004 . 1 . . . . . 103 TRP H . 50334 1
517 . 1 . 1 107 107 TRP HE1 H 1 10.187 0.000 . 1 . . . . . 103 TRP HE1 . 50334 1
518 . 1 . 1 107 107 TRP C C 13 175.875 0.007 . 1 . . . . . 103 TRP C . 50334 1
519 . 1 . 1 107 107 TRP CA C 13 61.616 0.004 . 1 . . . . . 103 TRP CA . 50334 1
520 . 1 . 1 107 107 TRP CB C 13 28.567 0.011 . 1 . . . . . 103 TRP CB . 50334 1
521 . 1 . 1 107 107 TRP N N 15 122.654 0.024 . 1 . . . . . 103 TRP N . 50334 1
522 . 1 . 1 107 107 TRP NE1 N 15 128.685 0.006 . 1 . . . . . 103 TRP NE1 . 50334 1
523 . 1 . 1 108 108 CYS H H 1 8.378 0.005 . 1 . . . . . 104 CYS H . 50334 1
524 . 1 . 1 108 108 CYS C C 13 176.336 0.004 . 1 . . . . . 104 CYS C . 50334 1
525 . 1 . 1 108 108 CYS CA C 13 65.832 0.036 . 1 . . . . . 104 CYS CA . 50334 1
526 . 1 . 1 108 108 CYS CB C 13 27.601 0.007 . 1 . . . . . 104 CYS CB . 50334 1
527 . 1 . 1 108 108 CYS N N 15 118.208 0.027 . 1 . . . . . 104 CYS N . 50334 1
528 . 1 . 1 109 109 ILE H H 1 8.729 0.004 . 1 . . . . . 105 ILE H . 50334 1
529 . 1 . 1 109 109 ILE C C 13 175.151 0.005 . 1 . . . . . 105 ILE C . 50334 1
530 . 1 . 1 109 109 ILE CA C 13 65.898 0.013 . 1 . . . . . 105 ILE CA . 50334 1
531 . 1 . 1 109 109 ILE CB C 13 37.729 0.004 . 1 . . . . . 105 ILE CB . 50334 1
532 . 1 . 1 109 109 ILE N N 15 120.520 0.026 . 1 . . . . . 105 ILE N . 50334 1
533 . 1 . 1 110 110 ARG H H 1 7.361 0.005 . 1 . . . . . 106 ARG H . 50334 1
534 . 1 . 1 110 110 ARG C C 13 177.332 0.006 . 1 . . . . . 106 ARG C . 50334 1
535 . 1 . 1 110 110 ARG CA C 13 58.568 0.005 . 1 . . . . . 106 ARG CA . 50334 1
536 . 1 . 1 110 110 ARG CB C 13 29.706 0.005 . 1 . . . . . 106 ARG CB . 50334 1
537 . 1 . 1 110 110 ARG N N 15 120.668 0.025 . 1 . . . . . 106 ARG N . 50334 1
538 . 1 . 1 111 111 CYS H H 1 7.760 0.005 . 1 . . . . . 107 CYS H . 50334 1
539 . 1 . 1 111 111 CYS C C 13 172.306 0.005 . 1 . . . . . 107 CYS C . 50334 1
540 . 1 . 1 111 111 CYS CA C 13 64.213 0.007 . 1 . . . . . 107 CYS CA . 50334 1
541 . 1 . 1 111 111 CYS CB C 13 27.150 0.005 . 1 . . . . . 107 CYS CB . 50334 1
542 . 1 . 1 111 111 CYS N N 15 116.678 0.026 . 1 . . . . . 107 CYS N . 50334 1
543 . 1 . 1 112 112 LEU H H 1 7.825 0.002 . 1 . . . . . 108 LEU H . 50334 1
544 . 1 . 1 112 112 LEU C C 13 174.787 0.006 . 1 . . . . . 108 LEU C . 50334 1
545 . 1 . 1 112 112 LEU CA C 13 54.675 0.002 . 1 . . . . . 108 LEU CA . 50334 1
546 . 1 . 1 112 112 LEU CB C 13 42.518 0.004 . 1 . . . . . 108 LEU CB . 50334 1
547 . 1 . 1 112 112 LEU N N 15 119.039 0.008 . 1 . . . . . 108 LEU N . 50334 1
548 . 1 . 1 113 113 TRP H H 1 7.518 0.005 . 1 . . . . . 109 TRP H . 50334 1
549 . 1 . 1 113 113 TRP HE1 H 1 10.156 0.001 . 1 . . . . . 109 TRP HE1 . 50334 1
550 . 1 . 1 113 113 TRP C C 13 173.025 0.005 . 1 . . . . . 109 TRP C . 50334 1
551 . 1 . 1 113 113 TRP CA C 13 56.890 0.001 . 1 . . . . . 109 TRP CA . 50334 1
552 . 1 . 1 113 113 TRP CB C 13 30.318 0.010 . 1 . . . . . 109 TRP CB . 50334 1
553 . 1 . 1 113 113 TRP N N 15 120.193 0.023 . 1 . . . . . 109 TRP N . 50334 1
554 . 1 . 1 113 113 TRP NE1 N 15 126.694 0.019 . 1 . . . . . 109 TRP NE1 . 50334 1
555 . 1 . 1 114 114 SER H H 1 8.368 0.004 . 1 . . . . . 110 SER H . 50334 1
556 . 1 . 1 114 114 SER C C 13 172.295 0.004 . 1 . . . . . 110 SER C . 50334 1
557 . 1 . 1 114 114 SER CA C 13 57.686 0.007 . 1 . . . . . 110 SER CA . 50334 1
558 . 1 . 1 114 114 SER CB C 13 65.082 0.006 . 1 . . . . . 110 SER CB . 50334 1
559 . 1 . 1 114 114 SER N N 15 116.115 0.023 . 1 . . . . . 110 SER N . 50334 1
560 . 1 . 1 115 115 THR H H 1 8.473 0.001 . 1 . . . . . 111 THR H . 50334 1
561 . 1 . 1 115 115 THR C C 13 171.537 0.005 . 1 . . . . . 111 THR C . 50334 1
562 . 1 . 1 115 115 THR CA C 13 61.496 0.010 . 1 . . . . . 111 THR CA . 50334 1
563 . 1 . 1 115 115 THR CB C 13 69.556 0.005 . 1 . . . . . 111 THR CB . 50334 1
564 . 1 . 1 115 115 THR N N 15 115.418 0.012 . 1 . . . . . 111 THR N . 50334 1
565 . 1 . 1 116 116 LYS H H 1 8.246 0.001 . 1 . . . . . 112 LYS H . 50334 1
566 . 1 . 1 116 116 LYS C C 13 171.674 0.000 . 1 . . . . . 112 LYS C . 50334 1
567 . 1 . 1 116 116 LYS CA C 13 54.341 0.000 . 1 . . . . . 112 LYS CA . 50334 1
568 . 1 . 1 116 116 LYS CB C 13 32.710 0.000 . 1 . . . . . 112 LYS CB . 50334 1
569 . 1 . 1 116 116 LYS N N 15 124.950 0.021 . 1 . . . . . 112 LYS N . 50334 1
570 . 1 . 1 117 117 PRO C C 13 174.079 0.000 . 1 . . . . . 113 PRO C . 50334 1
571 . 1 . 1 117 117 PRO CA C 13 62.937 0.049 . 1 . . . . . 113 PRO CA . 50334 1
572 . 1 . 1 117 117 PRO CB C 13 32.115 0.029 . 1 . . . . . 113 PRO CB . 50334 1
573 . 1 . 1 118 118 VAL H H 1 8.264 0.001 . 1 . . . . . 114 VAL H . 50334 1
574 . 1 . 1 118 118 VAL C C 13 173.485 0.005 . 1 . . . . . 114 VAL C . 50334 1
575 . 1 . 1 118 118 VAL CA C 13 62.436 0.029 . 1 . . . . . 114 VAL CA . 50334 1
576 . 1 . 1 118 118 VAL CB C 13 32.753 0.004 . 1 . . . . . 114 VAL CB . 50334 1
577 . 1 . 1 118 118 VAL N N 15 120.906 0.176 . 1 . . . . . 114 VAL N . 50334 1
578 . 1 . 1 119 119 GLU H H 1 8.486 0.011 . 1 . . . . . 115 GLU H . 50334 1
579 . 1 . 1 119 119 GLU C C 13 173.040 0.003 . 1 . . . . . 115 GLU C . 50334 1
580 . 1 . 1 119 119 GLU CA C 13 56.482 0.002 . 1 . . . . . 115 GLU CA . 50334 1
581 . 1 . 1 119 119 GLU CB C 13 30.538 0.001 . 1 . . . . . 115 GLU CB . 50334 1
582 . 1 . 1 119 119 GLU N N 15 125.547 0.207 . 1 . . . . . 115 GLU N . 50334 1
583 . 1 . 1 120 120 THR H H 1 7.837 0.001 . 1 . . . . . 116 THR H . 50334 1
584 . 1 . 1 120 120 THR C C 13 176.460 0.000 . 1 . . . . . 116 THR C . 50334 1
585 . 1 . 1 120 120 THR CA C 13 63.086 0.000 . 1 . . . . . 116 THR CA . 50334 1
586 . 1 . 1 120 120 THR CB C 13 70.706 0.000 . 1 . . . . . 116 THR CB . 50334 1
587 . 1 . 1 120 120 THR N N 15 120.731 0.148 . 1 . . . . . 116 THR N . 50334 1
stop_
save_