Content for NMR-STAR saveframe, "chemical_shift_1"
save_chemical_shift_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_1
_Assigned_chem_shift_list.Entry_ID 11380
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $condition_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $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 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11380 1
2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11380 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 $XWINNMR . . 11380 1
2 $NMRPipe . . 11380 1
3 $NMRView . . 11380 1
4 $Kujira . . 11380 1
5 $CYANA . . 11380 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_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.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 8 8 SER HA H 1 4.455 0.030 . 1 . . . . 8 SER HA . 11380 1
2 . 1 1 8 8 SER HB2 H 1 3.799 0.030 . 2 . . . . 8 SER HB2 . 11380 1
3 . 1 1 8 8 SER C C 13 174.591 0.300 . 1 . . . . 8 SER C . 11380 1
4 . 1 1 8 8 SER CA C 13 58.058 0.300 . 1 . . . . 8 SER CA . 11380 1
5 . 1 1 8 8 SER CB C 13 63.870 0.300 . 1 . . . . 8 SER CB . 11380 1
6 . 1 1 9 9 VAL H H 1 8.102 0.030 . 1 . . . . 9 VAL H . 11380 1
7 . 1 1 9 9 VAL HA H 1 4.066 0.030 . 1 . . . . 9 VAL HA . 11380 1
8 . 1 1 9 9 VAL HB H 1 2.059 0.030 . 1 . . . . 9 VAL HB . 11380 1
9 . 1 1 9 9 VAL HG11 H 1 0.907 0.030 . 1 . . . . 9 VAL HG1 . 11380 1
10 . 1 1 9 9 VAL HG12 H 1 0.907 0.030 . 1 . . . . 9 VAL HG1 . 11380 1
11 . 1 1 9 9 VAL HG13 H 1 0.907 0.030 . 1 . . . . 9 VAL HG1 . 11380 1
12 . 1 1 9 9 VAL HG21 H 1 0.894 0.030 . 1 . . . . 9 VAL HG2 . 11380 1
13 . 1 1 9 9 VAL HG22 H 1 0.894 0.030 . 1 . . . . 9 VAL HG2 . 11380 1
14 . 1 1 9 9 VAL HG23 H 1 0.894 0.030 . 1 . . . . 9 VAL HG2 . 11380 1
15 . 1 1 9 9 VAL C C 13 176.650 0.300 . 1 . . . . 9 VAL C . 11380 1
16 . 1 1 9 9 VAL CA C 13 62.592 0.300 . 1 . . . . 9 VAL CA . 11380 1
17 . 1 1 9 9 VAL CB C 13 32.550 0.300 . 1 . . . . 9 VAL CB . 11380 1
18 . 1 1 9 9 VAL CG1 C 13 20.457 0.300 . 2 . . . . 9 VAL CG1 . 11380 1
19 . 1 1 9 9 VAL CG2 C 13 21.026 0.300 . 2 . . . . 9 VAL CG2 . 11380 1
20 . 1 1 9 9 VAL N N 15 121.664 0.300 . 1 . . . . 9 VAL N . 11380 1
21 . 1 1 10 10 GLY H H 1 8.425 0.030 . 1 . . . . 10 GLY H . 11380 1
22 . 1 1 10 10 GLY HA2 H 1 3.838 0.030 . 2 . . . . 10 GLY HA2 . 11380 1
23 . 1 1 10 10 GLY HA3 H 1 3.875 0.030 . 2 . . . . 10 GLY HA3 . 11380 1
24 . 1 1 10 10 GLY C C 13 173.832 0.300 . 1 . . . . 10 GLY C . 11380 1
25 . 1 1 10 10 GLY CA C 13 45.223 0.300 . 1 . . . . 10 GLY CA . 11380 1
26 . 1 1 10 10 GLY N N 15 112.178 0.300 . 1 . . . . 10 GLY N . 11380 1
27 . 1 1 11 11 LYS H H 1 7.981 0.030 . 1 . . . . 11 LYS H . 11380 1
28 . 1 1 11 11 LYS HA H 1 4.438 0.030 . 1 . . . . 11 LYS HA . 11380 1
29 . 1 1 11 11 LYS HB2 H 1 1.469 0.030 . 2 . . . . 11 LYS HB2 . 11380 1
30 . 1 1 11 11 LYS HB3 H 1 1.371 0.030 . 2 . . . . 11 LYS HB3 . 11380 1
31 . 1 1 11 11 LYS HD2 H 1 1.358 0.030 . 2 . . . . 11 LYS HD2 . 11380 1
32 . 1 1 11 11 LYS HD3 H 1 1.464 0.030 . 2 . . . . 11 LYS HD3 . 11380 1
33 . 1 1 11 11 LYS HE2 H 1 2.853 0.030 . 1 . . . . 11 LYS HE2 . 11380 1
34 . 1 1 11 11 LYS HE3 H 1 2.853 0.030 . 1 . . . . 11 LYS HE3 . 11380 1
35 . 1 1 11 11 LYS HG2 H 1 1.235 0.030 . 2 . . . . 11 LYS HG2 . 11380 1
36 . 1 1 11 11 LYS HG3 H 1 1.086 0.030 . 2 . . . . 11 LYS HG3 . 11380 1
37 . 1 1 11 11 LYS C C 13 174.108 0.300 . 1 . . . . 11 LYS C . 11380 1
38 . 1 1 11 11 LYS CA C 13 53.549 0.300 . 1 . . . . 11 LYS CA . 11380 1
39 . 1 1 11 11 LYS CB C 13 32.611 0.300 . 1 . . . . 11 LYS CB . 11380 1
40 . 1 1 11 11 LYS CD C 13 29.288 0.300 . 1 . . . . 11 LYS CD . 11380 1
41 . 1 1 11 11 LYS CE C 13 42.129 0.300 . 1 . . . . 11 LYS CE . 11380 1
42 . 1 1 11 11 LYS CG C 13 24.759 0.300 . 1 . . . . 11 LYS CG . 11380 1
43 . 1 1 11 11 LYS N N 15 120.742 0.300 . 1 . . . . 11 LYS N . 11380 1
44 . 1 1 12 12 PRO HA H 1 4.264 0.030 . 1 . . . . 12 PRO HA . 11380 1
45 . 1 1 12 12 PRO HB2 H 1 1.968 0.030 . 2 . . . . 12 PRO HB2 . 11380 1
46 . 1 1 12 12 PRO HB3 H 1 1.317 0.030 . 2 . . . . 12 PRO HB3 . 11380 1
47 . 1 1 12 12 PRO HD2 H 1 3.589 0.030 . 2 . . . . 12 PRO HD2 . 11380 1
48 . 1 1 12 12 PRO HD3 H 1 3.547 0.030 . 2 . . . . 12 PRO HD3 . 11380 1
49 . 1 1 12 12 PRO HG2 H 1 1.566 0.030 . 2 . . . . 12 PRO HG2 . 11380 1
50 . 1 1 12 12 PRO HG3 H 1 1.836 0.030 . 2 . . . . 12 PRO HG3 . 11380 1
51 . 1 1 12 12 PRO C C 13 176.373 0.300 . 1 . . . . 12 PRO C . 11380 1
52 . 1 1 12 12 PRO CA C 13 63.498 0.300 . 1 . . . . 12 PRO CA . 11380 1
53 . 1 1 12 12 PRO CB C 13 32.031 0.300 . 1 . . . . 12 PRO CB . 11380 1
54 . 1 1 12 12 PRO CD C 13 50.089 0.300 . 1 . . . . 12 PRO CD . 11380 1
55 . 1 1 12 12 PRO CG C 13 26.576 0.300 . 1 . . . . 12 PRO CG . 11380 1
56 . 1 1 13 13 TYR H H 1 7.839 0.030 . 1 . . . . 13 TYR H . 11380 1
57 . 1 1 13 13 TYR HA H 1 4.533 0.030 . 1 . . . . 13 TYR HA . 11380 1
58 . 1 1 13 13 TYR HB2 H 1 2.875 0.030 . 2 . . . . 13 TYR HB2 . 11380 1
59 . 1 1 13 13 TYR HB3 H 1 2.756 0.030 . 2 . . . . 13 TYR HB3 . 11380 1
60 . 1 1 13 13 TYR HD1 H 1 6.989 0.030 . 1 . . . . 13 TYR HD1 . 11380 1
61 . 1 1 13 13 TYR HD2 H 1 6.989 0.030 . 1 . . . . 13 TYR HD2 . 11380 1
62 . 1 1 13 13 TYR HE1 H 1 6.811 0.030 . 1 . . . . 13 TYR HE1 . 11380 1
63 . 1 1 13 13 TYR HE2 H 1 6.811 0.030 . 1 . . . . 13 TYR HE2 . 11380 1
64 . 1 1 13 13 TYR C C 13 174.353 0.300 . 1 . . . . 13 TYR C . 11380 1
65 . 1 1 13 13 TYR CA C 13 57.745 0.300 . 1 . . . . 13 TYR CA . 11380 1
66 . 1 1 13 13 TYR CB C 13 37.788 0.300 . 1 . . . . 13 TYR CB . 11380 1
67 . 1 1 13 13 TYR CD1 C 13 133.185 0.300 . 1 . . . . 13 TYR CD1 . 11380 1
68 . 1 1 13 13 TYR CD2 C 13 133.185 0.300 . 1 . . . . 13 TYR CD2 . 11380 1
69 . 1 1 13 13 TYR CE1 C 13 118.213 0.300 . 1 . . . . 13 TYR CE1 . 11380 1
70 . 1 1 13 13 TYR CE2 C 13 118.213 0.300 . 1 . . . . 13 TYR CE2 . 11380 1
71 . 1 1 13 13 TYR N N 15 119.092 0.300 . 1 . . . . 13 TYR N . 11380 1
72 . 1 1 14 14 ILE H H 1 8.350 0.030 . 1 . . . . 14 ILE H . 11380 1
73 . 1 1 14 14 ILE HA H 1 4.565 0.030 . 1 . . . . 14 ILE HA . 11380 1
74 . 1 1 14 14 ILE HB H 1 1.649 0.030 . 1 . . . . 14 ILE HB . 11380 1
75 . 1 1 14 14 ILE HD11 H 1 0.687 0.030 . 1 . . . . 14 ILE HD1 . 11380 1
76 . 1 1 14 14 ILE HD12 H 1 0.687 0.030 . 1 . . . . 14 ILE HD1 . 11380 1
77 . 1 1 14 14 ILE HD13 H 1 0.687 0.030 . 1 . . . . 14 ILE HD1 . 11380 1
78 . 1 1 14 14 ILE HG12 H 1 1.328 0.030 . 2 . . . . 14 ILE HG12 . 11380 1
79 . 1 1 14 14 ILE HG13 H 1 1.031 0.030 . 2 . . . . 14 ILE HG13 . 11380 1
80 . 1 1 14 14 ILE HG21 H 1 0.619 0.030 . 1 . . . . 14 ILE HG2 . 11380 1
81 . 1 1 14 14 ILE HG22 H 1 0.619 0.030 . 1 . . . . 14 ILE HG2 . 11380 1
82 . 1 1 14 14 ILE HG23 H 1 0.619 0.030 . 1 . . . . 14 ILE HG2 . 11380 1
83 . 1 1 14 14 ILE C C 13 175.822 0.300 . 1 . . . . 14 ILE C . 11380 1
84 . 1 1 14 14 ILE CA C 13 59.436 0.300 . 1 . . . . 14 ILE CA . 11380 1
85 . 1 1 14 14 ILE CB C 13 39.789 0.300 . 1 . . . . 14 ILE CB . 11380 1
86 . 1 1 14 14 ILE CD1 C 13 12.116 0.300 . 1 . . . . 14 ILE CD1 . 11380 1
87 . 1 1 14 14 ILE CG1 C 13 27.470 0.300 . 1 . . . . 14 ILE CG1 . 11380 1
88 . 1 1 14 14 ILE CG2 C 13 16.987 0.300 . 1 . . . . 14 ILE CG2 . 11380 1
89 . 1 1 14 14 ILE N N 15 125.308 0.300 . 1 . . . . 14 ILE N . 11380 1
90 . 1 1 15 15 CYS H H 1 9.167 0.030 . 1 . . . . 15 CYS H . 11380 1
91 . 1 1 15 15 CYS HA H 1 4.482 0.030 . 1 . . . . 15 CYS HA . 11380 1
92 . 1 1 15 15 CYS HB2 H 1 3.335 0.030 . 2 . . . . 15 CYS HB2 . 11380 1
93 . 1 1 15 15 CYS HB3 H 1 2.857 0.030 . 2 . . . . 15 CYS HB3 . 11380 1
94 . 1 1 15 15 CYS C C 13 177.416 0.300 . 1 . . . . 15 CYS C . 11380 1
95 . 1 1 15 15 CYS CA C 13 59.996 0.300 . 1 . . . . 15 CYS CA . 11380 1
96 . 1 1 15 15 CYS CB C 13 29.374 0.300 . 1 . . . . 15 CYS CB . 11380 1
97 . 1 1 15 15 CYS N N 15 129.557 0.300 . 1 . . . . 15 CYS N . 11380 1
98 . 1 1 16 16 GLN H H 1 9.619 0.030 . 1 . . . . 16 GLN H . 11380 1
99 . 1 1 16 16 GLN HA H 1 4.114 0.030 . 1 . . . . 16 GLN HA . 11380 1
100 . 1 1 16 16 GLN HB2 H 1 2.197 0.030 . 2 . . . . 16 GLN HB2 . 11380 1
101 . 1 1 16 16 GLN HB3 H 1 2.062 0.030 . 2 . . . . 16 GLN HB3 . 11380 1
102 . 1 1 16 16 GLN HE21 H 1 6.916 0.030 . 2 . . . . 16 GLN HE21 . 11380 1
103 . 1 1 16 16 GLN HE22 H 1 7.426 0.030 . 2 . . . . 16 GLN HE22 . 11380 1
104 . 1 1 16 16 GLN HG2 H 1 2.488 0.030 . 1 . . . . 16 GLN HG2 . 11380 1
105 . 1 1 16 16 GLN HG3 H 1 2.488 0.030 . 1 . . . . 16 GLN HG3 . 11380 1
106 . 1 1 16 16 GLN C C 13 176.472 0.300 . 1 . . . . 16 GLN C . 11380 1
107 . 1 1 16 16 GLN CA C 13 57.727 0.300 . 1 . . . . 16 GLN CA . 11380 1
108 . 1 1 16 16 GLN CB C 13 28.533 0.300 . 1 . . . . 16 GLN CB . 11380 1
109 . 1 1 16 16 GLN CG C 13 34.083 0.300 . 1 . . . . 16 GLN CG . 11380 1
110 . 1 1 16 16 GLN N N 15 131.731 0.300 . 1 . . . . 16 GLN N . 11380 1
111 . 1 1 16 16 GLN NE2 N 15 112.852 0.300 . 1 . . . . 16 GLN NE2 . 11380 1
112 . 1 1 17 17 SER H H 1 8.734 0.030 . 1 . . . . 17 SER H . 11380 1
113 . 1 1 17 17 SER HA H 1 4.371 0.030 . 1 . . . . 17 SER HA . 11380 1
114 . 1 1 17 17 SER HB2 H 1 3.100 0.030 . 2 . . . . 17 SER HB2 . 11380 1
115 . 1 1 17 17 SER HB3 H 1 2.757 0.030 . 2 . . . . 17 SER HB3 . 11380 1
116 . 1 1 17 17 SER C C 13 174.756 0.300 . 1 . . . . 17 SER C . 11380 1
117 . 1 1 17 17 SER CA C 13 61.274 0.300 . 1 . . . . 17 SER CA . 11380 1
118 . 1 1 17 17 SER CB C 13 62.046 0.300 . 1 . . . . 17 SER CB . 11380 1
119 . 1 1 17 17 SER N N 15 116.303 0.300 . 1 . . . . 17 SER N . 11380 1
120 . 1 1 18 18 CYS H H 1 8.083 0.030 . 1 . . . . 18 CYS H . 11380 1
121 . 1 1 18 18 CYS HA H 1 5.178 0.030 . 1 . . . . 18 CYS HA . 11380 1
122 . 1 1 18 18 CYS HB2 H 1 3.410 0.030 . 2 . . . . 18 CYS HB2 . 11380 1
123 . 1 1 18 18 CYS HB3 H 1 2.914 0.030 . 2 . . . . 18 CYS HB3 . 11380 1
124 . 1 1 18 18 CYS C C 13 175.965 0.300 . 1 . . . . 18 CYS C . 11380 1
125 . 1 1 18 18 CYS CA C 13 58.708 0.300 . 1 . . . . 18 CYS CA . 11380 1
126 . 1 1 18 18 CYS CB C 13 32.658 0.300 . 1 . . . . 18 CYS CB . 11380 1
127 . 1 1 18 18 CYS N N 15 117.056 0.300 . 1 . . . . 18 CYS N . 11380 1
128 . 1 1 19 19 GLY H H 1 8.243 0.030 . 1 . . . . 19 GLY H . 11380 1
129 . 1 1 19 19 GLY HA2 H 1 4.149 0.030 . 2 . . . . 19 GLY HA2 . 11380 1
130 . 1 1 19 19 GLY HA3 H 1 3.664 0.030 . 2 . . . . 19 GLY HA3 . 11380 1
131 . 1 1 19 19 GLY C C 13 173.441 0.300 . 1 . . . . 19 GLY C . 11380 1
132 . 1 1 19 19 GLY CA C 13 46.088 0.300 . 1 . . . . 19 GLY CA . 11380 1
133 . 1 1 19 19 GLY N N 15 113.725 0.300 . 1 . . . . 19 GLY N . 11380 1
134 . 1 1 20 20 LYS H H 1 7.918 0.030 . 1 . . . . 20 LYS H . 11380 1
135 . 1 1 20 20 LYS HA H 1 3.933 0.030 . 1 . . . . 20 LYS HA . 11380 1
136 . 1 1 20 20 LYS HB2 H 1 1.463 0.030 . 2 . . . . 20 LYS HB2 . 11380 1
137 . 1 1 20 20 LYS HB3 H 1 1.229 0.030 . 2 . . . . 20 LYS HB3 . 11380 1
138 . 1 1 20 20 LYS HD2 H 1 1.503 0.030 . 2 . . . . 20 LYS HD2 . 11380 1
139 . 1 1 20 20 LYS HD3 H 1 1.403 0.030 . 2 . . . . 20 LYS HD3 . 11380 1
140 . 1 1 20 20 LYS HE2 H 1 2.917 0.030 . 2 . . . . 20 LYS HE2 . 11380 1
141 . 1 1 20 20 LYS HE3 H 1 2.858 0.030 . 2 . . . . 20 LYS HE3 . 11380 1
142 . 1 1 20 20 LYS HG2 H 1 1.001 0.030 . 2 . . . . 20 LYS HG2 . 11380 1
143 . 1 1 20 20 LYS HG3 H 1 1.365 0.030 . 2 . . . . 20 LYS HG3 . 11380 1
144 . 1 1 20 20 LYS C C 13 174.588 0.300 . 1 . . . . 20 LYS C . 11380 1
145 . 1 1 20 20 LYS CA C 13 58.058 0.300 . 1 . . . . 20 LYS CA . 11380 1
146 . 1 1 20 20 LYS CB C 13 33.801 0.300 . 1 . . . . 20 LYS CB . 11380 1
147 . 1 1 20 20 LYS CD C 13 29.369 0.300 . 1 . . . . 20 LYS CD . 11380 1
148 . 1 1 20 20 LYS CE C 13 42.253 0.300 . 1 . . . . 20 LYS CE . 11380 1
149 . 1 1 20 20 LYS CG C 13 26.116 0.300 . 1 . . . . 20 LYS CG . 11380 1
150 . 1 1 20 20 LYS N N 15 123.036 0.300 . 1 . . . . 20 LYS N . 11380 1
151 . 1 1 21 21 GLY H H 1 7.932 0.030 . 1 . . . . 21 GLY H . 11380 1
152 . 1 1 21 21 GLY HA2 H 1 4.915 0.030 . 2 . . . . 21 GLY HA2 . 11380 1
153 . 1 1 21 21 GLY HA3 H 1 3.249 0.030 . 2 . . . . 21 GLY HA3 . 11380 1
154 . 1 1 21 21 GLY C C 13 172.562 0.300 . 1 . . . . 21 GLY C . 11380 1
155 . 1 1 21 21 GLY CA C 13 44.174 0.300 . 1 . . . . 21 GLY CA . 11380 1
156 . 1 1 21 21 GLY N N 15 108.569 0.300 . 1 . . . . 21 GLY N . 11380 1
157 . 1 1 22 22 PHE H H 1 8.788 0.030 . 1 . . . . 22 PHE H . 11380 1
158 . 1 1 22 22 PHE HA H 1 4.768 0.030 . 1 . . . . 22 PHE HA . 11380 1
159 . 1 1 22 22 PHE HB2 H 1 3.447 0.030 . 2 . . . . 22 PHE HB2 . 11380 1
160 . 1 1 22 22 PHE HB3 H 1 2.825 0.030 . 2 . . . . 22 PHE HB3 . 11380 1
161 . 1 1 22 22 PHE HD1 H 1 7.320 0.030 . 1 . . . . 22 PHE HD1 . 11380 1
162 . 1 1 22 22 PHE HD2 H 1 7.320 0.030 . 1 . . . . 22 PHE HD2 . 11380 1
163 . 1 1 22 22 PHE HE1 H 1 6.797 0.030 . 1 . . . . 22 PHE HE1 . 11380 1
164 . 1 1 22 22 PHE HE2 H 1 6.797 0.030 . 1 . . . . 22 PHE HE2 . 11380 1
165 . 1 1 22 22 PHE HZ H 1 6.165 0.030 . 1 . . . . 22 PHE HZ . 11380 1
166 . 1 1 22 22 PHE C C 13 175.578 0.300 . 1 . . . . 22 PHE C . 11380 1
167 . 1 1 22 22 PHE CA C 13 57.246 0.300 . 1 . . . . 22 PHE CA . 11380 1
168 . 1 1 22 22 PHE CB C 13 43.805 0.300 . 1 . . . . 22 PHE CB . 11380 1
169 . 1 1 22 22 PHE CD1 C 13 132.480 0.300 . 1 . . . . 22 PHE CD1 . 11380 1
170 . 1 1 22 22 PHE CD2 C 13 132.480 0.300 . 1 . . . . 22 PHE CD2 . 11380 1
171 . 1 1 22 22 PHE CE1 C 13 130.772 0.300 . 1 . . . . 22 PHE CE1 . 11380 1
172 . 1 1 22 22 PHE CE2 C 13 130.772 0.300 . 1 . . . . 22 PHE CE2 . 11380 1
173 . 1 1 22 22 PHE CZ C 13 128.615 0.300 . 1 . . . . 22 PHE CZ . 11380 1
174 . 1 1 22 22 PHE N N 15 117.851 0.300 . 1 . . . . 22 PHE N . 11380 1
175 . 1 1 23 23 SER H H 1 9.774 0.030 . 1 . . . . 23 SER H . 11380 1
176 . 1 1 23 23 SER HA H 1 4.711 0.030 . 1 . . . . 23 SER HA . 11380 1
177 . 1 1 23 23 SER HB2 H 1 4.114 0.030 . 2 . . . . 23 SER HB2 . 11380 1
178 . 1 1 23 23 SER HB3 H 1 4.058 0.030 . 2 . . . . 23 SER HB3 . 11380 1
179 . 1 1 23 23 SER C C 13 173.960 0.300 . 1 . . . . 23 SER C . 11380 1
180 . 1 1 23 23 SER CA C 13 60.148 0.300 . 1 . . . . 23 SER CA . 11380 1
181 . 1 1 23 23 SER CB C 13 64.490 0.300 . 1 . . . . 23 SER CB . 11380 1
182 . 1 1 23 23 SER N N 15 116.001 0.300 . 1 . . . . 23 SER N . 11380 1
183 . 1 1 24 24 ARG H H 1 7.192 0.030 . 1 . . . . 24 ARG H . 11380 1
184 . 1 1 24 24 ARG HA H 1 4.738 0.030 . 1 . . . . 24 ARG HA . 11380 1
185 . 1 1 24 24 ARG HB2 H 1 1.873 0.030 . 2 . . . . 24 ARG HB2 . 11380 1
186 . 1 1 24 24 ARG HB3 H 1 0.877 0.030 . 2 . . . . 24 ARG HB3 . 11380 1
187 . 1 1 24 24 ARG HD2 H 1 2.780 0.030 . 2 . . . . 24 ARG HD2 . 11380 1
188 . 1 1 24 24 ARG HD3 H 1 3.079 0.030 . 2 . . . . 24 ARG HD3 . 11380 1
189 . 1 1 24 24 ARG HG2 H 1 1.344 0.030 . 2 . . . . 24 ARG HG2 . 11380 1
190 . 1 1 24 24 ARG HG3 H 1 1.525 0.030 . 2 . . . . 24 ARG HG3 . 11380 1
191 . 1 1 24 24 ARG C C 13 174.855 0.300 . 1 . . . . 24 ARG C . 11380 1
192 . 1 1 24 24 ARG CA C 13 52.650 0.300 . 1 . . . . 24 ARG CA . 11380 1
193 . 1 1 24 24 ARG CB C 13 33.486 0.300 . 1 . . . . 24 ARG CB . 11380 1
194 . 1 1 24 24 ARG CD C 13 43.439 0.300 . 1 . . . . 24 ARG CD . 11380 1
195 . 1 1 24 24 ARG CG C 13 26.275 0.300 . 1 . . . . 24 ARG CG . 11380 1
196 . 1 1 24 24 ARG N N 15 117.224 0.300 . 1 . . . . 24 ARG N . 11380 1
197 . 1 1 25 25 PRO HA H 1 3.470 0.030 . 1 . . . . 25 PRO HA . 11380 1
198 . 1 1 25 25 PRO HB2 H 1 1.752 0.030 . 1 . . . . 25 PRO HB2 . 11380 1
199 . 1 1 25 25 PRO HB3 H 1 1.752 0.030 . 1 . . . . 25 PRO HB3 . 11380 1
200 . 1 1 25 25 PRO HD2 H 1 3.032 0.030 . 2 . . . . 25 PRO HD2 . 11380 1
201 . 1 1 25 25 PRO HD3 H 1 3.533 0.030 . 2 . . . . 25 PRO HD3 . 11380 1
202 . 1 1 25 25 PRO HG2 H 1 1.876 0.030 . 2 . . . . 25 PRO HG2 . 11380 1
203 . 1 1 25 25 PRO HG3 H 1 1.514 0.030 . 2 . . . . 25 PRO HG3 . 11380 1
204 . 1 1 25 25 PRO C C 13 178.102 0.300 . 1 . . . . 25 PRO C . 11380 1
205 . 1 1 25 25 PRO CA C 13 64.466 0.300 . 1 . . . . 25 PRO CA . 11380 1
206 . 1 1 25 25 PRO CB C 13 31.083 0.300 . 1 . . . . 25 PRO CB . 11380 1
207 . 1 1 25 25 PRO CD C 13 50.083 0.300 . 1 . . . . 25 PRO CD . 11380 1
208 . 1 1 25 25 PRO CG C 13 26.538 0.300 . 1 . . . . 25 PRO CG . 11380 1
209 . 1 1 26 26 ASP H H 1 8.618 0.030 . 1 . . . . 26 ASP H . 11380 1
210 . 1 1 26 26 ASP HA H 1 4.287 0.030 . 1 . . . . 26 ASP HA . 11380 1
211 . 1 1 26 26 ASP HB2 H 1 2.500 0.030 . 2 . . . . 26 ASP HB2 . 11380 1
212 . 1 1 26 26 ASP HB3 H 1 2.666 0.030 . 2 . . . . 26 ASP HB3 . 11380 1
213 . 1 1 26 26 ASP C C 13 179.416 0.300 . 1 . . . . 26 ASP C . 11380 1
214 . 1 1 26 26 ASP CA C 13 56.125 0.300 . 1 . . . . 26 ASP CA . 11380 1
215 . 1 1 26 26 ASP CB C 13 38.236 0.300 . 1 . . . . 26 ASP CB . 11380 1
216 . 1 1 26 26 ASP N N 15 116.090 0.300 . 1 . . . . 26 ASP N . 11380 1
217 . 1 1 27 27 HIS H H 1 7.029 0.030 . 1 . . . . 27 HIS H . 11380 1
218 . 1 1 27 27 HIS HA H 1 4.498 0.030 . 1 . . . . 27 HIS HA . 11380 1
219 . 1 1 27 27 HIS HB2 H 1 3.282 0.030 . 1 . . . . 27 HIS HB2 . 11380 1
220 . 1 1 27 27 HIS HB3 H 1 3.282 0.030 . 1 . . . . 27 HIS HB3 . 11380 1
221 . 1 1 27 27 HIS HD2 H 1 6.855 0.030 . 1 . . . . 27 HIS HD2 . 11380 1
222 . 1 1 27 27 HIS HE1 H 1 7.773 0.030 . 1 . . . . 27 HIS HE1 . 11380 1
223 . 1 1 27 27 HIS C C 13 178.172 0.300 . 1 . . . . 27 HIS C . 11380 1
224 . 1 1 27 27 HIS CA C 13 56.808 0.300 . 1 . . . . 27 HIS CA . 11380 1
225 . 1 1 27 27 HIS CB C 13 31.689 0.300 . 1 . . . . 27 HIS CB . 11380 1
226 . 1 1 27 27 HIS CD2 C 13 116.577 0.300 . 1 . . . . 27 HIS CD2 . 11380 1
227 . 1 1 27 27 HIS CE1 C 13 139.024 0.300 . 1 . . . . 27 HIS CE1 . 11380 1
228 . 1 1 27 27 HIS N N 15 121.052 0.300 . 1 . . . . 27 HIS N . 11380 1
229 . 1 1 28 28 LEU H H 1 6.877 0.030 . 1 . . . . 28 LEU H . 11380 1
230 . 1 1 28 28 LEU HA H 1 3.169 0.030 . 1 . . . . 28 LEU HA . 11380 1
231 . 1 1 28 28 LEU HB2 H 1 1.892 0.030 . 2 . . . . 28 LEU HB2 . 11380 1
232 . 1 1 28 28 LEU HB3 H 1 1.257 0.030 . 2 . . . . 28 LEU HB3 . 11380 1
233 . 1 1 28 28 LEU HD11 H 1 0.993 0.030 . 1 . . . . 28 LEU HD1 . 11380 1
234 . 1 1 28 28 LEU HD12 H 1 0.993 0.030 . 1 . . . . 28 LEU HD1 . 11380 1
235 . 1 1 28 28 LEU HD13 H 1 0.993 0.030 . 1 . . . . 28 LEU HD1 . 11380 1
236 . 1 1 28 28 LEU HD21 H 1 1.037 0.030 . 1 . . . . 28 LEU HD2 . 11380 1
237 . 1 1 28 28 LEU HD22 H 1 1.037 0.030 . 1 . . . . 28 LEU HD2 . 11380 1
238 . 1 1 28 28 LEU HD23 H 1 1.037 0.030 . 1 . . . . 28 LEU HD2 . 11380 1
239 . 1 1 28 28 LEU HG H 1 1.572 0.030 . 1 . . . . 28 LEU HG . 11380 1
240 . 1 1 28 28 LEU C C 13 177.189 0.300 . 1 . . . . 28 LEU C . 11380 1
241 . 1 1 28 28 LEU CA C 13 57.896 0.300 . 1 . . . . 28 LEU CA . 11380 1
242 . 1 1 28 28 LEU CB C 13 39.999 0.300 . 1 . . . . 28 LEU CB . 11380 1
243 . 1 1 28 28 LEU CD1 C 13 26.373 0.300 . 2 . . . . 28 LEU CD1 . 11380 1
244 . 1 1 28 28 LEU CD2 C 13 22.519 0.300 . 2 . . . . 28 LEU CD2 . 11380 1
245 . 1 1 28 28 LEU CG C 13 27.538 0.300 . 1 . . . . 28 LEU CG . 11380 1
246 . 1 1 28 28 LEU N N 15 121.115 0.300 . 1 . . . . 28 LEU N . 11380 1
247 . 1 1 29 29 ASN H H 1 8.203 0.030 . 1 . . . . 29 ASN H . 11380 1
248 . 1 1 29 29 ASN HA H 1 4.339 0.030 . 1 . . . . 29 ASN HA . 11380 1
249 . 1 1 29 29 ASN HB2 H 1 2.710 0.030 . 1 . . . . 29 ASN HB2 . 11380 1
250 . 1 1 29 29 ASN HB3 H 1 2.710 0.030 . 1 . . . . 29 ASN HB3 . 11380 1
251 . 1 1 29 29 ASN HD21 H 1 7.576 0.030 . 2 . . . . 29 ASN HD21 . 11380 1
252 . 1 1 29 29 ASN HD22 H 1 6.863 0.030 . 2 . . . . 29 ASN HD22 . 11380 1
253 . 1 1 29 29 ASN C C 13 178.239 0.300 . 1 . . . . 29 ASN C . 11380 1
254 . 1 1 29 29 ASN CA C 13 56.678 0.300 . 1 . . . . 29 ASN CA . 11380 1
255 . 1 1 29 29 ASN CB C 13 37.934 0.300 . 1 . . . . 29 ASN CB . 11380 1
256 . 1 1 29 29 ASN N N 15 117.764 0.300 . 1 . . . . 29 ASN N . 11380 1
257 . 1 1 29 29 ASN ND2 N 15 112.209 0.300 . 1 . . . . 29 ASN ND2 . 11380 1
258 . 1 1 30 30 GLY H H 1 8.137 0.030 . 1 . . . . 30 GLY H . 11380 1
259 . 1 1 30 30 GLY HA2 H 1 3.856 0.030 . 2 . . . . 30 GLY HA2 . 11380 1
260 . 1 1 30 30 GLY HA3 H 1 3.764 0.030 . 2 . . . . 30 GLY HA3 . 11380 1
261 . 1 1 30 30 GLY C C 13 175.359 0.300 . 1 . . . . 30 GLY C . 11380 1
262 . 1 1 30 30 GLY CA C 13 47.072 0.300 . 1 . . . . 30 GLY CA . 11380 1
263 . 1 1 30 30 GLY N N 15 106.979 0.300 . 1 . . . . 30 GLY N . 11380 1
264 . 1 1 31 31 HIS H H 1 7.483 0.030 . 1 . . . . 31 HIS H . 11380 1
265 . 1 1 31 31 HIS HA H 1 4.294 0.030 . 1 . . . . 31 HIS HA . 11380 1
266 . 1 1 31 31 HIS HB2 H 1 3.237 0.030 . 2 . . . . 31 HIS HB2 . 11380 1
267 . 1 1 31 31 HIS HB3 H 1 2.817 0.030 . 2 . . . . 31 HIS HB3 . 11380 1
268 . 1 1 31 31 HIS HD2 H 1 7.127 0.030 . 1 . . . . 31 HIS HD2 . 11380 1
269 . 1 1 31 31 HIS HE1 H 1 8.038 0.030 . 1 . . . . 31 HIS HE1 . 11380 1
270 . 1 1 31 31 HIS C C 13 176.286 0.300 . 1 . . . . 31 HIS C . 11380 1
271 . 1 1 31 31 HIS CA C 13 59.285 0.300 . 1 . . . . 31 HIS CA . 11380 1
272 . 1 1 31 31 HIS CB C 13 28.316 0.300 . 1 . . . . 31 HIS CB . 11380 1
273 . 1 1 31 31 HIS CD2 C 13 127.949 0.300 . 1 . . . . 31 HIS CD2 . 11380 1
274 . 1 1 31 31 HIS CE1 C 13 139.387 0.300 . 1 . . . . 31 HIS CE1 . 11380 1
275 . 1 1 31 31 HIS N N 15 121.817 0.300 . 1 . . . . 31 HIS N . 11380 1
276 . 1 1 32 32 ILE H H 1 8.468 0.030 . 1 . . . . 32 ILE H . 11380 1
277 . 1 1 32 32 ILE HA H 1 3.371 0.030 . 1 . . . . 32 ILE HA . 11380 1
278 . 1 1 32 32 ILE HB H 1 1.898 0.030 . 1 . . . . 32 ILE HB . 11380 1
279 . 1 1 32 32 ILE HD11 H 1 1.051 0.030 . 1 . . . . 32 ILE HD1 . 11380 1
280 . 1 1 32 32 ILE HD12 H 1 1.051 0.030 . 1 . . . . 32 ILE HD1 . 11380 1
281 . 1 1 32 32 ILE HD13 H 1 1.051 0.030 . 1 . . . . 32 ILE HD1 . 11380 1
282 . 1 1 32 32 ILE HG12 H 1 1.393 0.030 . 2 . . . . 32 ILE HG12 . 11380 1
283 . 1 1 32 32 ILE HG13 H 1 2.111 0.030 . 2 . . . . 32 ILE HG13 . 11380 1
284 . 1 1 32 32 ILE HG21 H 1 0.949 0.030 . 1 . . . . 32 ILE HG2 . 11380 1
285 . 1 1 32 32 ILE HG22 H 1 0.949 0.030 . 1 . . . . 32 ILE HG2 . 11380 1
286 . 1 1 32 32 ILE HG23 H 1 0.949 0.030 . 1 . . . . 32 ILE HG2 . 11380 1
287 . 1 1 32 32 ILE C C 13 178.635 0.300 . 1 . . . . 32 ILE C . 11380 1
288 . 1 1 32 32 ILE CA C 13 66.696 0.300 . 1 . . . . 32 ILE CA . 11380 1
289 . 1 1 32 32 ILE CB C 13 38.528 0.300 . 1 . . . . 32 ILE CB . 11380 1
290 . 1 1 32 32 ILE CD1 C 13 14.251 0.300 . 1 . . . . 32 ILE CD1 . 11380 1
291 . 1 1 32 32 ILE CG1 C 13 30.504 0.300 . 1 . . . . 32 ILE CG1 . 11380 1
292 . 1 1 32 32 ILE CG2 C 13 17.415 0.300 . 1 . . . . 32 ILE CG2 . 11380 1
293 . 1 1 32 32 ILE N N 15 120.253 0.300 . 1 . . . . 32 ILE N . 11380 1
294 . 1 1 33 33 LYS H H 1 7.594 0.030 . 1 . . . . 33 LYS H . 11380 1
295 . 1 1 33 33 LYS HA H 1 3.975 0.030 . 1 . . . . 33 LYS HA . 11380 1
296 . 1 1 33 33 LYS HB2 H 1 1.825 0.030 . 1 . . . . 33 LYS HB2 . 11380 1
297 . 1 1 33 33 LYS HB3 H 1 1.825 0.030 . 1 . . . . 33 LYS HB3 . 11380 1
298 . 1 1 33 33 LYS HD2 H 1 1.606 0.030 . 1 . . . . 33 LYS HD2 . 11380 1
299 . 1 1 33 33 LYS HD3 H 1 1.606 0.030 . 1 . . . . 33 LYS HD3 . 11380 1
300 . 1 1 33 33 LYS HE2 H 1 2.905 0.030 . 1 . . . . 33 LYS HE2 . 11380 1
301 . 1 1 33 33 LYS HE3 H 1 2.905 0.030 . 1 . . . . 33 LYS HE3 . 11380 1
302 . 1 1 33 33 LYS HG2 H 1 1.459 0.030 . 2 . . . . 33 LYS HG2 . 11380 1
303 . 1 1 33 33 LYS HG3 H 1 1.376 0.030 . 2 . . . . 33 LYS HG3 . 11380 1
304 . 1 1 33 33 LYS C C 13 177.827 0.300 . 1 . . . . 33 LYS C . 11380 1
305 . 1 1 33 33 LYS CA C 13 58.576 0.300 . 1 . . . . 33 LYS CA . 11380 1
306 . 1 1 33 33 LYS CB C 13 32.530 0.300 . 1 . . . . 33 LYS CB . 11380 1
307 . 1 1 33 33 LYS CD C 13 29.089 0.300 . 1 . . . . 33 LYS CD . 11380 1
308 . 1 1 33 33 LYS CE C 13 42.051 0.300 . 1 . . . . 33 LYS CE . 11380 1
309 . 1 1 33 33 LYS CG C 13 24.986 0.300 . 1 . . . . 33 LYS CG . 11380 1
310 . 1 1 33 33 LYS N N 15 117.438 0.300 . 1 . . . . 33 LYS N . 11380 1
311 . 1 1 34 34 GLN H H 1 7.781 0.030 . 1 . . . . 34 GLN H . 11380 1
312 . 1 1 34 34 GLN HA H 1 4.052 0.030 . 1 . . . . 34 GLN HA . 11380 1
313 . 1 1 34 34 GLN HB2 H 1 2.040 0.030 . 2 . . . . 34 GLN HB2 . 11380 1
314 . 1 1 34 34 GLN HB3 H 1 2.006 0.030 . 2 . . . . 34 GLN HB3 . 11380 1
315 . 1 1 34 34 GLN HE21 H 1 7.346 0.030 . 2 . . . . 34 GLN HE21 . 11380 1
316 . 1 1 34 34 GLN HE22 H 1 6.780 0.030 . 2 . . . . 34 GLN HE22 . 11380 1
317 . 1 1 34 34 GLN HG2 H 1 2.397 0.030 . 2 . . . . 34 GLN HG2 . 11380 1
318 . 1 1 34 34 GLN HG3 H 1 2.263 0.030 . 2 . . . . 34 GLN HG3 . 11380 1
319 . 1 1 34 34 GLN C C 13 177.633 0.300 . 1 . . . . 34 GLN C . 11380 1
320 . 1 1 34 34 GLN CA C 13 58.102 0.300 . 1 . . . . 34 GLN CA . 11380 1
321 . 1 1 34 34 GLN CB C 13 29.767 0.300 . 1 . . . . 34 GLN CB . 11380 1
322 . 1 1 34 34 GLN CG C 13 33.918 0.300 . 1 . . . . 34 GLN CG . 11380 1
323 . 1 1 34 34 GLN N N 15 115.939 0.300 . 1 . . . . 34 GLN N . 11380 1
324 . 1 1 34 34 GLN NE2 N 15 111.654 0.300 . 1 . . . . 34 GLN NE2 . 11380 1
325 . 1 1 35 35 VAL H H 1 8.109 0.030 . 1 . . . . 35 VAL H . 11380 1
326 . 1 1 35 35 VAL HA H 1 3.923 0.030 . 1 . . . . 35 VAL HA . 11380 1
327 . 1 1 35 35 VAL HB H 1 0.900 0.030 . 1 . . . . 35 VAL HB . 11380 1
328 . 1 1 35 35 VAL HG11 H 1 0.517 0.030 . 1 . . . . 35 VAL HG1 . 11380 1
329 . 1 1 35 35 VAL HG12 H 1 0.517 0.030 . 1 . . . . 35 VAL HG1 . 11380 1
330 . 1 1 35 35 VAL HG13 H 1 0.517 0.030 . 1 . . . . 35 VAL HG1 . 11380 1
331 . 1 1 35 35 VAL HG21 H 1 0.371 0.030 . 1 . . . . 35 VAL HG2 . 11380 1
332 . 1 1 35 35 VAL HG22 H 1 0.371 0.030 . 1 . . . . 35 VAL HG2 . 11380 1
333 . 1 1 35 35 VAL HG23 H 1 0.371 0.030 . 1 . . . . 35 VAL HG2 . 11380 1
334 . 1 1 35 35 VAL C C 13 176.343 0.300 . 1 . . . . 35 VAL C . 11380 1
335 . 1 1 35 35 VAL CA C 13 63.693 0.300 . 1 . . . . 35 VAL CA . 11380 1
336 . 1 1 35 35 VAL CB C 13 33.241 0.300 . 1 . . . . 35 VAL CB . 11380 1
337 . 1 1 35 35 VAL CG1 C 13 21.746 0.300 . 2 . . . . 35 VAL CG1 . 11380 1
338 . 1 1 35 35 VAL CG2 C 13 21.184 0.300 . 2 . . . . 35 VAL CG2 . 11380 1
339 . 1 1 35 35 VAL N N 15 114.240 0.300 . 1 . . . . 35 VAL N . 11380 1
340 . 1 1 36 36 HIS H H 1 7.584 0.030 . 1 . . . . 36 HIS H . 11380 1
341 . 1 1 36 36 HIS HA H 1 5.185 0.030 . 1 . . . . 36 HIS HA . 11380 1
342 . 1 1 36 36 HIS HB2 H 1 3.165 0.030 . 2 . . . . 36 HIS HB2 . 11380 1
343 . 1 1 36 36 HIS HB3 H 1 3.347 0.030 . 2 . . . . 36 HIS HB3 . 11380 1
344 . 1 1 36 36 HIS HD2 H 1 6.608 0.030 . 1 . . . . 36 HIS HD2 . 11380 1
345 . 1 1 36 36 HIS HE1 H 1 7.978 0.030 . 1 . . . . 36 HIS HE1 . 11380 1
346 . 1 1 36 36 HIS C C 13 175.233 0.300 . 1 . . . . 36 HIS C . 11380 1
347 . 1 1 36 36 HIS CA C 13 54.276 0.300 . 1 . . . . 36 HIS CA . 11380 1
348 . 1 1 36 36 HIS CB C 13 28.843 0.300 . 1 . . . . 36 HIS CB . 11380 1
349 . 1 1 36 36 HIS CD2 C 13 127.725 0.300 . 1 . . . . 36 HIS CD2 . 11380 1
350 . 1 1 36 36 HIS CE1 C 13 139.769 0.300 . 1 . . . . 36 HIS CE1 . 11380 1
351 . 1 1 36 36 HIS N N 15 116.690 0.300 . 1 . . . . 36 HIS N . 11380 1
352 . 1 1 37 37 THR H H 1 7.642 0.030 . 1 . . . . 37 THR H . 11380 1
353 . 1 1 37 37 THR HA H 1 4.341 0.030 . 1 . . . . 37 THR HA . 11380 1
354 . 1 1 37 37 THR HB H 1 4.263 0.030 . 1 . . . . 37 THR HB . 11380 1
355 . 1 1 37 37 THR HG21 H 1 1.170 0.030 . 1 . . . . 37 THR HG2 . 11380 1
356 . 1 1 37 37 THR HG22 H 1 1.170 0.030 . 1 . . . . 37 THR HG2 . 11380 1
357 . 1 1 37 37 THR HG23 H 1 1.170 0.030 . 1 . . . . 37 THR HG2 . 11380 1
358 . 1 1 37 37 THR C C 13 174.555 0.300 . 1 . . . . 37 THR C . 11380 1
359 . 1 1 37 37 THR CA C 13 62.746 0.300 . 1 . . . . 37 THR CA . 11380 1
360 . 1 1 37 37 THR CB C 13 69.655 0.300 . 1 . . . . 37 THR CB . 11380 1
361 . 1 1 37 37 THR CG2 C 13 21.663 0.300 . 1 . . . . 37 THR CG2 . 11380 1
362 . 1 1 37 37 THR N N 15 113.465 0.300 . 1 . . . . 37 THR N . 11380 1
363 . 1 1 38 38 SER H H 1 8.360 0.030 . 1 . . . . 38 SER H . 11380 1
364 . 1 1 38 38 SER HA H 1 4.441 0.030 . 1 . . . . 38 SER HA . 11380 1
365 . 1 1 38 38 SER HB2 H 1 3.870 0.030 . 2 . . . . 38 SER HB2 . 11380 1
366 . 1 1 38 38 SER HB3 H 1 3.815 0.030 . 2 . . . . 38 SER HB3 . 11380 1
367 . 1 1 38 38 SER C C 13 174.311 0.300 . 1 . . . . 38 SER C . 11380 1
368 . 1 1 38 38 SER CA C 13 58.398 0.300 . 1 . . . . 38 SER CA . 11380 1
369 . 1 1 38 38 SER CB C 13 63.817 0.300 . 1 . . . . 38 SER CB . 11380 1
370 . 1 1 38 38 SER N N 15 117.878 0.300 . 1 . . . . 38 SER N . 11380 1
371 . 1 1 39 39 GLU H H 1 8.287 0.030 . 1 . . . . 39 GLU H . 11380 1
372 . 1 1 39 39 GLU HA H 1 4.248 0.030 . 1 . . . . 39 GLU HA . 11380 1
373 . 1 1 39 39 GLU HB2 H 1 2.001 0.030 . 2 . . . . 39 GLU HB2 . 11380 1
374 . 1 1 39 39 GLU HB3 H 1 1.909 0.030 . 2 . . . . 39 GLU HB3 . 11380 1
375 . 1 1 39 39 GLU HG2 H 1 2.240 0.030 . 2 . . . . 39 GLU HG2 . 11380 1
376 . 1 1 39 39 GLU HG3 H 1 2.197 0.030 . 2 . . . . 39 GLU HG3 . 11380 1
377 . 1 1 39 39 GLU C C 13 176.118 0.300 . 1 . . . . 39 GLU C . 11380 1
378 . 1 1 39 39 GLU CA C 13 56.464 0.300 . 1 . . . . 39 GLU CA . 11380 1
379 . 1 1 39 39 GLU CB C 13 30.282 0.300 . 1 . . . . 39 GLU CB . 11380 1
380 . 1 1 39 39 GLU CG C 13 36.244 0.300 . 1 . . . . 39 GLU CG . 11380 1
381 . 1 1 39 39 GLU N N 15 122.619 0.300 . 1 . . . . 39 GLU N . 11380 1
382 . 1 1 40 40 ARG H H 1 8.309 0.030 . 1 . . . . 40 ARG H . 11380 1
383 . 1 1 40 40 ARG HA H 1 4.573 0.030 . 1 . . . . 40 ARG HA . 11380 1
384 . 1 1 40 40 ARG HB2 H 1 1.678 0.030 . 2 . . . . 40 ARG HB2 . 11380 1
385 . 1 1 40 40 ARG HB3 H 1 1.789 0.030 . 2 . . . . 40 ARG HB3 . 11380 1
386 . 1 1 40 40 ARG HD2 H 1 3.160 0.030 . 1 . . . . 40 ARG HD2 . 11380 1
387 . 1 1 40 40 ARG HD3 H 1 3.160 0.030 . 1 . . . . 40 ARG HD3 . 11380 1
388 . 1 1 40 40 ARG HG2 H 1 1.611 0.030 . 1 . . . . 40 ARG HG2 . 11380 1
389 . 1 1 40 40 ARG HG3 H 1 1.611 0.030 . 1 . . . . 40 ARG HG3 . 11380 1
390 . 1 1 40 40 ARG C C 13 174.012 0.300 . 1 . . . . 40 ARG C . 11380 1
391 . 1 1 40 40 ARG CA C 13 53.787 0.300 . 1 . . . . 40 ARG CA . 11380 1
392 . 1 1 40 40 ARG CB C 13 30.106 0.300 . 1 . . . . 40 ARG CB . 11380 1
393 . 1 1 40 40 ARG CD C 13 43.378 0.300 . 1 . . . . 40 ARG CD . 11380 1
394 . 1 1 40 40 ARG CG C 13 26.767 0.300 . 1 . . . . 40 ARG CG . 11380 1
395 . 1 1 40 40 ARG N N 15 122.964 0.300 . 1 . . . . 40 ARG N . 11380 1
396 . 1 1 41 41 PRO HA H 1 4.365 0.030 . 1 . . . . 41 PRO HA . 11380 1
397 . 1 1 41 41 PRO HB2 H 1 2.229 0.030 . 2 . . . . 41 PRO HB2 . 11380 1
398 . 1 1 41 41 PRO HB3 H 1 1.800 0.030 . 2 . . . . 41 PRO HB3 . 11380 1
399 . 1 1 41 41 PRO HD2 H 1 3.565 0.030 . 2 . . . . 41 PRO HD2 . 11380 1
400 . 1 1 41 41 PRO HD3 H 1 3.740 0.030 . 2 . . . . 41 PRO HD3 . 11380 1
401 . 1 1 41 41 PRO HG2 H 1 1.954 0.030 . 1 . . . . 41 PRO HG2 . 11380 1
402 . 1 1 41 41 PRO HG3 H 1 1.954 0.030 . 1 . . . . 41 PRO HG3 . 11380 1
403 . 1 1 41 41 PRO C C 13 176.405 0.300 . 1 . . . . 41 PRO C . 11380 1
404 . 1 1 41 41 PRO CA C 13 63.143 0.300 . 1 . . . . 41 PRO CA . 11380 1
405 . 1 1 41 41 PRO CB C 13 32.116 0.300 . 1 . . . . 41 PRO CB . 11380 1
406 . 1 1 41 41 PRO CD C 13 50.568 0.300 . 1 . . . . 41 PRO CD . 11380 1
407 . 1 1 41 41 PRO CG C 13 27.397 0.300 . 1 . . . . 41 PRO CG . 11380 1
408 . 1 1 42 42 HIS H H 1 8.501 0.030 . 1 . . . . 42 HIS H . 11380 1
409 . 1 1 42 42 HIS HA H 1 4.538 0.030 . 1 . . . . 42 HIS HA . 11380 1
410 . 1 1 42 42 HIS HB2 H 1 3.063 0.030 . 1 . . . . 42 HIS HB2 . 11380 1
411 . 1 1 42 42 HIS HB3 H 1 3.063 0.030 . 1 . . . . 42 HIS HB3 . 11380 1
412 . 1 1 42 42 HIS CA C 13 56.290 0.300 . 1 . . . . 42 HIS CA . 11380 1
413 . 1 1 42 42 HIS CB C 13 30.792 0.300 . 1 . . . . 42 HIS CB . 11380 1
414 . 1 1 42 42 HIS N N 15 120.736 0.300 . 1 . . . . 42 HIS N . 11380 1
415 . 1 1 43 43 LYS H H 1 8.057 0.030 . 1 . . . . 43 LYS H . 11380 1
416 . 1 1 43 43 LYS HA H 1 4.335 0.030 . 1 . . . . 43 LYS HA . 11380 1
417 . 1 1 43 43 LYS HB2 H 1 1.626 0.030 . 2 . . . . 43 LYS HB2 . 11380 1
418 . 1 1 43 43 LYS HB3 H 1 1.534 0.030 . 2 . . . . 43 LYS HB3 . 11380 1
419 . 1 1 43 43 LYS HD2 H 1 1.595 0.030 . 1 . . . . 43 LYS HD2 . 11380 1
420 . 1 1 43 43 LYS HD3 H 1 1.595 0.030 . 1 . . . . 43 LYS HD3 . 11380 1
421 . 1 1 43 43 LYS HE2 H 1 2.888 0.030 . 1 . . . . 43 LYS HE2 . 11380 1
422 . 1 1 43 43 LYS HE3 H 1 2.888 0.030 . 1 . . . . 43 LYS HE3 . 11380 1
423 . 1 1 43 43 LYS HG2 H 1 1.294 0.030 . 2 . . . . 43 LYS HG2 . 11380 1
424 . 1 1 43 43 LYS HG3 H 1 1.209 0.030 . 2 . . . . 43 LYS HG3 . 11380 1
425 . 1 1 43 43 LYS CA C 13 54.931 0.300 . 1 . . . . 43 LYS CA . 11380 1
426 . 1 1 43 43 LYS CB C 13 33.780 0.300 . 1 . . . . 43 LYS CB . 11380 1
427 . 1 1 43 43 LYS CD C 13 29.051 0.300 . 1 . . . . 43 LYS CD . 11380 1
428 . 1 1 43 43 LYS CE C 13 42.064 0.300 . 1 . . . . 43 LYS CE . 11380 1
429 . 1 1 43 43 LYS CG C 13 24.538 0.300 . 1 . . . . 43 LYS CG . 11380 1
430 . 1 1 43 43 LYS N N 15 121.316 0.300 . 1 . . . . 43 LYS N . 11380 1
431 . 1 1 45 45 GLN H H 1 8.369 0.030 . 1 . . . . 45 GLN H . 11380 1
432 . 1 1 45 45 GLN HA H 1 4.229 0.030 . 1 . . . . 45 GLN HA . 11380 1
433 . 1 1 45 45 GLN HB2 H 1 1.873 0.030 . 1 . . . . 45 GLN HB2 . 11380 1
434 . 1 1 45 45 GLN HB3 H 1 1.873 0.030 . 1 . . . . 45 GLN HB3 . 11380 1
435 . 1 1 45 45 GLN HE21 H 1 7.376 0.030 . 2 . . . . 45 GLN HE21 . 11380 1
436 . 1 1 45 45 GLN HE22 H 1 6.818 0.030 . 2 . . . . 45 GLN HE22 . 11380 1
437 . 1 1 45 45 GLN HG2 H 1 2.178 0.030 . 1 . . . . 45 GLN HG2 . 11380 1
438 . 1 1 45 45 GLN HG3 H 1 2.178 0.030 . 1 . . . . 45 GLN HG3 . 11380 1
439 . 1 1 45 45 GLN C C 13 175.314 0.300 . 1 . . . . 45 GLN C . 11380 1
440 . 1 1 45 45 GLN CA C 13 55.868 0.300 . 1 . . . . 45 GLN CA . 11380 1
441 . 1 1 45 45 GLN CB C 13 29.671 0.300 . 1 . . . . 45 GLN CB . 11380 1
442 . 1 1 45 45 GLN CG C 13 33.712 0.300 . 1 . . . . 45 GLN CG . 11380 1
443 . 1 1 45 45 GLN N N 15 121.279 0.300 . 1 . . . . 45 GLN N . 11380 1
444 . 1 1 45 45 GLN NE2 N 15 112.327 0.300 . 1 . . . . 45 GLN NE2 . 11380 1
445 . 1 1 46 46 VAL H H 1 8.051 0.030 . 1 . . . . 46 VAL H . 11380 1
446 . 1 1 46 46 VAL HA H 1 4.032 0.030 . 1 . . . . 46 VAL HA . 11380 1
447 . 1 1 46 46 VAL HB H 1 1.915 0.030 . 1 . . . . 46 VAL HB . 11380 1
448 . 1 1 46 46 VAL HG11 H 1 0.788 0.030 . 1 . . . . 46 VAL HG1 . 11380 1
449 . 1 1 46 46 VAL HG12 H 1 0.788 0.030 . 1 . . . . 46 VAL HG1 . 11380 1
450 . 1 1 46 46 VAL HG13 H 1 0.788 0.030 . 1 . . . . 46 VAL HG1 . 11380 1
451 . 1 1 46 46 VAL C C 13 175.442 0.300 . 1 . . . . 46 VAL C . 11380 1
452 . 1 1 46 46 VAL CA C 13 62.172 0.300 . 1 . . . . 46 VAL CA . 11380 1
453 . 1 1 46 46 VAL CB C 13 32.861 0.300 . 1 . . . . 46 VAL CB . 11380 1
454 . 1 1 46 46 VAL CG1 C 13 20.565 0.300 . 1 . . . . 46 VAL CG1 . 11380 1
455 . 1 1 46 46 VAL N N 15 120.954 0.300 . 1 . . . . 46 VAL N . 11380 1
456 . 1 1 47 47 TRP H H 1 8.179 0.030 . 1 . . . . 47 TRP H . 11380 1
457 . 1 1 47 47 TRP HA H 1 4.659 0.030 . 1 . . . . 47 TRP HA . 11380 1
458 . 1 1 47 47 TRP HB2 H 1 3.176 0.030 . 2 . . . . 47 TRP HB2 . 11380 1
459 . 1 1 47 47 TRP HB3 H 1 3.068 0.030 . 2 . . . . 47 TRP HB3 . 11380 1
460 . 1 1 47 47 TRP HD1 H 1 7.120 0.030 . 1 . . . . 47 TRP HD1 . 11380 1
461 . 1 1 47 47 TRP HE1 H 1 10.008 0.030 . 1 . . . . 47 TRP HE1 . 11380 1
462 . 1 1 47 47 TRP HE3 H 1 7.508 0.030 . 1 . . . . 47 TRP HE3 . 11380 1
463 . 1 1 47 47 TRP HH2 H 1 7.149 0.030 . 1 . . . . 47 TRP HH2 . 11380 1
464 . 1 1 47 47 TRP HZ2 H 1 7.402 0.030 . 1 . . . . 47 TRP HZ2 . 11380 1
465 . 1 1 47 47 TRP HZ3 H 1 7.075 0.030 . 1 . . . . 47 TRP HZ3 . 11380 1
466 . 1 1 47 47 TRP C C 13 175.723 0.300 . 1 . . . . 47 TRP C . 11380 1
467 . 1 1 47 47 TRP CA C 13 57.106 0.300 . 1 . . . . 47 TRP CA . 11380 1
468 . 1 1 47 47 TRP CB C 13 29.822 0.300 . 1 . . . . 47 TRP CB . 11380 1
469 . 1 1 47 47 TRP CD1 C 13 126.996 0.300 . 1 . . . . 47 TRP CD1 . 11380 1
470 . 1 1 47 47 TRP CE3 C 13 120.870 0.300 . 1 . . . . 47 TRP CE3 . 11380 1
471 . 1 1 47 47 TRP CH2 C 13 124.469 0.300 . 1 . . . . 47 TRP CH2 . 11380 1
472 . 1 1 47 47 TRP CZ2 C 13 114.472 0.300 . 1 . . . . 47 TRP CZ2 . 11380 1
473 . 1 1 47 47 TRP CZ3 C 13 121.934 0.300 . 1 . . . . 47 TRP CZ3 . 11380 1
474 . 1 1 47 47 TRP N N 15 125.087 0.300 . 1 . . . . 47 TRP N . 11380 1
475 . 1 1 47 47 TRP NE1 N 15 129.279 0.300 . 1 . . . . 47 TRP NE1 . 11380 1
476 . 1 1 48 48 VAL H H 1 7.896 0.030 . 1 . . . . 48 VAL H . 11380 1
477 . 1 1 48 48 VAL HA H 1 4.032 0.030 . 1 . . . . 48 VAL HA . 11380 1
478 . 1 1 48 48 VAL HB H 1 1.921 0.030 . 1 . . . . 48 VAL HB . 11380 1
479 . 1 1 48 48 VAL HG11 H 1 0.811 0.030 . 1 . . . . 48 VAL HG1 . 11380 1
480 . 1 1 48 48 VAL HG12 H 1 0.811 0.030 . 1 . . . . 48 VAL HG1 . 11380 1
481 . 1 1 48 48 VAL HG13 H 1 0.811 0.030 . 1 . . . . 48 VAL HG1 . 11380 1
482 . 1 1 48 48 VAL HG21 H 1 0.753 0.030 . 1 . . . . 48 VAL HG2 . 11380 1
483 . 1 1 48 48 VAL HG22 H 1 0.753 0.030 . 1 . . . . 48 VAL HG2 . 11380 1
484 . 1 1 48 48 VAL HG23 H 1 0.753 0.030 . 1 . . . . 48 VAL HG2 . 11380 1
485 . 1 1 48 48 VAL C C 13 175.477 0.300 . 1 . . . . 48 VAL C . 11380 1
486 . 1 1 48 48 VAL CA C 13 62.305 0.300 . 1 . . . . 48 VAL CA . 11380 1
487 . 1 1 48 48 VAL CB C 13 33.103 0.300 . 1 . . . . 48 VAL CB . 11380 1
488 . 1 1 48 48 VAL CG1 C 13 20.976 0.300 . 2 . . . . 48 VAL CG1 . 11380 1
489 . 1 1 48 48 VAL CG2 C 13 20.996 0.300 . 2 . . . . 48 VAL CG2 . 11380 1
490 . 1 1 48 48 VAL N N 15 122.528 0.300 . 1 . . . . 48 VAL N . 11380 1
491 . 1 1 49 49 SER H H 1 8.133 0.030 . 1 . . . . 49 SER H . 11380 1
492 . 1 1 49 49 SER HA H 1 4.283 0.030 . 1 . . . . 49 SER HA . 11380 1
493 . 1 1 49 49 SER HB2 H 1 3.765 0.030 . 1 . . . . 49 SER HB2 . 11380 1
494 . 1 1 49 49 SER HB3 H 1 3.765 0.030 . 1 . . . . 49 SER HB3 . 11380 1
495 . 1 1 49 49 SER C C 13 174.406 0.300 . 1 . . . . 49 SER C . 11380 1
496 . 1 1 49 49 SER CA C 13 58.153 0.300 . 1 . . . . 49 SER CA . 11380 1
497 . 1 1 49 49 SER CB C 13 64.013 0.300 . 1 . . . . 49 SER CB . 11380 1
498 . 1 1 49 49 SER N N 15 118.775 0.300 . 1 . . . . 49 SER N . 11380 1
499 . 1 1 50 50 GLY H H 1 8.115 0.030 . 1 . . . . 50 GLY H . 11380 1
500 . 1 1 50 50 GLY HA2 H 1 4.061 0.030 . 2 . . . . 50 GLY HA2 . 11380 1
501 . 1 1 50 50 GLY HA3 H 1 4.010 0.030 . 2 . . . . 50 GLY HA3 . 11380 1
502 . 1 1 50 50 GLY C C 13 171.651 0.300 . 1 . . . . 50 GLY C . 11380 1
503 . 1 1 50 50 GLY CA C 13 44.643 0.300 . 1 . . . . 50 GLY CA . 11380 1
504 . 1 1 50 50 GLY N N 15 110.717 0.300 . 1 . . . . 50 GLY N . 11380 1
505 . 1 1 51 51 PRO HA H 1 4.377 0.030 . 1 . . . . 51 PRO HA . 11380 1
506 . 1 1 51 51 PRO HB2 H 1 2.225 0.030 . 2 . . . . 51 PRO HB2 . 11380 1
507 . 1 1 51 51 PRO HB3 H 1 1.919 0.030 . 2 . . . . 51 PRO HB3 . 11380 1
508 . 1 1 51 51 PRO HD2 H 1 3.542 0.030 . 1 . . . . 51 PRO HD2 . 11380 1
509 . 1 1 51 51 PRO HD3 H 1 3.542 0.030 . 1 . . . . 51 PRO HD3 . 11380 1
510 . 1 1 51 51 PRO HG2 H 1 1.951 0.030 . 1 . . . . 51 PRO HG2 . 11380 1
511 . 1 1 51 51 PRO HG3 H 1 1.951 0.030 . 1 . . . . 51 PRO HG3 . 11380 1
512 . 1 1 51 51 PRO C C 13 177.290 0.300 . 1 . . . . 51 PRO C . 11380 1
513 . 1 1 51 51 PRO CA C 13 63.150 0.300 . 1 . . . . 51 PRO CA . 11380 1
514 . 1 1 51 51 PRO CB C 13 32.144 0.300 . 1 . . . . 51 PRO CB . 11380 1
515 . 1 1 51 51 PRO CD C 13 49.755 0.300 . 1 . . . . 51 PRO CD . 11380 1
516 . 1 1 51 51 PRO CG C 13 27.268 0.300 . 1 . . . . 51 PRO CG . 11380 1
517 . 1 1 52 52 SER H H 1 8.452 0.030 . 1 . . . . 52 SER H . 11380 1
518 . 1 1 52 52 SER C C 13 174.614 0.300 . 1 . . . . 52 SER C . 11380 1
519 . 1 1 52 52 SER CA C 13 58.391 0.300 . 1 . . . . 52 SER CA . 11380 1
520 . 1 1 52 52 SER CB C 13 64.042 0.300 . 1 . . . . 52 SER CB . 11380 1
521 . 1 1 52 52 SER N N 15 116.292 0.300 . 1 . . . . 52 SER N . 11380 1
stop_
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