Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 16157
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err 0.02
_Assigned_chem_shift_list.Chem_shift_13C_err 0.05
_Assigned_chem_shift_list.Chem_shift_15N_err 0.05
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 16157 1
2 '2D 1H-13C HSQC' . . . 16157 1
3 '2D 1H-1H NOESY' . . . 16157 1
4 '2D 1H-1H NOESY' . . . 16157 1
5 '3D 1H-15N NOESY' . . . 16157 1
6 '3D 1H-13C NOESY' . . . 16157 1
7 '3D HNCO' . . . 16157 1
8 '3D HNCACB' . . . 16157 1
9 '3D HBHA(CO)NH' . . . 16157 1
10 '3D CBCA(CO)NH' . . . 16157 1
12 '3D HCCH-TOCSY' . . . 16157 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 $TOPSPIN . . 16157 1
2 $XEASY . . 16157 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 1 1 ALA CA C 13 49.800 0.05 . 1 . . . . 1 ALA CA . 16157 1
2 . 1 1 1 1 ALA CB C 13 17.640 0.05 . 1 . . . . 1 ALA CB . 16157 1
3 . 1 1 1 1 ALA HA H 1 4.015 0.02 . 1 . . . . 5 ALA HA . 16157 1
4 . 1 1 1 1 ALA HB1 H 1 1.381 0.02 . 2 . . . . 5 ALA HB1 . 16157 1
5 . 1 1 1 1 ALA HB2 H 1 1.381 0.02 . 2 . . . . 5 ALA HB2 . 16157 1
6 . 1 1 1 1 ALA HB3 H 1 1.381 0.02 . 2 . . . . 5 ALA HB3 . 16157 1
7 . 1 1 2 2 THR H H 1 7.608 0.02 . 1 . . . . 6 THR H . 16157 1
8 . 1 1 2 2 THR C C 13 174.815 0.05 . 1 . . . . 2 THR C . 16157 1
9 . 1 1 2 2 THR CA C 13 56.801 0.05 . 1 . . . . 2 THR CA . 16157 1
10 . 1 1 2 2 THR CB C 13 68.857 0.05 . 1 . . . . 2 THR CB . 16157 1
11 . 1 1 2 2 THR N N 15 113.279 0.05 . 1 . . . . 6 THR N . 16157 1
12 . 1 1 5 5 PRO HA H 1 4.493 0.02 . 1 . . . . 5 PRO HA . 16157 1
13 . 1 1 5 5 PRO HB2 H 1 2.237 0.02 . 1 . . . . 5 PRO HB2 . 16157 1
14 . 1 1 5 5 PRO HB3 H 1 1.814 0.02 . 1 . . . . 5 PRO HB3 . 16157 1
15 . 1 1 5 5 PRO HD2 H 1 3.612 0.02 . 1 . . . . 5 PRO HD2 . 16157 1
16 . 1 1 5 5 PRO HD3 H 1 3.745 0.02 . 1 . . . . 5 PRO HD3 . 16157 1
17 . 1 1 5 5 PRO HG2 H 1 1.927 0.02 . 2 . . . . 5 PRO HG2 . 16157 1
18 . 1 1 5 5 PRO HG3 H 1 1.927 0.02 . 2 . . . . 5 PRO HG3 . 16157 1
19 . 1 1 5 5 PRO CA C 13 61.290 0.05 . 1 . . . . 5 PRO CA . 16157 1
20 . 1 1 5 5 PRO CB C 13 30.190 0.05 . 1 . . . . 5 PRO CB . 16157 1
21 . 1 1 5 5 PRO CD C 13 49.060 0.05 . 1 . . . . 5 PRO CD . 16157 1
22 . 1 1 5 5 PRO CG C 13 25.517 0.05 . 1 . . . . 5 PRO CG . 16157 1
23 . 1 1 6 6 VAL H H 1 7.794 0.02 . 1 . . . . 6 VAL H . 16157 1
24 . 1 1 6 6 VAL HA H 1 3.880 0.02 . 1 . . . . 6 VAL HA . 16157 1
25 . 1 1 6 6 VAL HB H 1 1.810 0.02 . 1 . . . . 6 VAL HB . 16157 1
26 . 1 1 6 6 VAL HG11 H 1 0.754 0.02 . 2 . . . . 6 VAL HG11 . 16157 1
27 . 1 1 6 6 VAL HG12 H 1 0.754 0.02 . 2 . . . . 6 VAL HG12 . 16157 1
28 . 1 1 6 6 VAL HG13 H 1 0.754 0.02 . 2 . . . . 6 VAL HG13 . 16157 1
29 . 1 1 6 6 VAL HG21 H 1 0.732 0.02 . 2 . . . . 6 VAL HG21 . 16157 1
30 . 1 1 6 6 VAL HG22 H 1 0.732 0.02 . 2 . . . . 6 VAL HG22 . 16157 1
31 . 1 1 6 6 VAL HG23 H 1 0.732 0.02 . 2 . . . . 6 VAL HG23 . 16157 1
32 . 1 1 6 6 VAL C C 13 175.059 0.05 . 1 . . . . 6 VAL C . 16157 1
33 . 1 1 6 6 VAL CA C 13 59.560 0.05 . 1 . . . . 6 VAL CA . 16157 1
34 . 1 1 6 6 VAL CB C 13 30.680 0.05 . 1 . . . . 6 VAL CB . 16157 1
35 . 1 1 6 6 VAL CG1 C 13 19.775 0.05 . 2 . . . . 6 VAL CG1 . 16157 1
36 . 1 1 6 6 VAL CG2 C 13 19.775 0.05 . 2 . . . . 6 VAL CG2 . 16157 1
37 . 1 1 6 6 VAL N N 15 118.616 0.05 . 1 . . . . 6 VAL N . 16157 1
38 . 1 1 7 7 ALA H H 1 8.029 0.02 . 1 . . . . 7 ALA H . 16157 1
39 . 1 1 7 7 ALA HA H 1 4.167 0.02 . 1 . . . . 7 ALA HA . 16157 1
40 . 1 1 7 7 ALA HB1 H 1 1.503 0.02 . 2 . . . . 7 ALA HB1 . 16157 1
41 . 1 1 7 7 ALA HB2 H 1 1.503 0.02 . 2 . . . . 7 ALA HB2 . 16157 1
42 . 1 1 7 7 ALA HB3 H 1 1.503 0.02 . 2 . . . . 7 ALA HB3 . 16157 1
43 . 1 1 7 7 ALA C C 13 173.395 0.05 . 1 . . . . 7 ALA C . 16157 1
44 . 1 1 7 7 ALA CA C 13 50.780 0.05 . 1 . . . . 7 ALA CA . 16157 1
45 . 1 1 7 7 ALA CB C 13 18.292 0.05 . 1 . . . . 7 ALA CB . 16157 1
46 . 1 1 7 7 ALA N N 15 126.653 0.05 . 1 . . . . 7 ALA N . 16157 1
47 . 1 1 8 8 GLU H H 1 8.587 0.02 . 1 . . . . 8 GLU H . 16157 1
48 . 1 1 8 8 GLU HA H 1 4.085 0.02 . 1 . . . . 8 GLU HA . 16157 1
49 . 1 1 8 8 GLU HB2 H 1 2.016 0.02 . 1 . . . . 8 GLU HB2 . 16157 1
50 . 1 1 8 8 GLU HB3 H 1 1.937 0.02 . 1 . . . . 8 GLU HB3 . 16157 1
51 . 1 1 8 8 GLU HG2 H 1 2.236 0.02 . 2 . . . . 8 GLU HG2 . 16157 1
52 . 1 1 8 8 GLU HG3 H 1 2.236 0.02 . 2 . . . . 8 GLU HG3 . 16157 1
53 . 1 1 8 8 GLU C C 13 176.717 0.05 . 1 . . . . 8 GLU C . 16157 1
54 . 1 1 8 8 GLU CA C 13 56.520 0.05 . 1 . . . . 8 GLU CA . 16157 1
55 . 1 1 8 8 GLU CB C 13 27.393 0.05 . 1 . . . . 8 GLU CB . 16157 1
56 . 1 1 8 8 GLU CG C 13 34.290 0.05 . 1 . . . . 8 GLU CG . 16157 1
57 . 1 1 8 8 GLU N N 15 118.049 0.05 . 1 . . . . 8 GLU N . 16157 1
58 . 1 1 9 9 CYS H H 1 7.348 0.02 . 1 . . . . 9 CYS H . 16157 1
59 . 1 1 9 9 CYS HA H 1 4.422 0.02 . 1 . . . . 9 CYS HA . 16157 1
60 . 1 1 9 9 CYS HB2 H 1 2.993 0.02 . 2 . . . . 9 CYS HB2 . 16157 1
61 . 1 1 9 9 CYS HB3 H 1 2.993 0.02 . 2 . . . . 9 CYS HB3 . 16157 1
62 . 1 1 9 9 CYS C C 13 173.399 0.05 . 1 . . . . 9 CYS C . 16157 1
63 . 1 1 9 9 CYS CA C 13 51.850 0.05 . 1 . . . . 9 CYS CA . 16157 1
64 . 1 1 9 9 CYS CB C 13 38.617 0.05 . 1 . . . . 9 CYS CB . 16157 1
65 . 1 1 9 9 CYS N N 15 109.798 0.05 . 1 . . . . 9 CYS N . 16157 1
66 . 1 1 10 10 VAL H H 1 7.682 0.02 . 1 . . . . 10 VAL H . 16157 1
67 . 1 1 10 10 VAL HA H 1 4.483 0.02 . 1 . . . . 10 VAL HA . 16157 1
68 . 1 1 10 10 VAL HB H 1 2.002 0.02 . 1 . . . . 10 VAL HB . 16157 1
69 . 1 1 10 10 VAL HG11 H 1 0.793 0.02 . 2 . . . . 10 VAL HG11 . 16157 1
70 . 1 1 10 10 VAL HG12 H 1 0.793 0.02 . 2 . . . . 10 VAL HG12 . 16157 1
71 . 1 1 10 10 VAL HG13 H 1 0.793 0.02 . 2 . . . . 10 VAL HG13 . 16157 1
72 . 1 1 10 10 VAL HG21 H 1 0.531 0.02 . 2 . . . . 10 VAL HG21 . 16157 1
73 . 1 1 10 10 VAL HG22 H 1 0.531 0.02 . 2 . . . . 10 VAL HG22 . 16157 1
74 . 1 1 10 10 VAL HG23 H 1 0.531 0.02 . 2 . . . . 10 VAL HG23 . 16157 1
75 . 1 1 10 10 VAL C C 13 172.261 0.05 . 1 . . . . 10 VAL C . 16157 1
76 . 1 1 10 10 VAL CA C 13 60.360 0.05 . 1 . . . . 10 VAL CA . 16157 1
77 . 1 1 10 10 VAL CB C 13 29.445 0.05 . 1 . . . . 10 VAL CB . 16157 1
78 . 1 1 10 10 VAL CG1 C 13 22.050 0.05 . 1 . . . . 10 VAL CG1 . 16157 1
79 . 1 1 10 10 VAL CG2 C 13 20.880 0.05 . 1 . . . . 10 VAL CG2 . 16157 1
80 . 1 1 10 10 VAL N N 15 125.088 0.05 . 1 . . . . 10 VAL N . 16157 1
81 . 1 1 11 11 GLU H H 1 8.322 0.02 . 1 . . . . 11 GLU H . 16157 1
82 . 1 1 11 11 GLU HA H 1 4.644 0.02 . 1 . . . . 11 GLU HA . 16157 1
83 . 1 1 11 11 GLU HB2 H 1 1.751 0.02 . 2 . . . . 11 GLU HB2 . 16157 1
84 . 1 1 11 11 GLU HB3 H 1 1.751 0.02 . 2 . . . . 11 GLU HB3 . 16157 1
85 . 1 1 11 11 GLU HG2 H 1 2.079 0.02 . 2 . . . . 11 GLU HG2 . 16157 1
86 . 1 1 11 11 GLU HG3 H 1 2.002 0.02 . 2 . . . . 11 GLU HG3 . 16157 1
87 . 1 1 11 11 GLU C C 13 172.004 0.05 . 1 . . . . 11 GLU C . 16157 1
88 . 1 1 11 11 GLU CA C 13 51.852 0.05 . 1 . . . . 11 GLU CA . 16157 1
89 . 1 1 11 11 GLU CB C 13 31.925 0.05 . 1 . . . . 11 GLU CB . 16157 1
90 . 1 1 11 11 GLU CG C 13 34.288 0.05 . 1 . . . . 11 GLU CG . 16157 1
91 . 1 1 11 11 GLU N N 15 124.099 0.05 . 1 . . . . 11 GLU N . 16157 1
92 . 1 1 12 12 TYR H H 1 7.843 0.02 . 1 . . . . 12 TYR H . 16157 1
93 . 1 1 12 12 TYR HA H 1 5.697 0.02 . 1 . . . . 12 TYR HA . 16157 1
94 . 1 1 12 12 TYR HB2 H 1 2.617 0.02 . 2 . . . . 12 TYR HB2 . 16157 1
95 . 1 1 12 12 TYR HB3 H 1 2.617 0.02 . 2 . . . . 12 TYR HB3 . 16157 1
96 . 1 1 12 12 TYR HD1 H 1 6.572 0.02 . 3 . . . . 12 TYR HD1 . 16157 1
97 . 1 1 12 12 TYR HD2 H 1 6.572 0.02 . 3 . . . . 12 TYR HD2 . 16157 1
98 . 1 1 12 12 TYR HE1 H 1 6.515 0.02 . 3 . . . . 12 TYR HE1 . 16157 1
99 . 1 1 12 12 TYR HE2 H 1 6.515 0.02 . 3 . . . . 12 TYR HE2 . 16157 1
100 . 1 1 12 12 TYR C C 13 172.281 0.05 . 1 . . . . 12 TYR C . 16157 1
101 . 1 1 12 12 TYR CA C 13 53.160 0.05 . 1 . . . . 12 TYR CA . 16157 1
102 . 1 1 12 12 TYR CB C 13 40.610 0.05 . 1 . . . . 12 TYR CB . 16157 1
103 . 1 1 12 12 TYR N N 15 115.283 0.05 . 1 . . . . 12 TYR N . 16157 1
104 . 1 1 13 13 PHE H H 1 9.057 0.02 . 1 . . . . 13 PHE H . 16157 1
105 . 1 1 13 13 PHE HA H 1 4.750 0.02 . 1 . . . . 13 PHE HA . 16157 1
106 . 1 1 13 13 PHE C C 13 170.766 0.05 . 1 . . . . 13 PHE C . 16157 1
107 . 1 1 13 13 PHE CA C 13 54.815 0.05 . 1 . . . . 13 PHE CA . 16157 1
108 . 1 1 13 13 PHE CB C 13 39.947 0.05 . 1 . . . . 13 PHE CB . 16157 1
109 . 1 1 13 13 PHE N N 15 119.347 0.05 . 1 . . . . 13 PHE N . 16157 1
110 . 1 1 14 14 GLN HA H 1 5.302 0.02 . 1 . . . . 14 GLN HA . 16157 1
111 . 1 1 14 14 GLN HB2 H 1 2.283 0.02 . 2 . . . . 14 GLN HB2 . 16157 1
112 . 1 1 14 14 GLN HB3 H 1 2.283 0.02 . 2 . . . . 14 GLN HB3 . 16157 1
113 . 1 1 14 14 GLN CA C 13 53.700 0.05 . 1 . . . . 14 GLN CA . 16157 1
114 . 1 1 14 14 GLN CB C 13 30.685 0.05 . 1 . . . . 14 GLN CB . 16157 1
115 . 1 1 15 15 SER H H 1 8.657 0.02 . 1 . . . . 15 SER H . 16157 1
116 . 1 1 15 15 SER HA H 1 4.715 0.02 . 1 . . . . 15 SER HA . 16157 1
117 . 1 1 15 15 SER C C 13 172.296 0.05 . 1 . . . . 15 SER C . 16157 1
118 . 1 1 15 15 SER CA C 13 54.708 0.05 . 1 . . . . 15 SER CA . 16157 1
119 . 1 1 15 15 SER CB C 13 64.456 0.05 . 1 . . . . 15 SER CB . 16157 1
120 . 1 1 15 15 SER N N 15 119.667 0.05 . 1 . . . . 15 SER N . 16157 1
121 . 1 1 17 17 ARG HA H 1 3.413 0.02 . 1 . . . . 17 ARG HA . 16157 1
122 . 1 1 17 17 ARG HB2 H 1 0.405 0.02 . 2 . . . . 17 ARG HB2 . 16157 1
123 . 1 1 17 17 ARG HB3 H 1 0.405 0.02 . 2 . . . . 17 ARG HB3 . 16157 1
124 . 1 1 17 17 ARG CA C 13 55.648 0.05 . 1 . . . . 17 ARG CA . 16157 1
125 . 1 1 17 17 ARG CB C 13 29.496 0.05 . 1 . . . . 17 ARG CB . 16157 1
126 . 1 1 18 18 TYR H H 1 6.870 0.02 . 1 . . . . 18 TYR H . 16157 1
127 . 1 1 18 18 TYR HA H 1 5.233 0.02 . 1 . . . . 18 TYR HA . 16157 1
128 . 1 1 18 18 TYR HB2 H 1 3.046 0.02 . 1 . . . . 18 TYR HB2 . 16157 1
129 . 1 1 18 18 TYR HB3 H 1 2.546 0.02 . 1 . . . . 18 TYR HB3 . 16157 1
130 . 1 1 18 18 TYR HD1 H 1 6.572 0.02 . 3 . . . . 18 TYR HD1 . 16157 1
131 . 1 1 18 18 TYR HD2 H 1 6.572 0.02 . 3 . . . . 18 TYR HD2 . 16157 1
132 . 1 1 18 18 TYR HE1 H 1 6.514 0.02 . 3 . . . . 18 TYR HE1 . 16157 1
133 . 1 1 18 18 TYR HE2 H 1 6.514 0.02 . 3 . . . . 18 TYR HE2 . 16157 1
134 . 1 1 18 18 TYR C C 13 174.107 0.05 . 1 . . . . 18 TYR C . 16157 1
135 . 1 1 18 18 TYR CA C 13 54.231 0.05 . 1 . . . . 18 TYR CA . 16157 1
136 . 1 1 18 18 TYR CB C 13 40.725 0.05 . 1 . . . . 18 TYR CB . 16157 1
137 . 1 1 18 18 TYR N N 15 114.525 0.05 . 1 . . . . 18 TYR N . 16157 1
138 . 1 1 19 19 THR H H 1 8.684 0.02 . 1 . . . . 19 THR H . 16157 1
139 . 1 1 19 19 THR HA H 1 5.061 0.02 . 1 . . . . 19 THR HA . 16157 1
140 . 1 1 19 19 THR HB H 1 3.876 0.02 . 1 . . . . 19 THR HB . 16157 1
141 . 1 1 19 19 THR HG21 H 1 0.999 0.02 . 2 . . . . 19 THR HG21 . 16157 1
142 . 1 1 19 19 THR HG22 H 1 0.999 0.02 . 2 . . . . 19 THR HG22 . 16157 1
143 . 1 1 19 19 THR HG23 H 1 0.999 0.02 . 2 . . . . 19 THR HG23 . 16157 1
144 . 1 1 19 19 THR C C 13 173.054 0.05 . 1 . . . . 19 THR C . 16157 1
145 . 1 1 19 19 THR CA C 13 60.704 0.05 . 1 . . . . 19 THR CA . 16157 1
146 . 1 1 19 19 THR CB C 13 67.997 0.05 . 1 . . . . 19 THR CB . 16157 1
147 . 1 1 19 19 THR CG2 C 13 19.499 0.05 . 1 . . . . 19 THR CG2 . 16157 1
148 . 1 1 19 19 THR N N 15 119.368 0.05 . 1 . . . . 19 THR N . 16157 1
149 . 1 1 20 20 ASP H H 1 8.975 0.02 . 1 . . . . 20 ASP H . 16157 1
150 . 1 1 20 20 ASP HA H 1 5.690 0.02 . 1 . . . . 20 ASP HA . 16157 1
151 . 1 1 20 20 ASP HB2 H 1 2.932 0.02 . 1 . . . . 20 ASP HB2 . 16157 1
152 . 1 1 20 20 ASP HB3 H 1 2.858 0.02 . 1 . . . . 20 ASP HB3 . 16157 1
153 . 1 1 20 20 ASP C C 13 171.832 0.05 . 1 . . . . 20 ASP C . 16157 1
154 . 1 1 20 20 ASP CA C 13 52.039 0.05 . 1 . . . . 20 ASP CA . 16157 1
155 . 1 1 20 20 ASP CB C 13 42.292 0.05 . 1 . . . . 20 ASP CB . 16157 1
156 . 1 1 20 20 ASP N N 15 128.307 0.05 . 1 . . . . 20 ASP N . 16157 1
157 . 1 1 21 21 VAL H H 1 9.496 0.02 . 1 . . . . 21 VAL H . 16157 1
158 . 1 1 21 21 VAL HA H 1 4.775 0.02 . 1 . . . . 21 VAL HA . 16157 1
159 . 1 1 21 21 VAL HB H 1 1.967 0.02 . 1 . . . . 21 VAL HB . 16157 1
160 . 1 1 21 21 VAL HG11 H 1 0.779 0.02 . 2 . . . . 21 VAL HG11 . 16157 1
161 . 1 1 21 21 VAL HG12 H 1 0.779 0.02 . 2 . . . . 21 VAL HG12 . 16157 1
162 . 1 1 21 21 VAL HG13 H 1 0.779 0.02 . 2 . . . . 21 VAL HG13 . 16157 1
163 . 1 1 21 21 VAL HG21 H 1 0.603 0.02 . 2 . . . . 21 VAL HG21 . 16157 1
164 . 1 1 21 21 VAL HG22 H 1 0.603 0.02 . 2 . . . . 21 VAL HG22 . 16157 1
165 . 1 1 21 21 VAL HG23 H 1 0.603 0.02 . 2 . . . . 21 VAL HG23 . 16157 1
166 . 1 1 21 21 VAL C C 13 173.611 0.05 . 1 . . . . 21 VAL C . 16157 1
167 . 1 1 21 21 VAL CA C 13 59.478 0.05 . 1 . . . . 21 VAL CA . 16157 1
168 . 1 1 21 21 VAL CB C 13 32.243 0.05 . 1 . . . . 21 VAL CB . 16157 1
169 . 1 1 21 21 VAL CG1 C 13 20.267 0.05 . 1 . . . . 21 VAL CG1 . 16157 1
170 . 1 1 21 21 VAL CG2 C 13 20.185 0.05 . 1 . . . . 21 VAL CG2 . 16157 1
171 . 1 1 21 21 VAL N N 15 123.356 0.05 . 1 . . . . 21 VAL N . 16157 1
172 . 1 1 22 22 HIS H H 1 8.973 0.02 . 1 . . . . 22 HIS H . 16157 1
173 . 1 1 22 22 HIS HA H 1 4.622 0.02 . 1 . . . . 22 HIS HA . 16157 1
174 . 1 1 22 22 HIS HB2 H 1 2.325 0.02 . 2 . . . . 22 HIS HB2 . 16157 1
175 . 1 1 22 22 HIS HB3 H 1 2.325 0.02 . 2 . . . . 22 HIS HB3 . 16157 1
176 . 1 1 22 22 HIS HD2 H 1 7.193 0.02 . 1 . . . . 22 HIS HD2 . 16157 1
177 . 1 1 22 22 HIS C C 13 171.626 0.05 . 1 . . . . 22 HIS C . 16157 1
178 . 1 1 22 22 HIS CA C 13 49.980 0.05 . 1 . . . . 22 HIS CA . 16157 1
179 . 1 1 22 22 HIS CB C 13 28.390 0.05 . 1 . . . . 22 HIS CB . 16157 1
180 . 1 1 22 22 HIS N N 15 124.534 0.05 . 1 . . . . 22 HIS N . 16157 1
181 . 1 1 23 23 ASN H H 1 8.317 0.02 . 1 . . . . 23 ASN H . 16157 1
182 . 1 1 23 23 ASN HA H 1 4.517 0.02 . 1 . . . . 23 ASN HA . 16157 1
183 . 1 1 23 23 ASN HB2 H 1 2.986 0.02 . 1 . . . . 23 ASN HB2 . 16157 1
184 . 1 1 23 23 ASN HB3 H 1 1.781 0.02 . 1 . . . . 23 ASN HB3 . 16157 1
185 . 1 1 23 23 ASN C C 13 171.836 0.05 . 1 . . . . 23 ASN C . 16157 1
186 . 1 1 23 23 ASN CA C 13 49.380 0.05 . 1 . . . . 23 ASN CA . 16157 1
187 . 1 1 23 23 ASN CB C 13 36.018 0.05 . 1 . . . . 23 ASN CB . 16157 1
188 . 1 1 23 23 ASN N N 15 123.095 0.05 . 1 . . . . 23 ASN N . 16157 1
189 . 1 1 24 24 GLY H H 1 7.602 0.02 . 1 . . . . 24 GLY H . 16157 1
190 . 1 1 24 24 GLY HA2 H 1 4.051 0.02 . 1 . . . . 24 GLY HA2 . 16157 1
191 . 1 1 24 24 GLY HA3 H 1 3.381 0.02 . 1 . . . . 24 GLY HA3 . 16157 1
192 . 1 1 24 24 GLY C C 13 171.684 0.05 . 1 . . . . 24 GLY C . 16157 1
193 . 1 1 24 24 GLY CA C 13 42.936 0.05 . 1 . . . . 24 GLY CA . 16157 1
194 . 1 1 24 24 GLY N N 15 113.217 0.05 . 1 . . . . 24 GLY N . 16157 1
195 . 1 1 25 25 CYS H H 1 8.145 0.02 . 1 . . . . 25 CYS H . 16157 1
196 . 1 1 25 25 CYS HA H 1 4.544 0.02 . 1 . . . . 25 CYS HA . 16157 1
197 . 1 1 25 25 CYS HB2 H 1 3.475 0.02 . 1 . . . . 25 CYS HB2 . 16157 1
198 . 1 1 25 25 CYS HB3 H 1 3.382 0.02 . 1 . . . . 25 CYS HB3 . 16157 1
199 . 1 1 25 25 CYS C C 13 172.305 0.05 . 1 . . . . 25 CYS C . 16157 1
200 . 1 1 25 25 CYS CA C 13 50.790 0.05 . 1 . . . . 25 CYS CA . 16157 1
201 . 1 1 25 25 CYS CB C 13 39.528 0.05 . 1 . . . . 25 CYS CB . 16157 1
202 . 1 1 25 25 CYS N N 15 119.843 0.05 . 1 . . . . 25 CYS N . 16157 1
203 . 1 1 26 26 ALA H H 1 8.111 0.02 . 1 . . . . 26 ALA H . 16157 1
204 . 1 1 26 26 ALA HA H 1 4.084 0.02 . 1 . . . . 26 ALA HA . 16157 1
205 . 1 1 26 26 ALA HB1 H 1 1.278 0.02 . 2 . . . . 26 ALA HB1 . 16157 1
206 . 1 1 26 26 ALA HB2 H 1 1.278 0.02 . 2 . . . . 26 ALA HB2 . 16157 1
207 . 1 1 26 26 ALA HB3 H 1 1.278 0.02 . 2 . . . . 26 ALA HB3 . 16157 1
208 . 1 1 26 26 ALA C C 13 172.481 0.05 . 1 . . . . 26 ALA C . 16157 1
209 . 1 1 26 26 ALA CA C 13 50.950 0.05 . 1 . . . . 26 ALA CA . 16157 1
210 . 1 1 26 26 ALA CB C 13 17.251 0.05 . 1 . . . . 26 ALA CB . 16157 1
211 . 1 1 26 26 ALA N N 15 119.852 0.05 . 1 . . . . 26 ALA N . 16157 1
212 . 1 1 27 27 ASP H H 1 6.938 0.02 . 1 . . . . 27 ASP H . 16157 1
213 . 1 1 27 27 ASP HA H 1 4.787 0.02 . 1 . . . . 27 ASP HA . 16157 1
214 . 1 1 27 27 ASP HB2 H 1 2.606 0.02 . 1 . . . . 27 ASP HB2 . 16157 1
215 . 1 1 27 27 ASP HB3 H 1 2.232 0.02 . 1 . . . . 27 ASP HB3 . 16157 1
216 . 1 1 27 27 ASP C C 13 174.263 0.05 . 1 . . . . 27 ASP C . 16157 1
217 . 1 1 27 27 ASP CA C 13 49.550 0.05 . 1 . . . . 27 ASP CA . 16157 1
218 . 1 1 27 27 ASP CB C 13 42.250 0.05 . 1 . . . . 27 ASP CB . 16157 1
219 . 1 1 27 27 ASP N N 15 113.761 0.05 . 1 . . . . 27 ASP N . 16157 1
220 . 1 1 28 28 ALA H H 1 8.454 0.02 . 1 . . . . 28 ALA H . 16157 1
221 . 1 1 28 28 ALA HA H 1 3.986 0.02 . 1 . . . . 28 ALA HA . 16157 1
222 . 1 1 28 28 ALA HB1 H 1 1.159 0.02 . 2 . . . . 28 ALA HB1 . 16157 1
223 . 1 1 28 28 ALA HB2 H 1 1.159 0.02 . 2 . . . . 28 ALA HB2 . 16157 1
224 . 1 1 28 28 ALA HB3 H 1 1.159 0.02 . 2 . . . . 28 ALA HB3 . 16157 1
225 . 1 1 28 28 ALA C C 13 173.188 0.05 . 1 . . . . 28 ALA C . 16157 1
226 . 1 1 28 28 ALA CA C 13 50.550 0.05 . 1 . . . . 28 ALA CA . 16157 1
227 . 1 1 28 28 ALA CB C 13 16.820 0.05 . 1 . . . . 28 ALA CB . 16157 1
228 . 1 1 28 28 ALA N N 15 121.635 0.05 . 1 . . . . 28 ALA N . 16157 1
229 . 1 1 29 29 VAL H H 1 7.742 0.02 . 1 . . . . 29 VAL H . 16157 1
230 . 1 1 29 29 VAL HA H 1 4.553 0.02 . 1 . . . . 29 VAL HA . 16157 1
231 . 1 1 29 29 VAL HB H 1 1.852 0.02 . 1 . . . . 29 VAL HB . 16157 1
232 . 1 1 29 29 VAL HG11 H 1 0.652 0.02 . 2 . . . . 29 VAL HG11 . 16157 1
233 . 1 1 29 29 VAL HG12 H 1 0.652 0.02 . 2 . . . . 29 VAL HG12 . 16157 1
234 . 1 1 29 29 VAL HG13 H 1 0.652 0.02 . 2 . . . . 29 VAL HG13 . 16157 1
235 . 1 1 29 29 VAL HG21 H 1 0.624 0.02 . 2 . . . . 29 VAL HG21 . 16157 1
236 . 1 1 29 29 VAL HG22 H 1 0.624 0.02 . 2 . . . . 29 VAL HG22 . 16157 1
237 . 1 1 29 29 VAL HG23 H 1 0.624 0.02 . 2 . . . . 29 VAL HG23 . 16157 1
238 . 1 1 29 29 VAL C C 13 174.826 0.05 . 1 . . . . 29 VAL C . 16157 1
239 . 1 1 29 29 VAL CA C 13 57.140 0.05 . 1 . . . . 29 VAL CA . 16157 1
240 . 1 1 29 29 VAL CB C 13 33.000 0.05 . 1 . . . . 29 VAL CB . 16157 1
241 . 1 1 29 29 VAL CG1 C 13 18.250 0.05 . 1 . . . . 29 VAL CG1 . 16157 1
242 . 1 1 29 29 VAL CG2 C 13 16.330 0.05 . 1 . . . . 29 VAL CG2 . 16157 1
243 . 1 1 29 29 VAL N N 15 113.732 0.05 . 1 . . . . 29 VAL N . 16157 1
244 . 1 1 30 30 SER H H 1 8.101 0.02 . 1 . . . . 30 SER H . 16157 1
245 . 1 1 30 30 SER HA H 1 5.338 0.02 . 1 . . . . 30 SER HA . 16157 1
246 . 1 1 30 30 SER HB2 H 1 3.768 0.02 . 1 . . . . 30 SER HB2 . 16157 1
247 . 1 1 30 30 SER HB3 H 1 3.556 0.02 . 1 . . . . 30 SER HB3 . 16157 1
248 . 1 1 30 30 SER C C 13 171.613 0.05 . 1 . . . . 30 SER C . 16157 1
249 . 1 1 30 30 SER CA C 13 54.310 0.05 . 1 . . . . 30 SER CA . 16157 1
250 . 1 1 30 30 SER CB C 13 62.237 0.05 . 1 . . . . 30 SER CB . 16157 1
251 . 1 1 30 30 SER N N 15 118.729 0.05 . 1 . . . . 30 SER N . 16157 1
252 . 1 1 31 31 VAL H H 1 8.780 0.02 . 1 . . . . 31 VAL H . 16157 1
253 . 1 1 31 31 VAL HA H 1 5.146 0.02 . 1 . . . . 31 VAL HA . 16157 1
254 . 1 1 31 31 VAL HB H 1 1.830 0.02 . 1 . . . . 31 VAL HB . 16157 1
255 . 1 1 31 31 VAL HG11 H 1 0.679 0.02 . 2 . . . . 31 VAL HG11 . 16157 1
256 . 1 1 31 31 VAL HG12 H 1 0.679 0.02 . 2 . . . . 31 VAL HG12 . 16157 1
257 . 1 1 31 31 VAL HG13 H 1 0.679 0.02 . 2 . . . . 31 VAL HG13 . 16157 1
258 . 1 1 31 31 VAL HG21 H 1 0.682 0.02 . 2 . . . . 31 VAL HG21 . 16157 1
259 . 1 1 31 31 VAL HG22 H 1 0.682 0.02 . 2 . . . . 31 VAL HG22 . 16157 1
260 . 1 1 31 31 VAL HG23 H 1 0.682 0.02 . 2 . . . . 31 VAL HG23 . 16157 1
261 . 1 1 31 31 VAL C C 13 172.831 0.05 . 1 . . . . 31 VAL C . 16157 1
262 . 1 1 31 31 VAL CA C 13 56.940 0.05 . 1 . . . . 31 VAL CA . 16157 1
263 . 1 1 31 31 VAL CB C 13 35.030 0.05 . 1 . . . . 31 VAL CB . 16157 1
264 . 1 1 31 31 VAL CG1 C 13 20.243 0.05 . 1 . . . . 31 VAL CG1 . 16157 1
265 . 1 1 31 31 VAL CG2 C 13 18.381 0.05 . 1 . . . . 31 VAL CG2 . 16157 1
266 . 1 1 31 31 VAL N N 15 119.018 0.05 . 1 . . . . 31 VAL N . 16157 1
267 . 1 1 32 32 THR H H 1 8.366 0.02 . 1 . . . . 32 THR H . 16157 1
268 . 1 1 32 32 THR HA H 1 4.498 0.02 . 1 . . . . 32 THR HA . 16157 1
269 . 1 1 32 32 THR HB H 1 4.057 0.02 . 1 . . . . 32 THR HB . 16157 1
270 . 1 1 32 32 THR HG21 H 1 1.155 0.02 . 2 . . . . 32 THR HG21 . 16157 1
271 . 1 1 32 32 THR HG22 H 1 1.155 0.02 . 2 . . . . 32 THR HG22 . 16157 1
272 . 1 1 32 32 THR HG23 H 1 1.155 0.02 . 2 . . . . 32 THR HG23 . 16157 1
273 . 1 1 32 32 THR C C 13 171.480 0.05 . 1 . . . . 32 THR C . 16157 1
274 . 1 1 32 32 THR CA C 13 57.100 0.05 . 1 . . . . 32 THR CA . 16157 1
275 . 1 1 32 32 THR CB C 13 67.767 0.05 . 1 . . . . 32 THR CB . 16157 1
276 . 1 1 32 32 THR CG2 C 13 19.440 0.05 . 1 . . . . 32 THR CG2 . 16157 1
277 . 1 1 32 32 THR N N 15 115.885 0.05 . 1 . . . . 32 THR N . 16157 1
278 . 1 1 33 33 VAL H H 1 6.720 0.02 . 1 . . . . 33 VAL H . 16157 1
279 . 1 1 33 33 VAL HA H 1 3.950 0.02 . 1 . . . . 33 VAL HA . 16157 1
280 . 1 1 33 33 VAL HB H 1 1.132 0.02 . 1 . . . . 33 VAL HB . 16157 1
281 . 1 1 33 33 VAL HG11 H 1 -0.216 0.02 . 2 . . . . 33 VAL HG11 . 16157 1
282 . 1 1 33 33 VAL HG12 H 1 -0.216 0.02 . 2 . . . . 33 VAL HG12 . 16157 1
283 . 1 1 33 33 VAL HG13 H 1 -0.216 0.02 . 2 . . . . 33 VAL HG13 . 16157 1
284 . 1 1 33 33 VAL HG21 H 1 -0.374 0.02 . 2 . . . . 33 VAL HG21 . 16157 1
285 . 1 1 33 33 VAL HG22 H 1 -0.374 0.02 . 2 . . . . 33 VAL HG22 . 16157 1
286 . 1 1 33 33 VAL HG23 H 1 -0.374 0.02 . 2 . . . . 33 VAL HG23 . 16157 1
287 . 1 1 33 33 VAL C C 13 169.808 0.05 . 1 . . . . 33 VAL C . 16157 1
288 . 1 1 33 33 VAL CA C 13 57.990 0.05 . 1 . . . . 33 VAL CA . 16157 1
289 . 1 1 33 33 VAL CB C 13 32.331 0.05 . 1 . . . . 33 VAL CB . 16157 1
290 . 1 1 33 33 VAL CG1 C 13 20.094 0.05 . 1 . . . . 33 VAL CG1 . 16157 1
291 . 1 1 33 33 VAL CG2 C 13 17.230 0.05 . 1 . . . . 33 VAL CG2 . 16157 1
292 . 1 1 33 33 VAL N N 15 119.716 0.05 . 1 . . . . 33 VAL N . 16157 1
293 . 1 1 34 34 GLU H H 1 7.670 0.02 . 1 . . . . 34 GLU H . 16157 1
294 . 1 1 34 34 GLU HA H 1 4.187 0.02 . 1 . . . . 34 GLU HA . 16157 1
295 . 1 1 34 34 GLU HB2 H 1 1.425 0.02 . 1 . . . . 34 GLU HB2 . 16157 1
296 . 1 1 34 34 GLU HB3 H 1 0.777 0.02 . 1 . . . . 34 GLU HB3 . 16157 1
297 . 1 1 34 34 GLU C C 13 171.032 0.05 . 1 . . . . 34 GLU C . 16157 1
298 . 1 1 34 34 GLU CA C 13 51.930 0.05 . 1 . . . . 34 GLU CA . 16157 1
299 . 1 1 34 34 GLU CB C 13 29.430 0.05 . 1 . . . . 34 GLU CB . 16157 1
300 . 1 1 34 34 GLU N N 15 123.182 0.05 . 1 . . . . 34 GLU N . 16157 1
301 . 1 1 35 35 TYR H H 1 8.500 0.02 . 1 . . . . 35 TYR H . 16157 1
302 . 1 1 35 35 TYR HA H 1 4.646 0.02 . 1 . . . . 35 TYR HA . 16157 1
303 . 1 1 35 35 TYR HB2 H 1 3.155 0.02 . 1 . . . . 35 TYR HB2 . 16157 1
304 . 1 1 35 35 TYR HB3 H 1 2.585 0.02 . 1 . . . . 35 TYR HB3 . 16157 1
305 . 1 1 35 35 TYR HD1 H 1 6.944 0.02 . 3 . . . . 35 TYR HD1 . 16157 1
306 . 1 1 35 35 TYR HD2 H 1 6.944 0.02 . 3 . . . . 35 TYR HD2 . 16157 1
307 . 1 1 35 35 TYR HE1 H 1 6.396 0.02 . 3 . . . . 35 TYR HE1 . 16157 1
308 . 1 1 35 35 TYR HE2 H 1 6.396 0.02 . 3 . . . . 35 TYR HE2 . 16157 1
309 . 1 1 35 35 TYR C C 13 172.817 0.05 . 1 . . . . 35 TYR C . 16157 1
310 . 1 1 35 35 TYR CA C 13 55.880 0.05 . 1 . . . . 35 TYR CA . 16157 1
311 . 1 1 35 35 TYR CB C 13 38.300 0.05 . 1 . . . . 35 TYR CB . 16157 1
312 . 1 1 35 35 TYR N N 15 122.953 0.05 . 1 . . . . 35 TYR N . 16157 1
313 . 1 1 36 36 THR H H 1 8.295 0.02 . 1 . . . . 36 THR H . 16157 1
314 . 1 1 36 36 THR HA H 1 3.731 0.02 . 1 . . . . 36 THR HA . 16157 1
315 . 1 1 36 36 THR HB H 1 4.069 0.02 . 1 . . . . 36 THR HB . 16157 1
316 . 1 1 36 36 THR HG21 H 1 1.004 0.02 . 2 . . . . 36 THR HG21 . 16157 1
317 . 1 1 36 36 THR HG22 H 1 1.004 0.02 . 2 . . . . 36 THR HG22 . 16157 1
318 . 1 1 36 36 THR HG23 H 1 1.004 0.02 . 2 . . . . 36 THR HG23 . 16157 1
319 . 1 1 36 36 THR C C 13 175.873 0.05 . 1 . . . . 36 THR C . 16157 1
320 . 1 1 36 36 THR CA C 13 65.169 0.05 . 1 . . . . 36 THR CA . 16157 1
321 . 1 1 36 36 THR CB C 13 67.700 0.05 . 1 . . . . 36 THR CB . 16157 1
322 . 1 1 36 36 THR CG2 C 13 18.710 0.05 . 1 . . . . 36 THR CG2 . 16157 1
323 . 1 1 36 36 THR N N 15 119.739 0.05 . 1 . . . . 36 THR N . 16157 1
324 . 1 1 37 37 HIS H H 1 8.755 0.02 . 1 . . . . 37 HIS H . 16157 1
325 . 1 1 37 37 HIS HA H 1 4.807 0.02 . 1 . . . . 37 HIS HA . 16157 1
326 . 1 1 37 37 HIS HB2 H 1 3.233 0.02 . 1 . . . . 37 HIS HB2 . 16157 1
327 . 1 1 37 37 HIS HB3 H 1 3.131 0.02 . 1 . . . . 37 HIS HB3 . 16157 1
328 . 1 1 37 37 HIS HD2 H 1 6.774 0.02 . 1 . . . . 37 HIS HD2 . 16157 1
329 . 1 1 37 37 HIS C C 13 173.381 0.05 . 1 . . . . 37 HIS C . 16157 1
330 . 1 1 37 37 HIS CA C 13 53.412 0.05 . 1 . . . . 37 HIS CA . 16157 1
331 . 1 1 37 37 HIS CB C 13 27.137 0.05 . 1 . . . . 37 HIS CB . 16157 1
332 . 1 1 37 37 HIS N N 15 115.916 0.05 . 1 . . . . 37 HIS N . 16157 1
333 . 1 1 38 38 GLY H H 1 7.856 0.02 . 1 . . . . 38 GLY H . 16157 1
334 . 1 1 38 38 GLY HA2 H 1 4.091 0.02 . 1 . . . . 38 GLY HA2 . 16157 1
335 . 1 1 38 38 GLY HA3 H 1 3.795 0.02 . 1 . . . . 38 GLY HA3 . 16157 1
336 . 1 1 38 38 GLY C C 13 174.479 0.05 . 1 . . . . 38 GLY C . 16157 1
337 . 1 1 38 38 GLY CA C 13 43.935 0.05 . 1 . . . . 38 GLY CA . 16157 1
338 . 1 1 38 38 GLY N N 15 106.387 0.05 . 1 . . . . 38 GLY N . 16157 1
339 . 1 1 39 39 GLN H H 1 8.096 0.02 . 1 . . . . 39 GLN H . 16157 1
340 . 1 1 39 39 GLN HA H 1 4.239 0.02 . 1 . . . . 39 GLN HA . 16157 1
341 . 1 1 39 39 GLN HB2 H 1 1.816 0.02 . 2 . . . . 39 GLN HB2 . 16157 1
342 . 1 1 39 39 GLN HB3 H 1 1.816 0.02 . 2 . . . . 39 GLN HB3 . 16157 1
343 . 1 1 39 39 GLN HG2 H 1 2.293 0.02 . 1 . . . . 39 GLN HG2 . 16157 1
344 . 1 1 39 39 GLN HG3 H 1 2.178 0.02 . 1 . . . . 39 GLN HG3 . 16157 1
345 . 1 1 39 39 GLN C C 13 171.748 0.05 . 1 . . . . 39 GLN C . 16157 1
346 . 1 1 39 39 GLN CA C 13 55.050 0.05 . 1 . . . . 39 GLN CA . 16157 1
347 . 1 1 39 39 GLN CB C 13 26.580 0.05 . 1 . . . . 39 GLN CB . 16157 1
348 . 1 1 39 39 GLN CG C 13 31.802 0.05 . 1 . . . . 39 GLN CG . 16157 1
349 . 1 1 39 39 GLN N N 15 119.846 0.05 . 1 . . . . 39 GLN N . 16157 1
350 . 1 1 40 40 TRP H H 1 8.286 0.02 . 1 . . . . 40 TRP H . 16157 1
351 . 1 1 40 40 TRP HA H 1 4.961 0.02 . 1 . . . . 40 TRP HA . 16157 1
352 . 1 1 40 40 TRP HB2 H 1 3.122 0.02 . 1 . . . . 40 TRP HB2 . 16157 1
353 . 1 1 40 40 TRP HB3 H 1 3.012 0.02 . 1 . . . . 40 TRP HB3 . 16157 1
354 . 1 1 40 40 TRP HD1 H 1 7.247 0.02 . 1 . . . . 40 TRP HD1 . 16157 1
355 . 1 1 40 40 TRP HE1 H 1 9.791 0.02 . 1 . . . . 40 TRP HE1 . 16157 1
356 . 1 1 40 40 TRP HE3 H 1 7.411 0.02 . 1 . . . . 40 TRP HE3 . 16157 1
357 . 1 1 40 40 TRP HZ2 H 1 7.176 0.02 . 1 . . . . 40 TRP HZ2 . 16157 1
358 . 1 1 40 40 TRP C C 13 172.966 0.05 . 1 . . . . 40 TRP C . 16157 1
359 . 1 1 40 40 TRP CA C 13 55.210 0.05 . 1 . . . . 40 TRP CA . 16157 1
360 . 1 1 40 40 TRP CB C 13 28.161 0.05 . 1 . . . . 40 TRP CB . 16157 1
361 . 1 1 40 40 TRP N N 15 121.182 0.05 . 1 . . . . 40 TRP N . 16157 1
362 . 1 1 40 40 TRP NE1 N 15 128.933 0.05 . 1 . . . . 40 TRP NE1 . 16157 1
363 . 1 1 41 41 ALA H H 1 7.947 0.02 . 1 . . . . 41 ALA H . 16157 1
364 . 1 1 41 41 ALA HA H 1 4.641 0.02 . 1 . . . . 41 ALA HA . 16157 1
365 . 1 1 41 41 ALA HB1 H 1 1.589 0.02 . 2 . . . . 41 ALA HB1 . 16157 1
366 . 1 1 41 41 ALA HB2 H 1 1.589 0.02 . 2 . . . . 41 ALA HB2 . 16157 1
367 . 1 1 41 41 ALA HB3 H 1 1.589 0.02 . 2 . . . . 41 ALA HB3 . 16157 1
368 . 1 1 41 41 ALA C C 13 174.070 0.05 . 1 . . . . 41 ALA C . 16157 1
369 . 1 1 41 41 ALA CA C 13 47.995 0.05 . 1 . . . . 41 ALA CA . 16157 1
370 . 1 1 41 41 ALA CB C 13 18.627 0.05 . 1 . . . . 41 ALA CB . 16157 1
371 . 1 1 41 41 ALA N N 15 126.752 0.05 . 1 . . . . 41 ALA N . 16157 1
372 . 1 1 42 42 PRO HA H 1 4.240 0.02 . 1 . . . . 42 PRO HA . 16157 1
373 . 1 1 42 42 PRO HB2 H 1 2.307 0.02 . 1 . . . . 42 PRO HB2 . 16157 1
374 . 1 1 42 42 PRO HB3 H 1 1.721 0.02 . 1 . . . . 42 PRO HB3 . 16157 1
375 . 1 1 42 42 PRO HD2 H 1 3.666 0.02 . 2 . . . . 42 PRO HD2 . 16157 1
376 . 1 1 42 42 PRO HD3 H 1 3.666 0.02 . 2 . . . . 42 PRO HD3 . 16157 1
377 . 1 1 42 42 PRO CA C 13 60.853 0.05 . 1 . . . . 42 PRO CA . 16157 1
378 . 1 1 42 42 PRO CB C 13 30.203 0.05 . 1 . . . . 42 PRO CB . 16157 1
379 . 1 1 43 43 CYS H H 1 8.229 0.02 . 1 . . . . 43 CYS H . 16157 1
380 . 1 1 43 43 CYS HA H 1 4.643 0.02 . 1 . . . . 43 CYS HA . 16157 1
381 . 1 1 43 43 CYS HB2 H 1 2.945 0.02 . 1 . . . . 43 CYS HB2 . 16157 1
382 . 1 1 43 43 CYS HB3 H 1 2.726 0.02 . 1 . . . . 43 CYS HB3 . 16157 1
383 . 1 1 43 43 CYS C C 13 173.099 0.05 . 1 . . . . 43 CYS C . 16157 1
384 . 1 1 43 43 CYS CA C 13 53.574 0.05 . 1 . . . . 43 CYS CA . 16157 1
385 . 1 1 43 43 CYS CB C 13 39.464 0.05 . 1 . . . . 43 CYS CB . 16157 1
386 . 1 1 43 43 CYS N N 15 119.646 0.05 . 1 . . . . 43 CYS N . 16157 1
387 . 1 1 44 44 ARG H H 1 8.931 0.02 . 1 . . . . 44 ARG H . 16157 1
388 . 1 1 44 44 ARG HA H 1 4.653 0.02 . 1 . . . . 44 ARG HA . 16157 1
389 . 1 1 44 44 ARG HB2 H 1 1.646 0.02 . 2 . . . . 44 ARG HB2 . 16157 1
390 . 1 1 44 44 ARG HB3 H 1 1.646 0.02 . 2 . . . . 44 ARG HB3 . 16157 1
391 . 1 1 44 44 ARG HD2 H 1 2.916 0.02 . 1 . . . . 44 ARG HD2 . 16157 1
392 . 1 1 44 44 ARG HD3 H 1 2.811 0.02 . 1 . . . . 44 ARG HD3 . 16157 1
393 . 1 1 44 44 ARG HG2 H 1 1.407 0.02 . 1 . . . . 44 ARG HG2 . 16157 1
394 . 1 1 44 44 ARG HG3 H 1 1.346 0.02 . 1 . . . . 44 ARG HG3 . 16157 1
395 . 1 1 44 44 ARG C C 13 172.821 0.05 . 1 . . . . 44 ARG C . 16157 1
396 . 1 1 44 44 ARG CA C 13 51.850 0.05 . 1 . . . . 44 ARG CA . 16157 1
397 . 1 1 44 44 ARG CB C 13 30.892 0.05 . 1 . . . . 44 ARG CB . 16157 1
398 . 1 1 44 44 ARG CD C 13 40.528 0.05 . 1 . . . . 44 ARG CD . 16157 1
399 . 1 1 44 44 ARG CG C 13 24.943 0.05 . 1 . . . . 44 ARG CG . 16157 1
400 . 1 1 44 44 ARG N N 15 128.546 0.05 . 1 . . . . 44 ARG N . 16157 1
401 . 1 1 45 45 VAL H H 1 8.242 0.02 . 1 . . . . 45 VAL H . 16157 1
402 . 1 1 45 45 VAL HA H 1 4.625 0.02 . 1 . . . . 45 VAL HA . 16157 1
403 . 1 1 45 45 VAL HB H 1 1.842 0.02 . 1 . . . . 45 VAL HB . 16157 1
404 . 1 1 45 45 VAL HG11 H 1 0.866 0.02 . 2 . . . . 45 VAL HG11 . 16157 1
405 . 1 1 45 45 VAL HG12 H 1 0.866 0.02 . 2 . . . . 45 VAL HG12 . 16157 1
406 . 1 1 45 45 VAL HG13 H 1 0.866 0.02 . 2 . . . . 45 VAL HG13 . 16157 1
407 . 1 1 45 45 VAL HG21 H 1 0.690 0.02 . 2 . . . . 45 VAL HG21 . 16157 1
408 . 1 1 45 45 VAL HG22 H 1 0.690 0.02 . 2 . . . . 45 VAL HG22 . 16157 1
409 . 1 1 45 45 VAL HG23 H 1 0.690 0.02 . 2 . . . . 45 VAL HG23 . 16157 1
410 . 1 1 45 45 VAL C C 13 172.339 0.05 . 1 . . . . 45 VAL C . 16157 1
411 . 1 1 45 45 VAL CA C 13 59.800 0.05 . 1 . . . . 45 VAL CA . 16157 1
412 . 1 1 45 45 VAL CB C 13 29.914 0.05 . 1 . . . . 45 VAL CB . 16157 1
413 . 1 1 45 45 VAL CG1 C 13 19.280 0.05 . 1 . . . . 45 VAL CG1 . 16157 1
414 . 1 1 45 45 VAL CG2 C 13 18.755 0.05 . 1 . . . . 45 VAL CG2 . 16157 1
415 . 1 1 45 45 VAL N N 15 123.347 0.05 . 1 . . . . 45 VAL N . 16157 1
416 . 1 1 46 46 ILE H H 1 9.161 0.02 . 1 . . . . 46 ILE H . 16157 1
417 . 1 1 46 46 ILE HA H 1 4.241 0.02 . 1 . . . . 46 ILE HA . 16157 1
418 . 1 1 46 46 ILE HB H 1 1.414 0.02 . 1 . . . . 46 ILE HB . 16157 1
419 . 1 1 46 46 ILE HD11 H 1 0.536 0.02 . 2 . . . . 46 ILE HD11 . 16157 1
420 . 1 1 46 46 ILE HD12 H 1 0.536 0.02 . 2 . . . . 46 ILE HD12 . 16157 1
421 . 1 1 46 46 ILE HD13 H 1 0.536 0.02 . 2 . . . . 46 ILE HD13 . 16157 1
422 . 1 1 46 46 ILE HG12 H 1 0.621 0.02 . 2 . . . . 46 ILE HG12 . 16157 1
423 . 1 1 46 46 ILE HG13 H 1 0.621 0.02 . 2 . . . . 46 ILE HG13 . 16157 1
424 . 1 1 46 46 ILE HG21 H 1 0.815 0.02 . 2 . . . . 46 ILE HG21 . 16157 1
425 . 1 1 46 46 ILE HG22 H 1 0.815 0.02 . 2 . . . . 46 ILE HG22 . 16157 1
426 . 1 1 46 46 ILE HG23 H 1 0.815 0.02 . 2 . . . . 46 ILE HG23 . 16157 1
427 . 1 1 46 46 ILE C C 13 174.656 0.05 . 1 . . . . 46 ILE C . 16157 1
428 . 1 1 46 46 ILE CA C 13 58.660 0.05 . 1 . . . . 46 ILE CA . 16157 1
429 . 1 1 46 46 ILE CB C 13 37.551 0.05 . 1 . . . . 46 ILE CB . 16157 1
430 . 1 1 46 46 ILE CD1 C 13 13.700 0.05 . 1 . . . . 46 ILE CD1 . 16157 1
431 . 1 1 46 46 ILE CG1 C 13 16.330 0.05 . 1 . . . . 46 ILE CG2 . 16157 1
432 . 1 1 46 46 ILE N N 15 128.086 0.05 . 1 . . . . 46 ILE N . 16157 1
433 . 1 1 47 47 GLU H H 1 9.214 0.02 . 1 . . . . 47 GLU H . 16157 1
434 . 1 1 47 47 GLU HA H 1 4.182 0.02 . 1 . . . . 47 GLU HA . 16157 1
435 . 1 1 47 47 GLU HB2 H 1 2.055 0.02 . 1 . . . . 47 GLU HB2 . 16157 1
436 . 1 1 47 47 GLU HB3 H 1 1.860 0.02 . 1 . . . . 47 GLU HB3 . 16157 1
437 . 1 1 47 47 GLU HG2 H 1 2.279 0.02 . 1 . . . . 47 GLU HG2 . 16157 1
438 . 1 1 47 47 GLU HG3 H 1 2.177 0.02 . 1 . . . . 47 GLU HG3 . 16157 1
439 . 1 1 47 47 GLU C C 13 174.413 0.05 . 1 . . . . 47 GLU C . 16157 1
440 . 1 1 47 47 GLU CA C 13 53.820 0.05 . 1 . . . . 47 GLU CA . 16157 1
441 . 1 1 47 47 GLU CB C 13 25.600 0.05 . 1 . . . . 47 GLU CB . 16157 1
442 . 1 1 47 47 GLU CG C 13 33.683 0.05 . 1 . . . . 47 GLU CG . 16157 1
443 . 1 1 47 47 GLU N N 15 129.614 0.05 . 1 . . . . 47 GLU N . 16157 1
444 . 1 1 48 48 PRO HA H 1 3.872 0.02 . 1 . . . . 48 PRO HA . 16157 1
445 . 1 1 48 48 PRO HB2 H 1 1.702 0.02 . 1 . . . . 48 PRO HB2 . 16157 1
446 . 1 1 48 48 PRO HB3 H 1 1.960 0.02 . 1 . . . . 48 PRO HB3 . 16157 1
447 . 1 1 48 48 PRO HD2 H 1 3.646 0.02 . 1 . . . . 48 PRO HD2 . 16157 1
448 . 1 1 48 48 PRO HD3 H 1 3.264 0.02 . 1 . . . . 48 PRO HD3 . 16157 1
449 . 1 1 48 48 PRO HG2 H 1 1.992 0.02 . 1 . . . . 48 PRO HG2 . 16157 1
450 . 1 1 48 48 PRO HG3 H 1 1.395 0.02 . 1 . . . . 48 PRO HG3 . 16157 1
451 . 1 1 48 48 PRO CA C 13 62.770 0.05 . 1 . . . . 48 PRO CA . 16157 1
452 . 1 1 48 48 PRO CB C 13 29.241 0.05 . 1 . . . . 48 PRO CB . 16157 1
453 . 1 1 48 48 PRO CD C 13 48.241 0.05 . 1 . . . . 48 PRO CD . 16157 1
454 . 1 1 48 48 PRO CG C 13 26.171 0.05 . 1 . . . . 48 PRO CG . 16157 1
455 . 1 1 49 49 GLY H H 1 8.330 0.02 . 1 . . . . 49 GLY H . 16157 1
456 . 1 1 49 49 GLY HA2 H 1 4.140 0.02 . 1 . . . . 49 GLY HA2 . 16157 1
457 . 1 1 49 49 GLY HA3 H 1 3.702 0.02 . 1 . . . . 49 GLY HA3 . 16157 1
458 . 1 1 49 49 GLY C C 13 176.101 0.05 . 1 . . . . 49 GLY C . 16157 1
459 . 1 1 49 49 GLY CA C 13 43.930 0.05 . 1 . . . . 49 GLY CA . 16157 1
460 . 1 1 49 49 GLY N N 15 115.617 0.05 . 1 . . . . 49 GLY N . 16157 1
461 . 1 1 50 50 GLY H H 1 8.496 0.02 . 1 . . . . 50 GLY H . 16157 1
462 . 1 1 50 50 GLY HA2 H 1 4.374 0.02 . 1 . . . . 50 GLY HA2 . 16157 1
463 . 1 1 50 50 GLY HA3 H 1 3.614 0.02 . 1 . . . . 50 GLY HA3 . 16157 1
464 . 1 1 50 50 GLY C C 13 172.758 0.05 . 1 . . . . 50 GLY C . 16157 1
465 . 1 1 50 50 GLY CA C 13 42.550 0.05 . 1 . . . . 50 GLY CA . 16157 1
466 . 1 1 50 50 GLY N N 15 108.129 0.05 . 1 . . . . 50 GLY N . 16157 1
467 . 1 1 51 51 TRP H H 1 8.184 0.02 . 1 . . . . 51 TRP H . 16157 1
468 . 1 1 51 51 TRP HA H 1 5.778 0.02 . 1 . . . . 51 TRP HA . 16157 1
469 . 1 1 51 51 TRP HB2 H 1 3.129 0.02 . 1 . . . . 51 TRP HB2 . 16157 1
470 . 1 1 51 51 TRP HB3 H 1 2.662 0.02 . 1 . . . . 51 TRP HB3 . 16157 1
471 . 1 1 51 51 TRP HD1 H 1 7.183 0.02 . 1 . . . . 51 TRP HD1 . 16157 1
472 . 1 1 51 51 TRP HE1 H 1 9.856 0.02 . 1 . . . . 51 TRP HE1 . 16157 1
473 . 1 1 51 51 TRP HE3 H 1 7.369 0.02 . 1 . . . . 51 TRP HE3 . 16157 1
474 . 1 1 51 51 TRP HZ2 H 1 6.829 0.02 . 1 . . . . 51 TRP HZ2 . 16157 1
475 . 1 1 51 51 TRP C C 13 170.134 0.05 . 1 . . . . 51 TRP C . 16157 1
476 . 1 1 51 51 TRP CA C 13 53.820 0.05 . 1 . . . . 51 TRP CA . 16157 1
477 . 1 1 51 51 TRP CB C 13 30.930 0.05 . 1 . . . . 51 TRP CB . 16157 1
478 . 1 1 51 51 TRP N N 15 117.328 0.05 . 1 . . . . 51 TRP N . 16157 1
479 . 1 1 51 51 TRP NE1 N 15 129.871 0.05 . 1 . . . . 51 TRP NE1 . 16157 1
480 . 1 1 52 52 ALA H H 1 9.354 0.02 . 1 . . . . 52 ALA H . 16157 1
481 . 1 1 52 52 ALA HA H 1 4.654 0.02 . 1 . . . . 52 ALA HA . 16157 1
482 . 1 1 52 52 ALA HB1 H 1 1.142 0.02 . 2 . . . . 52 ALA HB1 . 16157 1
483 . 1 1 52 52 ALA HB2 H 1 1.142 0.02 . 2 . . . . 52 ALA HB2 . 16157 1
484 . 1 1 52 52 ALA HB3 H 1 1.142 0.02 . 2 . . . . 52 ALA HB3 . 16157 1
485 . 1 1 52 52 ALA C C 13 174.350 0.05 . 1 . . . . 52 ALA C . 16157 1
486 . 1 1 52 52 ALA CA C 13 49.250 0.05 . 1 . . . . 52 ALA CA . 16157 1
487 . 1 1 52 52 ALA CB C 13 20.971 0.05 . 1 . . . . 52 ALA CB . 16157 1
488 . 1 1 52 52 ALA N N 15 122.785 0.05 . 1 . . . . 52 ALA N . 16157 1
489 . 1 1 53 53 THR H H 1 8.059 0.02 . 1 . . . . 53 THR H . 16157 1
490 . 1 1 53 53 THR HA H 1 5.251 0.02 . 1 . . . . 53 THR HA . 16157 1
491 . 1 1 53 53 THR HB H 1 3.622 0.02 . 1 . . . . 53 THR HB . 16157 1
492 . 1 1 53 53 THR HG21 H 1 1.036 0.02 . 2 . . . . 53 THR HG21 . 16157 1
493 . 1 1 53 53 THR HG22 H 1 1.036 0.02 . 2 . . . . 53 THR HG22 . 16157 1
494 . 1 1 53 53 THR HG23 H 1 1.036 0.02 . 2 . . . . 53 THR HG23 . 16157 1
495 . 1 1 53 53 THR C C 13 173.703 0.05 . 1 . . . . 53 THR C . 16157 1
496 . 1 1 53 53 THR CA C 13 60.321 0.05 . 1 . . . . 53 THR CA . 16157 1
497 . 1 1 53 53 THR CB C 13 69.150 0.05 . 1 . . . . 53 THR CB . 16157 1
498 . 1 1 53 53 THR CG2 C 13 20.839 0.05 . 1 . . . . 53 THR CG2 . 16157 1
499 . 1 1 53 53 THR N N 15 115.813 0.05 . 1 . . . . 53 THR N . 16157 1
500 . 1 1 54 54 PHE H H 1 9.370 0.02 . 1 . . . . 54 PHE H . 16157 1
501 . 1 1 54 54 PHE HA H 1 4.827 0.02 . 1 . . . . 54 PHE HA . 16157 1
502 . 1 1 54 54 PHE HB2 H 1 2.617 0.02 . 1 . . . . 54 PHE HB2 . 16157 1
503 . 1 1 54 54 PHE HB3 H 1 3.517 0.02 . 1 . . . . 54 PHE HB3 . 16157 1
504 . 1 1 54 54 PHE HD1 H 1 7.168 0.02 . 3 . . . . 54 PHE HD1 . 16157 1
505 . 1 1 54 54 PHE HD2 H 1 7.168 0.02 . 3 . . . . 54 PHE HD2 . 16157 1
506 . 1 1 54 54 PHE HE1 H 1 7.204 0.02 . 3 . . . . 54 PHE HE1 . 16157 1
507 . 1 1 54 54 PHE HE2 H 1 7.204 0.02 . 3 . . . . 54 PHE HE2 . 16157 1
508 . 1 1 54 54 PHE C C 13 171.593 0.05 . 1 . . . . 54 PHE C . 16157 1
509 . 1 1 54 54 PHE CA C 13 53.813 0.05 . 1 . . . . 54 PHE CA . 16157 1
510 . 1 1 54 54 PHE CB C 13 40.556 0.05 . 1 . . . . 54 PHE CB . 16157 1
511 . 1 1 54 54 PHE N N 15 125.684 0.05 . 1 . . . . 54 PHE N . 16157 1
512 . 1 1 55 55 ALA H H 1 8.706 0.02 . 1 . . . . 55 ALA H . 16157 1
513 . 1 1 55 55 ALA HA H 1 4.362 0.02 . 1 . . . . 55 ALA HA . 16157 1
514 . 1 1 55 55 ALA HB1 H 1 1.387 0.02 . 2 . . . . 55 ALA HB1 . 16157 1
515 . 1 1 55 55 ALA HB2 H 1 1.387 0.02 . 2 . . . . 55 ALA HB2 . 16157 1
516 . 1 1 55 55 ALA HB3 H 1 1.387 0.02 . 2 . . . . 55 ALA HB3 . 16157 1
517 . 1 1 55 55 ALA C C 13 173.468 0.05 . 1 . . . . 55 ALA C . 16157 1
518 . 1 1 55 55 ALA CA C 13 52.010 0.05 . 1 . . . . 55 ALA CA . 16157 1
519 . 1 1 55 55 ALA CB C 13 16.740 0.05 . 1 . . . . 55 ALA CB . 16157 1
520 . 1 1 55 55 ALA N N 15 124.175 0.05 . 1 . . . . 55 ALA N . 16157 1
521 . 1 1 56 56 GLY H H 1 7.517 0.02 . 1 . . . . 56 GLY H . 16157 1
522 . 1 1 56 56 GLY HA2 H 1 4.252 0.02 . 1 . . . . 56 GLY HA2 . 16157 1
523 . 1 1 56 56 GLY HA3 H 1 3.339 0.02 . 1 . . . . 56 GLY HA3 . 16157 1
524 . 1 1 56 56 GLY C C 13 178.583 0.05 . 1 . . . . 56 GLY C . 16157 1
525 . 1 1 56 56 GLY CA C 13 42.282 0.05 . 1 . . . . 56 GLY CA . 16157 1
526 . 1 1 56 56 GLY N N 15 110.256 0.05 . 1 . . . . 56 GLY N . 16157 1
527 . 1 1 57 57 TYR H H 1 7.154 0.02 . 1 . . . . 57 TYR H . 16157 1
528 . 1 1 57 57 TYR HA H 1 4.516 0.02 . 1 . . . . 57 TYR HA . 16157 1
529 . 1 1 57 57 TYR HB2 H 1 2.497 0.02 . 1 . . . . 57 TYR HB2 . 16157 1
530 . 1 1 57 57 TYR HB3 H 1 2.404 0.02 . 1 . . . . 57 TYR HB3 . 16157 1
531 . 1 1 57 57 TYR HD1 H 1 7.058 0.02 . 3 . . . . 57 TYR HD1 . 16157 1
532 . 1 1 57 57 TYR HD2 H 1 7.058 0.02 . 3 . . . . 57 TYR HD2 . 16157 1
533 . 1 1 57 57 TYR HE1 H 1 6.729 0.02 . 3 . . . . 57 TYR HE1 . 16157 1
534 . 1 1 57 57 TYR HE2 H 1 6.729 0.02 . 3 . . . . 57 TYR HE2 . 16157 1
535 . 1 1 57 57 TYR C C 13 170.587 0.05 . 1 . . . . 57 TYR C . 16157 1
536 . 1 1 57 57 TYR CA C 13 55.130 0.05 . 1 . . . . 57 TYR CA . 16157 1
537 . 1 1 57 57 TYR CB C 13 36.127 0.05 . 1 . . . . 57 TYR CB . 16157 1
538 . 1 1 57 57 TYR N N 15 113.618 0.05 . 1 . . . . 57 TYR N . 16157 1
539 . 1 1 58 58 GLY H H 1 8.498 0.02 . 1 . . . . 58 GLY H . 16157 1
540 . 1 1 58 58 GLY HA2 H 1 3.946 0.02 . 1 . . . . 58 GLY HA2 . 16157 1
541 . 1 1 58 58 GLY HA3 H 1 3.420 0.02 . 1 . . . . 58 GLY HA3 . 16157 1
542 . 1 1 58 58 GLY C C 13 175.193 0.05 . 1 . . . . 58 GLY C . 16157 1
543 . 1 1 58 58 GLY CA C 13 43.806 0.05 . 1 . . . . 58 GLY CA . 16157 1
544 . 1 1 58 58 GLY N N 15 109.549 0.05 . 1 . . . . 58 GLY N . 16157 1
545 . 1 1 59 59 THR H H 1 8.301 0.02 . 1 . . . . 59 THR H . 16157 1
546 . 1 1 59 59 THR HA H 1 4.277 0.02 . 1 . . . . 59 THR HA . 16157 1
547 . 1 1 59 59 THR C C 13 172.318 0.05 . 1 . . . . 59 THR C . 16157 1
548 . 1 1 59 59 THR CA C 13 60.637 0.05 . 1 . . . . 59 THR CA . 16157 1
549 . 1 1 59 59 THR CB C 13 67.412 0.05 . 1 . . . . 59 THR CB . 16157 1
550 . 1 1 59 59 THR N N 15 111.031 0.05 . 1 . . . . 59 THR N . 16157 1
551 . 1 1 60 60 ASP H H 1 8.414 0.02 . 1 . . . . 60 ASP H . 16157 1
552 . 1 1 60 60 ASP HA H 1 4.679 0.02 . 1 . . . . 60 ASP HA . 16157 1
553 . 1 1 60 60 ASP HB2 H 1 2.697 0.02 . 1 . . . . 60 ASP HB2 . 16157 1
554 . 1 1 60 60 ASP HB3 H 1 2.499 0.02 . 1 . . . . 60 ASP HB3 . 16157 1
555 . 1 1 60 60 ASP C C 13 173.345 0.05 . 1 . . . . 60 ASP C . 16157 1
556 . 1 1 60 60 ASP CA C 13 51.030 0.05 . 1 . . . . 60 ASP CA . 16157 1
557 . 1 1 60 60 ASP CB C 13 38.608 0.05 . 1 . . . . 60 ASP CB . 16157 1
558 . 1 1 60 60 ASP N N 15 120.007 0.05 . 1 . . . . 60 ASP N . 16157 1
559 . 1 1 61 61 GLY H H 1 7.967 0.02 . 1 . . . . 61 GLY H . 16157 1
560 . 1 1 61 61 GLY HA2 H 1 3.550 0.02 . 1 . . . . 61 GLY HA2 . 16157 1
561 . 1 1 61 61 GLY HA3 H 1 2.879 0.02 . 1 . . . . 61 GLY HA3 . 16157 1
562 . 1 1 61 61 GLY C C 13 175.339 0.05 . 1 . . . . 61 GLY C . 16157 1
563 . 1 1 61 61 GLY CA C 13 44.956 0.05 . 1 . . . . 61 GLY CA . 16157 1
564 . 1 1 61 61 GLY N N 15 108.692 0.05 . 1 . . . . 61 GLY N . 16157 1
565 . 1 1 62 62 ASN H H 1 8.507 0.02 . 1 . . . . 62 ASN H . 16157 1
566 . 1 1 62 62 ASN HA H 1 4.455 0.02 . 1 . . . . 62 ASN HA . 16157 1
567 . 1 1 62 62 ASN HB2 H 1 2.971 0.02 . 1 . . . . 62 ASN HB2 . 16157 1
568 . 1 1 62 62 ASN HB3 H 1 2.358 0.02 . 1 . . . . 62 ASN HB3 . 16157 1
569 . 1 1 62 62 ASN HD21 H 1 6.962 0.02 . 1 . . . . 62 ASN HD21 . 16157 1
570 . 1 1 62 62 ASN HD22 H 1 6.465 0.02 . 1 . . . . 62 ASN HD22 . 16157 1
571 . 1 1 62 62 ASN C C 13 172.217 0.05 . 1 . . . . 62 ASN C . 16157 1
572 . 1 1 62 62 ASN CA C 13 48.627 0.05 . 1 . . . . 62 ASN CA . 16157 1
573 . 1 1 62 62 ASN CB C 13 34.339 0.05 . 1 . . . . 62 ASN CB . 16157 1
574 . 1 1 62 62 ASN N N 15 120.625 0.05 . 1 . . . . 62 ASN N . 16157 1
575 . 1 1 62 62 ASN ND2 N 15 108.526 0.05 . 1 . . . . 62 ASN ND2 . 16157 1
576 . 1 1 63 63 TYR H H 1 6.994 0.02 . 1 . . . . 63 TYR H . 16157 1
577 . 1 1 63 63 TYR HA H 1 4.477 0.02 . 1 . . . . 63 TYR HA . 16157 1
578 . 1 1 63 63 TYR HB2 H 1 3.041 0.02 . 1 . . . . 63 TYR HB2 . 16157 1
579 . 1 1 63 63 TYR HB3 H 1 2.366 0.02 . 1 . . . . 63 TYR HB3 . 16157 1
580 . 1 1 63 63 TYR C C 13 172.042 0.05 . 1 . . . . 63 TYR C . 16157 1
581 . 1 1 63 63 TYR CA C 13 56.210 0.05 . 1 . . . . 63 TYR CA . 16157 1
582 . 1 1 63 63 TYR CB C 13 36.755 0.05 . 1 . . . . 63 TYR CB . 16157 1
583 . 1 1 63 63 TYR N N 15 116.333 0.05 . 1 . . . . 63 TYR N . 16157 1
584 . 1 1 64 64 VAL H H 1 8.841 0.02 . 1 . . . . 64 VAL H . 16157 1
585 . 1 1 64 64 VAL HA H 1 3.689 0.02 . 1 . . . . 64 VAL HA . 16157 1
586 . 1 1 64 64 VAL HB H 1 1.572 0.02 . 1 . . . . 64 VAL HB . 16157 1
587 . 1 1 64 64 VAL HG11 H 1 0.539 0.02 . 2 . . . . 64 VAL HG11 . 16157 1
588 . 1 1 64 64 VAL HG12 H 1 0.539 0.02 . 2 . . . . 64 VAL HG12 . 16157 1
589 . 1 1 64 64 VAL HG13 H 1 0.539 0.02 . 2 . . . . 64 VAL HG13 . 16157 1
590 . 1 1 64 64 VAL HG21 H 1 0.120 0.02 . 2 . . . . 64 VAL HG21 . 16157 1
591 . 1 1 64 64 VAL HG22 H 1 0.120 0.02 . 2 . . . . 64 VAL HG22 . 16157 1
592 . 1 1 64 64 VAL HG23 H 1 0.120 0.02 . 2 . . . . 64 VAL HG23 . 16157 1
593 . 1 1 64 64 VAL C C 13 175.531 0.05 . 1 . . . . 64 VAL C . 16157 1
594 . 1 1 64 64 VAL CA C 13 61.550 0.05 . 1 . . . . 64 VAL CA . 16157 1
595 . 1 1 64 64 VAL CB C 13 30.583 0.05 . 1 . . . . 64 VAL CB . 16157 1
596 . 1 1 64 64 VAL CG1 C 13 21.285 0.05 . 1 . . . . 64 VAL CG1 . 16157 1
597 . 1 1 64 64 VAL CG2 C 13 19.200 0.05 . 1 . . . . 64 VAL CG2 . 16157 1
598 . 1 1 64 64 VAL N N 15 123.889 0.05 . 1 . . . . 64 VAL N . 16157 1
599 . 1 1 65 65 THR H H 1 8.850 0.02 . 1 . . . . 65 THR H . 16157 1
600 . 1 1 65 65 THR HA H 1 4.210 0.02 . 1 . . . . 65 THR HA . 16157 1
601 . 1 1 65 65 THR HB H 1 3.931 0.02 . 1 . . . . 65 THR HB . 16157 1
602 . 1 1 65 65 THR HG21 H 1 0.930 0.02 . 2 . . . . 65 THR HG21 . 16157 1
603 . 1 1 65 65 THR HG22 H 1 0.930 0.02 . 2 . . . . 65 THR HG22 . 16157 1
604 . 1 1 65 65 THR HG23 H 1 0.930 0.02 . 2 . . . . 65 THR HG23 . 16157 1
605 . 1 1 65 65 THR C C 13 175.388 0.05 . 1 . . . . 65 THR C . 16157 1
606 . 1 1 65 65 THR CA C 13 60.109 0.05 . 1 . . . . 65 THR CA . 16157 1
607 . 1 1 65 65 THR CB C 13 66.710 0.05 . 1 . . . . 65 THR CB . 16157 1
608 . 1 1 65 65 THR CG2 C 13 20.020 0.05 . 1 . . . . 65 THR CG2 . 16157 1
609 . 1 1 65 65 THR N N 15 119.739 0.05 . 1 . . . . 65 THR N . 16157 1
610 . 1 1 66 66 GLY H H 1 6.907 0.02 . 1 . . . . 66 GLY H . 16157 1
611 . 1 1 66 66 GLY HA2 H 1 3.769 0.02 . 1 . . . . 66 GLY HA2 . 16157 1
612 . 1 1 66 66 GLY HA3 H 1 3.583 0.02 . 1 . . . . 66 GLY HA3 . 16157 1
613 . 1 1 66 66 GLY C C 13 173.131 0.05 . 1 . . . . 66 GLY C . 16157 1
614 . 1 1 66 66 GLY CA C 13 42.950 0.05 . 1 . . . . 66 GLY CA . 16157 1
615 . 1 1 66 66 GLY N N 15 108.712 0.05 . 1 . . . . 66 GLY N . 16157 1
616 . 1 1 67 67 LEU H H 1 7.723 0.02 . 1 . . . . 67 LEU H . 16157 1
617 . 1 1 67 67 LEU HA H 1 4.628 0.02 . 1 . . . . 67 LEU HA . 16157 1
618 . 1 1 67 67 LEU HB2 H 1 1.182 0.02 . 1 . . . . 67 LEU HB2 . 16157 1
619 . 1 1 67 67 LEU HB3 H 1 1.057 0.02 . 1 . . . . 67 LEU HB3 . 16157 1
620 . 1 1 67 67 LEU HD11 H 1 0.333 0.02 . 2 . . . . 67 LEU HD11 . 16157 1
621 . 1 1 67 67 LEU HD12 H 1 0.333 0.02 . 2 . . . . 67 LEU HD12 . 16157 1
622 . 1 1 67 67 LEU HD13 H 1 0.333 0.02 . 2 . . . . 67 LEU HD13 . 16157 1
623 . 1 1 67 67 LEU HD21 H 1 0.203 0.02 . 2 . . . . 67 LEU HD21 . 16157 1
624 . 1 1 67 67 LEU HD22 H 1 0.203 0.02 . 2 . . . . 67 LEU HD22 . 16157 1
625 . 1 1 67 67 LEU HD23 H 1 0.203 0.02 . 2 . . . . 67 LEU HD23 . 16157 1
626 . 1 1 67 67 LEU C C 13 167.522 0.05 . 1 . . . . 67 LEU C . 16157 1
627 . 1 1 67 67 LEU CA C 13 51.200 0.05 . 1 . . . . 67 LEU CA . 16157 1
628 . 1 1 67 67 LEU CB C 13 42.747 0.05 . 1 . . . . 67 LEU CB . 16157 1
629 . 1 1 67 67 LEU CD1 C 13 23.666 0.05 . 1 . . . . 67 LEU CD1 . 16157 1
630 . 1 1 67 67 LEU CD2 C 13 22.730 0.05 . 1 . . . . 67 LEU CD2 . 16157 1
631 . 1 1 67 67 LEU N N 15 118.448 0.05 . 1 . . . . 67 LEU N . 16157 1
632 . 1 1 68 68 HIS H H 1 8.003 0.02 . 1 . . . . 68 HIS H . 16157 1
633 . 1 1 68 68 HIS HA H 1 4.890 0.02 . 1 . . . . 68 HIS HA . 16157 1
634 . 1 1 68 68 HIS HB2 H 1 3.000 0.02 . 1 . . . . 68 HIS HB2 . 16157 1
635 . 1 1 68 68 HIS HB3 H 1 2.466 0.02 . 1 . . . . 68 HIS HB3 . 16157 1
636 . 1 1 68 68 HIS HD2 H 1 6.330 0.02 . 1 . . . . 68 HIS HD2 . 16157 1
637 . 1 1 68 68 HIS C C 13 174.161 0.05 . 1 . . . . 68 HIS C . 16157 1
638 . 1 1 68 68 HIS CA C 13 52.180 0.05 . 1 . . . . 68 HIS CA . 16157 1
639 . 1 1 68 68 HIS CB C 13 31.877 0.05 . 1 . . . . 68 HIS CB . 16157 1
640 . 1 1 68 68 HIS N N 15 116.650 0.05 . 1 . . . . 68 HIS N . 16157 1
641 . 1 1 69 69 THR H H 1 8.515 0.02 . 1 . . . . 69 THR H . 16157 1
642 . 1 1 69 69 THR HA H 1 4.808 0.02 . 1 . . . . 69 THR HA . 16157 1
643 . 1 1 69 69 THR HB H 1 4.213 0.02 . 1 . . . . 69 THR HB . 16157 1
644 . 1 1 69 69 THR HG21 H 1 1.188 0.02 . 2 . . . . 69 THR HG21 . 16157 1
645 . 1 1 69 69 THR HG22 H 1 1.188 0.02 . 2 . . . . 69 THR HG22 . 16157 1
646 . 1 1 69 69 THR HG23 H 1 1.188 0.02 . 2 . . . . 69 THR HG23 . 16157 1
647 . 1 1 69 69 THR C C 13 172.511 0.05 . 1 . . . . 69 THR C . 16157 1
648 . 1 1 69 69 THR CA C 13 60.130 0.05 . 1 . . . . 69 THR CA . 16157 1
649 . 1 1 69 69 THR CB C 13 67.840 0.05 . 1 . . . . 69 THR CB . 16157 1
650 . 1 1 69 69 THR CG2 C 13 20.470 0.05 . 1 . . . . 69 THR CG2 . 16157 1
651 . 1 1 69 69 THR N N 15 114.721 0.05 . 1 . . . . 69 THR N . 16157 1
652 . 1 1 70 70 CYS H H 1 7.731 0.02 . 1 . . . . 70 CYS H . 16157 1
653 . 1 1 70 70 CYS HA H 1 4.786 0.02 . 1 . . . . 70 CYS HA . 16157 1
654 . 1 1 70 70 CYS HB2 H 1 3.098 0.02 . 1 . . . . 70 CYS HB2 . 16157 1
655 . 1 1 70 70 CYS HB3 H 1 2.980 0.02 . 1 . . . . 70 CYS HB3 . 16157 1
656 . 1 1 70 70 CYS C C 13 172.053 0.05 . 1 . . . . 70 CYS C . 16157 1
657 . 1 1 70 70 CYS CA C 13 51.950 0.05 . 1 . . . . 70 CYS CA . 16157 1
658 . 1 1 70 70 CYS CB C 13 43.320 0.05 . 1 . . . . 70 CYS CB . 16157 1
659 . 1 1 70 70 CYS N N 15 117.575 0.05 . 1 . . . . 70 CYS N . 16157 1
660 . 1 1 71 71 ASP H H 1 8.370 0.02 . 1 . . . . 71 ASP H . 16157 1
661 . 1 1 71 71 ASP HA H 1 4.993 0.02 . 1 . . . . 71 ASP HA . 16157 1
662 . 1 1 71 71 ASP HB2 H 1 2.706 0.02 . 1 . . . . 71 ASP HB2 . 16157 1
663 . 1 1 71 71 ASP HB3 H 1 2.400 0.02 . 1 . . . . 71 ASP HB3 . 16157 1
664 . 1 1 71 71 ASP C C 13 169.692 0.05 . 1 . . . . 71 ASP C . 16157 1
665 . 1 1 71 71 ASP CA C 13 48.815 0.05 . 1 . . . . 71 ASP CA . 16157 1
666 . 1 1 71 71 ASP CB C 13 40.118 0.05 . 1 . . . . 71 ASP CB . 16157 1
667 . 1 1 71 71 ASP N N 15 120.975 0.05 . 1 . . . . 71 ASP N . 16157 1
668 . 1 1 72 72 PRO HA H 1 4.145 0.02 . 1 . . . . 72 PRO HA . 16157 1
669 . 1 1 72 72 PRO HB2 H 1 1.974 0.02 . 1 . . . . 72 PRO HB2 . 16157 1
670 . 1 1 72 72 PRO HB3 H 1 1.891 0.02 . 1 . . . . 72 PRO HB3 . 16157 1
671 . 1 1 72 72 PRO HD2 H 1 3.815 0.02 . 2 . . . . 72 PRO HD2 . 16157 1
672 . 1 1 72 72 PRO HD3 H 1 3.815 0.02 . 2 . . . . 72 PRO HD3 . 16157 1
673 . 1 1 72 72 PRO HG2 H 1 1.870 0.02 . 1 . . . . 72 PRO HG2 . 16157 1
674 . 1 1 72 72 PRO HG3 H 1 1.780 0.02 . 1 . . . . 72 PRO HG3 . 16157 1
675 . 1 1 72 72 PRO CA C 13 61.360 0.05 . 1 . . . . 72 PRO CA . 16157 1
676 . 1 1 72 72 PRO CB C 13 30.141 0.05 . 1 . . . . 72 PRO CB . 16157 1
677 . 1 1 72 72 PRO CD C 13 48.897 0.05 . 1 . . . . 72 PRO CD . 16157 1
678 . 1 1 72 72 PRO CG C 13 24.900 0.05 . 1 . . . . 72 PRO CG . 16157 1
679 . 1 1 73 73 ALA H H 1 8.169 0.02 . 1 . . . . 73 ALA H . 16157 1
680 . 1 1 73 73 ALA HA H 1 4.247 0.02 . 1 . . . . 73 ALA HA . 16157 1
681 . 1 1 73 73 ALA HB1 H 1 1.311 0.02 . 2 . . . . 73 ALA HB1 . 16157 1
682 . 1 1 73 73 ALA HB2 H 1 1.311 0.02 . 2 . . . . 73 ALA HB2 . 16157 1
683 . 1 1 73 73 ALA HB3 H 1 1.311 0.02 . 2 . . . . 73 ALA HB3 . 16157 1
684 . 1 1 73 73 ALA C C 13 174.353 0.05 . 1 . . . . 73 ALA C . 16157 1
685 . 1 1 73 73 ALA CA C 13 50.370 0.05 . 1 . . . . 73 ALA CA . 16157 1
686 . 1 1 73 73 ALA CB C 13 17.230 0.05 . 1 . . . . 73 ALA CB . 16157 1
687 . 1 1 73 73 ALA N N 15 122.390 0.05 . 1 . . . . 73 ALA N . 16157 1
688 . 1 1 74 74 THR H H 1 7.704 0.02 . 1 . . . . 74 THR H . 16157 1
689 . 1 1 74 74 THR C C 13 175.770 0.05 . 1 . . . . 74 THR C . 16157 1
690 . 1 1 74 74 THR CA C 13 57.794 0.05 . 1 . . . . 74 THR CA . 16157 1
691 . 1 1 74 74 THR CB C 13 67.994 0.05 . 1 . . . . 74 THR CB . 16157 1
692 . 1 1 74 74 THR N N 15 114.834 0.05 . 1 . . . . 74 THR N . 16157 1
693 . 1 1 75 75 PRO HA H 1 4.386 0.02 . 1 . . . . 75 PRO HA . 16157 1
694 . 1 1 75 75 PRO HB2 H 1 2.231 0.02 . 1 . . . . 75 PRO HB2 . 16157 1
695 . 1 1 75 75 PRO HB3 H 1 1.874 0.02 . 1 . . . . 75 PRO HB3 . 16157 1
696 . 1 1 75 75 PRO HD2 H 1 3.750 0.02 . 1 . . . . 75 PRO HD2 . 16157 1
697 . 1 1 75 75 PRO HD3 H 1 3.621 0.02 . 1 . . . . 75 PRO HD3 . 16157 1
698 . 1 1 75 75 PRO HG2 H 1 1.935 0.02 . 2 . . . . 75 PRO HG2 . 16157 1
699 . 1 1 75 75 PRO HG3 H 1 1.935 0.02 . 2 . . . . 75 PRO HG3 . 16157 1
700 . 1 1 75 75 PRO CA C 13 61.440 0.05 . 1 . . . . 75 PRO CA . 16157 1
701 . 1 1 75 75 PRO CB C 13 30.088 0.05 . 1 . . . . 75 PRO CB . 16157 1
702 . 1 1 75 75 PRO CD C 13 48.997 0.05 . 1 . . . . 75 PRO CD . 16157 1
703 . 1 1 75 75 PRO CG C 13 25.430 0.05 . 1 . . . . 75 PRO CG . 16157 1
704 . 1 1 76 76 SER H H 1 8.209 0.02 . 1 . . . . 76 SER H . 16157 1
705 . 1 1 76 76 SER HA H 1 4.373 0.02 . 1 . . . . 76 SER HA . 16157 1
706 . 1 1 76 76 SER HB2 H 1 3.782 0.02 . 2 . . . . 76 SER HB2 . 16157 1
707 . 1 1 76 76 SER HB3 H 1 3.782 0.02 . 2 . . . . 76 SER HB3 . 16157 1
708 . 1 1 76 76 SER C C 13 175.051 0.05 . 1 . . . . 76 SER C . 16157 1
709 . 1 1 76 76 SER CA C 13 56.360 0.05 . 1 . . . . 76 SER CA . 16157 1
710 . 1 1 76 76 SER CB C 13 61.939 0.05 . 1 . . . . 76 SER CB . 16157 1
711 . 1 1 76 76 SER N N 15 115.319 0.05 . 1 . . . . 76 SER N . 16157 1
712 . 1 1 77 77 GLY H H 1 8.124 0.02 . 1 . . . . 77 GLY H . 16157 1
713 . 1 1 77 77 GLY HA2 H 1 4.093 0.02 . 1 . . . . 77 GLY HA2 . 16157 1
714 . 1 1 77 77 GLY HA3 H 1 3.577 0.02 . 1 . . . . 77 GLY HA3 . 16157 1
715 . 1 1 77 77 GLY C C 13 173.087 0.05 . 1 . . . . 77 GLY C . 16157 1
716 . 1 1 77 77 GLY CA C 13 43.555 0.05 . 1 . . . . 77 GLY CA . 16157 1
717 . 1 1 77 77 GLY N N 15 110.791 0.05 . 1 . . . . 77 GLY N . 16157 1
718 . 1 1 78 78 VAL H H 1 7.318 0.02 . 1 . . . . 78 VAL H . 16157 1
719 . 1 1 78 78 VAL HA H 1 3.989 0.02 . 1 . . . . 78 VAL HA . 16157 1
720 . 1 1 78 78 VAL HB H 1 1.979 0.02 . 1 . . . . 78 VAL HB . 16157 1
721 . 1 1 78 78 VAL HG11 H 1 0.785 0.02 . 2 . . . . 78 VAL HG11 . 16157 1
722 . 1 1 78 78 VAL HG12 H 1 0.785 0.02 . 2 . . . . 78 VAL HG12 . 16157 1
723 . 1 1 78 78 VAL HG13 H 1 0.785 0.02 . 2 . . . . 78 VAL HG13 . 16157 1
724 . 1 1 78 78 VAL HG21 H 1 0.744 0.02 . 2 . . . . 78 VAL HG21 . 16157 1
725 . 1 1 78 78 VAL HG22 H 1 0.744 0.02 . 2 . . . . 78 VAL HG22 . 16157 1
726 . 1 1 78 78 VAL HG23 H 1 0.744 0.02 . 2 . . . . 78 VAL HG23 . 16157 1
727 . 1 1 78 78 VAL C C 13 171.243 0.05 . 1 . . . . 78 VAL C . 16157 1
728 . 1 1 78 78 VAL CA C 13 61.449 0.05 . 1 . . . . 78 VAL CA . 16157 1
729 . 1 1 78 78 VAL CB C 13 31.340 0.05 . 1 . . . . 78 VAL CB . 16157 1
730 . 1 1 78 78 VAL CG1 C 13 19.600 0.05 . 1 . . . . 78 VAL CG1 . 16157 1
731 . 1 1 78 78 VAL CG2 C 13 17.862 0.05 . 1 . . . . 78 VAL CG2 . 16157 1
732 . 1 1 78 78 VAL N N 15 122.088 0.05 . 1 . . . . 78 VAL N . 16157 1
stop_
save_