Content for NMR-STAR saveframe, "assigned_chem_shift_list"
save_assigned_chem_shift_list
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list
_Assigned_chem_shift_list.Entry_ID 25213
_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_1
_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 .
_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 'Origin nmrStar file /ebi/msd/pdb_root/Processing/prepare/4uzw/ebi/sap.dep.data.csh'
_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 '1H-15N HSQC' 1 $sample_1 solution 25213 1
2 '1H-13C HSQC' 1 $sample_1 solution 25213 1
3 HNCACB 1 $sample_1 solution 25213 1
4 CBCA(CO)NH 1 $sample_1 solution 25213 1
5 HNCO 1 $sample_1 solution 25213 1
6 HN(CA)CO 1 $sample_1 solution 25213 1
7 HNHB 1 $sample_1 solution 25213 1
8 1H-NOESY 1 $sample_1 solution 25213 1
9 1H-DQF-COSY 1 $sample_1 solution 25213 1
10 1H-TOCSY 1 $sample_1 solution 25213 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
3 $CNS . . 25213 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 SER HA H 1 4.330 0.01 . 1 . 2 . . 1 SER HA . 25213 1
2 . 1 1 1 1 SER HB2 H 1 3.785 0.01 . 1 . 5 . . 1 SER HB2 . 25213 1
3 . 1 1 1 1 SER HB3 H 1 3.785 0.01 . 1 . 6 . . 1 SER HB3 . 25213 1
4 . 1 1 1 1 SER C C 13 174.650 0.10 . 1 . 3 . . 1 SER C . 25213 1
5 . 1 1 1 1 SER CA C 13 59.400 0.10 . 1 . 1 . . 1 SER CA . 25213 1
6 . 1 1 1 1 SER CB C 13 64.360 0.10 . 1 . 4 . . 1 SER CB . 25213 1
7 . 1 1 2 2 ALA H H 1 8.281 0.01 . 1 . 8 . . 2 ALA H . 25213 1
8 . 1 1 2 2 ALA HA H 1 4.065 0.01 . 1 . 10 . . 2 ALA HA . 25213 1
9 . 1 1 2 2 ALA HB1 H 1 0.985 0.01 . 1 . 13 . . 2 ALA HB1 . 25213 1
10 . 1 1 2 2 ALA HB2 H 1 0.985 0.01 . 1 . 13 . . 2 ALA HB2 . 25213 1
11 . 1 1 2 2 ALA HB3 H 1 0.985 0.01 . 1 . 13 . . 2 ALA HB3 . 25213 1
12 . 1 1 2 2 ALA C C 13 177.520 0.10 . 1 . 11 . . 2 ALA C . 25213 1
13 . 1 1 2 2 ALA CA C 13 52.790 0.10 . 1 . 9 . . 2 ALA CA . 25213 1
14 . 1 1 2 2 ALA CB C 13 19.630 0.10 . 1 . 12 . . 2 ALA CB . 25213 1
15 . 1 1 2 2 ALA N N 15 125.050 0.10 . 1 . 7 . . 2 ALA N . 25213 1
16 . 1 1 3 3 ASP H H 1 8.035 0.01 . 1 . 15 . . 3 ASP H . 25213 1
17 . 1 1 3 3 ASP HA H 1 4.534 0.01 . 1 . 17 . . 3 ASP HA . 25213 1
18 . 1 1 3 3 ASP HB2 H 1 2.414 0.01 . 2 . 20 . . 3 ASP HB2 . 25213 1
19 . 1 1 3 3 ASP HB3 H 1 2.579 0.01 . 2 . 21 . . 3 ASP HB3 . 25213 1
20 . 1 1 3 3 ASP C C 13 177.750 0.10 . 1 . 18 . . 3 ASP C . 25213 1
21 . 1 1 3 3 ASP CA C 13 53.710 0.10 . 1 . 16 . . 3 ASP CA . 25213 1
22 . 1 1 3 3 ASP CB C 13 40.730 0.10 . 1 . 19 . . 3 ASP CB . 25213 1
23 . 1 1 3 3 ASP N N 15 118.870 0.10 . 1 . 14 . . 3 ASP N . 25213 1
24 . 1 1 4 4 TYR H H 1 8.035 0.01 . 1 . 23 . . 4 TYR H . 25213 1
25 . 1 1 4 4 TYR HA H 1 4.360 0.01 . 1 . 25 . . 4 TYR HA . 25213 1
26 . 1 1 4 4 TYR HB2 H 1 3.194 0.01 . 1 . 28 . . 4 TYR HB2 . 25213 1
27 . 1 1 4 4 TYR HB3 H 1 2.711 0.01 . 1 . 29 . . 4 TYR HB3 . 25213 1
28 . 1 1 4 4 TYR HD1 H 1 6.882 0.01 . 1 . 30 . . 4 TYR HD1 . 25213 1
29 . 1 1 4 4 TYR HD2 H 1 6.882 0.01 . 1 . 31 . . 4 TYR HD2 . 25213 1
30 . 1 1 4 4 TYR HE1 H 1 6.641 0.01 . 1 . 32 . . 4 TYR HE1 . 25213 1
31 . 1 1 4 4 TYR HE2 H 1 6.641 0.01 . 1 . 33 . . 4 TYR HE2 . 25213 1
32 . 1 1 4 4 TYR C C 13 177.890 0.10 . 1 . 26 . . 4 TYR C . 25213 1
33 . 1 1 4 4 TYR CA C 13 59.610 0.10 . 1 . 24 . . 4 TYR CA . 25213 1
34 . 1 1 4 4 TYR CB C 13 39.400 0.10 . 1 . 27 . . 4 TYR CB . 25213 1
35 . 1 1 4 4 TYR N N 15 121.880 0.10 . 1 . 22 . . 4 TYR N . 25213 1
36 . 1 1 5 5 SER H H 1 8.291 0.01 . 1 . 35 . . 5 SER H . 25213 1
37 . 1 1 5 5 SER HA H 1 4.023 0.01 . 1 . 37 . . 5 SER HA . 25213 1
38 . 1 1 5 5 SER HB2 H 1 3.984 0.01 . 1 . 40 . . 5 SER HB2 . 25213 1
39 . 1 1 5 5 SER HB3 H 1 3.984 0.01 . 1 . 41 . . 5 SER HB3 . 25213 1
40 . 1 1 5 5 SER C C 13 175.700 0.10 . 1 . 38 . . 5 SER C . 25213 1
41 . 1 1 5 5 SER CA C 13 62.030 0.10 . 1 . 36 . . 5 SER CA . 25213 1
42 . 1 1 5 5 SER CB C 13 63.550 0.10 . 1 . 39 . . 5 SER CB . 25213 1
43 . 1 1 5 5 SER N N 15 111.630 0.10 . 1 . 34 . . 5 SER N . 25213 1
44 . 1 1 6 6 SER H H 1 7.864 0.01 . 1 . 43 . . 6 SER H . 25213 1
45 . 1 1 6 6 SER HA H 1 4.468 0.01 . 1 . 45 . . 6 SER HA . 25213 1
46 . 1 1 6 6 SER HB2 H 1 3.857 0.01 . 2 . 48 . . 6 SER HB2 . 25213 1
47 . 1 1 6 6 SER HB3 H 1 3.913 0.01 . 2 . 49 . . 6 SER HB3 . 25213 1
48 . 1 1 6 6 SER C C 13 174.830 0.10 . 1 . 46 . . 6 SER C . 25213 1
49 . 1 1 6 6 SER CA C 13 59.340 0.10 . 1 . 44 . . 6 SER CA . 25213 1
50 . 1 1 6 6 SER CB C 13 64.340 0.10 . 1 . 47 . . 6 SER CB . 25213 1
51 . 1 1 6 6 SER N N 15 115.660 0.10 . 1 . 42 . . 6 SER N . 25213 1
52 . 1 1 7 7 LEU H H 1 7.290 0.01 . 1 . 51 . . 7 LEU H . 25213 1
53 . 1 1 7 7 LEU HA H 1 4.502 0.01 . 1 . 53 . . 7 LEU HA . 25213 1
54 . 1 1 7 7 LEU HB2 H 1 1.579 0.01 . 1 . 56 . . 7 LEU HB2 . 25213 1
55 . 1 1 7 7 LEU HB3 H 1 1.890 0.01 . 1 . 57 . . 7 LEU HB3 . 25213 1
56 . 1 1 7 7 LEU HG H 1 1.784 0.01 . 1 . 58 . . 7 LEU HG . 25213 1
57 . 1 1 7 7 LEU HD11 H 1 0.965 0.01 . 2 . 60 . . 7 LEU HD11 . 25213 1
58 . 1 1 7 7 LEU HD12 H 1 0.965 0.01 . 2 . 60 . . 7 LEU HD12 . 25213 1
59 . 1 1 7 7 LEU HD13 H 1 0.965 0.01 . 2 . 60 . . 7 LEU HD13 . 25213 1
60 . 1 1 7 7 LEU HD21 H 1 0.756 0.01 . 2 . 62 . . 7 LEU HD21 . 25213 1
61 . 1 1 7 7 LEU HD22 H 1 0.756 0.01 . 2 . 62 . . 7 LEU HD22 . 25213 1
62 . 1 1 7 7 LEU HD23 H 1 0.756 0.01 . 2 . 62 . . 7 LEU HD23 . 25213 1
63 . 1 1 7 7 LEU C C 13 177.800 0.10 . 1 . 54 . . 7 LEU C . 25213 1
64 . 1 1 7 7 LEU CA C 13 55.050 0.10 . 1 . 52 . . 7 LEU CA . 25213 1
65 . 1 1 7 7 LEU CB C 13 42.700 0.10 . 1 . 55 . . 7 LEU CB . 25213 1
66 . 1 1 7 7 LEU CD1 C 13 24.480 0.10 . 1 . 59 . . 7 LEU CD1 . 25213 1
67 . 1 1 7 7 LEU CD2 C 13 20.230 0.10 . 1 . 61 . . 7 LEU CD2 . 25213 1
68 . 1 1 7 7 LEU N N 15 122.630 0.10 . 1 . 50 . . 7 LEU N . 25213 1
69 . 1 1 8 8 THR H H 1 8.670 0.01 . 1 . 64 . . 8 THR H . 25213 1
70 . 1 1 8 8 THR HA H 1 4.423 0.01 . 1 . 66 . . 8 THR HA . 25213 1
71 . 1 1 8 8 THR HB H 1 4.714 0.01 . 1 . 69 . . 8 THR HB . 25213 1
72 . 1 1 8 8 THR HG21 H 1 1.304 0.01 . 1 . 71 . . 8 THR HG21 . 25213 1
73 . 1 1 8 8 THR HG22 H 1 1.304 0.01 . 1 . 71 . . 8 THR HG22 . 25213 1
74 . 1 1 8 8 THR HG23 H 1 1.304 0.01 . 1 . 71 . . 8 THR HG23 . 25213 1
75 . 1 1 8 8 THR C C 13 176.470 0.10 . 1 . 67 . . 8 THR C . 25213 1
76 . 1 1 8 8 THR CA C 13 60.870 0.10 . 1 . 65 . . 8 THR CA . 25213 1
77 . 1 1 8 8 THR CB C 13 71.790 0.10 . 1 . 68 . . 8 THR CB . 25213 1
78 . 1 1 8 8 THR CG2 C 13 19.750 0.10 . 1 . 70 . . 8 THR CG2 . 25213 1
79 . 1 1 8 8 THR N N 15 109.730 0.10 . 1 . 63 . . 8 THR N . 25213 1
80 . 1 1 9 9 VAL H H 1 8.763 0.01 . 1 . 73 . . 9 VAL H . 25213 1
81 . 1 1 9 9 VAL HA H 1 3.601 0.01 . 1 . 75 . . 9 VAL HA . 25213 1
82 . 1 1 9 9 VAL HB H 1 2.086 0.01 . 1 . 78 . . 9 VAL HB . 25213 1
83 . 1 1 9 9 VAL HG11 H 1 0.933 0.01 . 2 . 80 . . 9 VAL HG11 . 25213 1
84 . 1 1 9 9 VAL HG12 H 1 0.933 0.01 . 2 . 80 . . 9 VAL HG12 . 25213 1
85 . 1 1 9 9 VAL HG13 H 1 0.933 0.01 . 2 . 80 . . 9 VAL HG13 . 25213 1
86 . 1 1 9 9 VAL HG21 H 1 1.066 0.01 . 2 . 82 . . 9 VAL HG21 . 25213 1
87 . 1 1 9 9 VAL HG22 H 1 1.066 0.01 . 2 . 82 . . 9 VAL HG22 . 25213 1
88 . 1 1 9 9 VAL HG23 H 1 1.066 0.01 . 2 . 82 . . 9 VAL HG23 . 25213 1
89 . 1 1 9 9 VAL C C 13 177.960 0.10 . 1 . 76 . . 9 VAL C . 25213 1
90 . 1 1 9 9 VAL CA C 13 68.520 0.10 . 1 . 74 . . 9 VAL CA . 25213 1
91 . 1 1 9 9 VAL CB C 13 31.900 0.10 . 1 . 77 . . 9 VAL CB . 25213 1
92 . 1 1 9 9 VAL CG1 C 13 19.470 0.10 . 1 . 79 . . 9 VAL CG1 . 25213 1
93 . 1 1 9 9 VAL CG2 C 13 21.470 0.10 . 1 . 81 . . 9 VAL CG2 . 25213 1
94 . 1 1 9 9 VAL N N 15 119.300 0.10 . 1 . 72 . . 9 VAL N . 25213 1
95 . 1 1 10 10 VAL H H 1 7.738 0.01 . 1 . 84 . . 10 VAL H . 25213 1
96 . 1 1 10 10 VAL HA H 1 3.573 0.01 . 1 . 86 . . 10 VAL HA . 25213 1
97 . 1 1 10 10 VAL HB H 1 1.903 0.01 . 1 . 89 . . 10 VAL HB . 25213 1
98 . 1 1 10 10 VAL HG11 H 1 0.907 0.01 . 2 . 91 . . 10 VAL HG11 . 25213 1
99 . 1 1 10 10 VAL HG12 H 1 0.907 0.01 . 2 . 91 . . 10 VAL HG12 . 25213 1
100 . 1 1 10 10 VAL HG13 H 1 0.907 0.01 . 2 . 91 . . 10 VAL HG13 . 25213 1
101 . 1 1 10 10 VAL HG21 H 1 1.025 0.01 . 2 . 93 . . 10 VAL HG21 . 25213 1
102 . 1 1 10 10 VAL HG22 H 1 1.025 0.01 . 2 . 93 . . 10 VAL HG22 . 25213 1
103 . 1 1 10 10 VAL HG23 H 1 1.025 0.01 . 2 . 93 . . 10 VAL HG23 . 25213 1
104 . 1 1 10 10 VAL C C 13 179.200 0.10 . 1 . 87 . . 10 VAL C . 25213 1
105 . 1 1 10 10 VAL CA C 13 67.490 0.10 . 1 . 85 . . 10 VAL CA . 25213 1
106 . 1 1 10 10 VAL CB C 13 32.450 0.10 . 1 . 88 . . 10 VAL CB . 25213 1
107 . 1 1 10 10 VAL CG1 C 13 19.050 0.10 . 1 . 90 . . 10 VAL CG1 . 25213 1
108 . 1 1 10 10 VAL CG2 C 13 20.650 0.10 . 1 . 92 . . 10 VAL CG2 . 25213 1
109 . 1 1 10 10 VAL N N 15 117.620 0.10 . 1 . 83 . . 10 VAL N . 25213 1
110 . 1 1 11 11 GLN H H 1 7.524 0.01 . 1 . 95 . . 11 GLN H . 25213 1
111 . 1 1 11 11 GLN HA H 1 4.090 0.01 . 1 . 97 . . 11 GLN HA . 25213 1
112 . 1 1 11 11 GLN HB2 H 1 1.923 0.01 . 1 . 100 . . 11 GLN HB2 . 25213 1
113 . 1 1 11 11 GLN HB3 H 1 2.494 0.01 . 1 . 101 . . 11 GLN HB3 . 25213 1
114 . 1 1 11 11 GLN HG2 H 1 2.440 0.01 . 2 . 102 . . 11 GLN HG2 . 25213 1
115 . 1 1 11 11 GLN HG3 H 1 2.393 0.01 . 2 . 103 . . 11 GLN HG3 . 25213 1
116 . 1 1 11 11 GLN HE21 H 1 6.723 0.01 . 1 . 104 . . 11 GLN HE21 . 25213 1
117 . 1 1 11 11 GLN HE22 H 1 7.539 0.01 . 1 . 105 . . 11 GLN HE22 . 25213 1
118 . 1 1 11 11 GLN C C 13 180.470 0.10 . 1 . 98 . . 11 GLN C . 25213 1
119 . 1 1 11 11 GLN CA C 13 59.340 0.10 . 1 . 96 . . 11 GLN CA . 25213 1
120 . 1 1 11 11 GLN CB C 13 30.370 0.10 . 1 . 99 . . 11 GLN CB . 25213 1
121 . 1 1 11 11 GLN N N 15 119.670 0.10 . 1 . 94 . . 11 GLN N . 25213 1
122 . 1 1 12 12 LEU H H 1 8.699 0.01 . 1 . 107 . . 12 LEU H . 25213 1
123 . 1 1 12 12 LEU HA H 1 3.848 0.01 . 1 . 109 . . 12 LEU HA . 25213 1
124 . 1 1 12 12 LEU HB2 H 1 1.068 0.01 . 1 . 112 . . 12 LEU HB2 . 25213 1
125 . 1 1 12 12 LEU HB3 H 1 2.064 0.01 . 1 . 113 . . 12 LEU HB3 . 25213 1
126 . 1 1 12 12 LEU HG H 1 1.760 0.01 . 1 . 114 . . 12 LEU HG . 25213 1
127 . 1 1 12 12 LEU HD11 H 1 0.758 0.01 . 2 . 116 . . 12 LEU HD11 . 25213 1
128 . 1 1 12 12 LEU HD12 H 1 0.758 0.01 . 2 . 116 . . 12 LEU HD12 . 25213 1
129 . 1 1 12 12 LEU HD13 H 1 0.758 0.01 . 2 . 116 . . 12 LEU HD13 . 25213 1
130 . 1 1 12 12 LEU HD21 H 1 0.852 0.01 . 2 . 118 . . 12 LEU HD21 . 25213 1
131 . 1 1 12 12 LEU HD22 H 1 0.852 0.01 . 2 . 118 . . 12 LEU HD22 . 25213 1
132 . 1 1 12 12 LEU HD23 H 1 0.852 0.01 . 2 . 118 . . 12 LEU HD23 . 25213 1
133 . 1 1 12 12 LEU C C 13 179.440 0.10 . 1 . 110 . . 12 LEU C . 25213 1
134 . 1 1 12 12 LEU CA C 13 58.910 0.10 . 1 . 108 . . 12 LEU CA . 25213 1
135 . 1 1 12 12 LEU CB C 13 43.270 0.10 . 1 . 111 . . 12 LEU CB . 25213 1
136 . 1 1 12 12 LEU CD1 C 13 25.490 0.10 . 1 . 115 . . 12 LEU CD1 . 25213 1
137 . 1 1 12 12 LEU CD2 C 13 23.130 0.10 . 1 . 117 . . 12 LEU CD2 . 25213 1
138 . 1 1 12 12 LEU N N 15 121.490 0.10 . 1 . 106 . . 12 LEU N . 25213 1
139 . 1 1 13 13 LYS H H 1 8.589 0.01 . 1 . 120 . . 13 LYS H . 25213 1
140 . 1 1 13 13 LYS HA H 1 3.893 0.01 . 1 . 122 . . 13 LYS HA . 25213 1
141 . 1 1 13 13 LYS HB2 H 1 1.875 0.01 . 1 . 125 . . 13 LYS HB2 . 25213 1
142 . 1 1 13 13 LYS HB3 H 1 1.875 0.01 . 1 . 126 . . 13 LYS HB3 . 25213 1
143 . 1 1 13 13 LYS HG2 H 1 1.252 0.01 . 1 . 127 . . 13 LYS HG2 . 25213 1
144 . 1 1 13 13 LYS HG3 H 1 1.252 0.01 . 1 . 128 . . 13 LYS HG3 . 25213 1
145 . 1 1 13 13 LYS HD2 H 1 1.674 0.01 . 2 . 129 . . 13 LYS HD2 . 25213 1
146 . 1 1 13 13 LYS HD3 H 1 1.579 0.01 . 2 . 130 . . 13 LYS HD3 . 25213 1
147 . 1 1 13 13 LYS HE2 H 1 2.806 0.01 . 2 . 131 . . 13 LYS HE2 . 25213 1
148 . 1 1 13 13 LYS HE3 H 1 2.982 0.01 . 2 . 132 . . 13 LYS HE3 . 25213 1
149 . 1 1 13 13 LYS C C 13 179.780 0.10 . 1 . 123 . . 13 LYS C . 25213 1
150 . 1 1 13 13 LYS CA C 13 61.650 0.10 . 1 . 121 . . 13 LYS CA . 25213 1
151 . 1 1 13 13 LYS CB C 13 32.660 0.10 . 1 . 124 . . 13 LYS CB . 25213 1
152 . 1 1 13 13 LYS N N 15 117.610 0.10 . 1 . 119 . . 13 LYS N . 25213 1
153 . 1 1 14 14 ASP H H 1 7.963 0.01 . 1 . 134 . . 14 ASP H . 25213 1
154 . 1 1 14 14 ASP HA H 1 4.381 0.01 . 1 . 136 . . 14 ASP HA . 25213 1
155 . 1 1 14 14 ASP HB2 H 1 2.699 0.01 . 2 . 139 . . 14 ASP HB2 . 25213 1
156 . 1 1 14 14 ASP HB3 H 1 2.749 0.01 . 2 . 140 . . 14 ASP HB3 . 25213 1
157 . 1 1 14 14 ASP C C 13 179.020 0.10 . 1 . 137 . . 14 ASP C . 25213 1
158 . 1 1 14 14 ASP CA C 13 58.310 0.10 . 1 . 135 . . 14 ASP CA . 25213 1
159 . 1 1 14 14 ASP CB C 13 41.520 0.10 . 1 . 138 . . 14 ASP CB . 25213 1
160 . 1 1 14 14 ASP N N 15 121.450 0.10 . 1 . 133 . . 14 ASP N . 25213 1
161 . 1 1 15 15 LEU H H 1 7.655 0.01 . 1 . 142 . . 15 LEU H . 25213 1
162 . 1 1 15 15 LEU HA H 1 3.990 0.01 . 1 . 144 . . 15 LEU HA . 25213 1
163 . 1 1 15 15 LEU HB2 H 1 1.341 0.01 . 1 . 147 . . 15 LEU HB2 . 25213 1
164 . 1 1 15 15 LEU HB3 H 1 1.957 0.01 . 1 . 148 . . 15 LEU HB3 . 25213 1
165 . 1 1 15 15 LEU HG H 1 1.841 0.01 . 1 . 149 . . 15 LEU HG . 25213 1
166 . 1 1 15 15 LEU HD11 H 1 0.936 0.01 . 2 . 151 . . 15 LEU HD11 . 25213 1
167 . 1 1 15 15 LEU HD12 H 1 0.936 0.01 . 2 . 151 . . 15 LEU HD12 . 25213 1
168 . 1 1 15 15 LEU HD13 H 1 0.936 0.01 . 2 . 151 . . 15 LEU HD13 . 25213 1
169 . 1 1 15 15 LEU HD21 H 1 0.886 0.01 . 2 . 153 . . 15 LEU HD21 . 25213 1
170 . 1 1 15 15 LEU HD22 H 1 0.886 0.01 . 2 . 153 . . 15 LEU HD22 . 25213 1
171 . 1 1 15 15 LEU HD23 H 1 0.886 0.01 . 2 . 153 . . 15 LEU HD23 . 25213 1
172 . 1 1 15 15 LEU C C 13 180.440 0.10 . 1 . 145 . . 15 LEU C . 25213 1
173 . 1 1 15 15 LEU CA C 13 58.610 0.10 . 1 . 143 . . 15 LEU CA . 25213 1
174 . 1 1 15 15 LEU CB C 13 42.910 0.10 . 1 . 146 . . 15 LEU CB . 25213 1
175 . 1 1 15 15 LEU CD1 C 13 23.930 0.10 . 1 . 150 . . 15 LEU CD1 . 25213 1
176 . 1 1 15 15 LEU CD2 C 13 21.330 0.10 . 1 . 152 . . 15 LEU CD2 . 25213 1
177 . 1 1 15 15 LEU N N 15 119.440 0.10 . 1 . 141 . . 15 LEU N . 25213 1
178 . 1 1 16 16 LEU H H 1 8.288 0.01 . 1 . 155 . . 16 LEU H . 25213 1
179 . 1 1 16 16 LEU HA H 1 3.603 0.01 . 1 . 157 . . 16 LEU HA . 25213 1
180 . 1 1 16 16 LEU HB2 H 1 1.250 0.01 . 1 . 160 . . 16 LEU HB2 . 25213 1
181 . 1 1 16 16 LEU HB3 H 1 1.805 0.01 . 1 . 161 . . 16 LEU HB3 . 25213 1
182 . 1 1 16 16 LEU HG H 1 1.489 0.01 . 1 . 162 . . 16 LEU HG . 25213 1
183 . 1 1 16 16 LEU HD11 H 1 0.969 0.01 . 2 . 164 . . 16 LEU HD11 . 25213 1
184 . 1 1 16 16 LEU HD12 H 1 0.969 0.01 . 2 . 164 . . 16 LEU HD12 . 25213 1
185 . 1 1 16 16 LEU HD13 H 1 0.969 0.01 . 2 . 164 . . 16 LEU HD13 . 25213 1
186 . 1 1 16 16 LEU HD21 H 1 0.775 0.01 . 2 . 166 . . 16 LEU HD21 . 25213 1
187 . 1 1 16 16 LEU HD22 H 1 0.775 0.01 . 2 . 166 . . 16 LEU HD22 . 25213 1
188 . 1 1 16 16 LEU HD23 H 1 0.775 0.01 . 2 . 166 . . 16 LEU HD23 . 25213 1
189 . 1 1 16 16 LEU C C 13 179.780 0.10 . 1 . 158 . . 16 LEU C . 25213 1
190 . 1 1 16 16 LEU CA C 13 59.270 0.10 . 1 . 156 . . 16 LEU CA . 25213 1
191 . 1 1 16 16 LEU CB C 13 42.070 0.10 . 1 . 159 . . 16 LEU CB . 25213 1
192 . 1 1 16 16 LEU CD1 C 13 26.030 0.10 . 1 . 163 . . 16 LEU CD1 . 25213 1
193 . 1 1 16 16 LEU CD2 C 13 23.360 0.10 . 1 . 165 . . 16 LEU CD2 . 25213 1
194 . 1 1 16 16 LEU N N 15 119.690 0.10 . 1 . 154 . . 16 LEU N . 25213 1
195 . 1 1 17 17 THR H H 1 8.461 0.01 . 1 . 168 . . 17 THR H . 25213 1
196 . 1 1 17 17 THR HA H 1 3.982 0.01 . 1 . 170 . . 17 THR HA . 25213 1
197 . 1 1 17 17 THR HB H 1 4.342 0.01 . 1 . 173 . . 17 THR HB . 25213 1
198 . 1 1 17 17 THR HG21 H 1 1.212 0.01 . 1 . 175 . . 17 THR HG21 . 25213 1
199 . 1 1 17 17 THR HG22 H 1 1.212 0.01 . 1 . 175 . . 17 THR HG22 . 25213 1
200 . 1 1 17 17 THR HG23 H 1 1.212 0.01 . 1 . 175 . . 17 THR HG23 . 25213 1
201 . 1 1 17 17 THR C C 13 179.420 0.10 . 1 . 171 . . 17 THR C . 25213 1
202 . 1 1 17 17 THR CA C 13 67.500 0.10 . 1 . 169 . . 17 THR CA . 25213 1
203 . 1 1 17 17 THR CB C 13 69.130 0.10 . 1 . 172 . . 17 THR CB . 25213 1
204 . 1 1 17 17 THR CG2 C 13 19.220 0.10 . 1 . 174 . . 17 THR CG2 . 25213 1
205 . 1 1 17 17 THR N N 15 116.450 0.10 . 1 . 167 . . 17 THR N . 25213 1
206 . 1 1 18 18 LYS H H 1 7.803 0.01 . 1 . 177 . . 18 LYS H . 25213 1
207 . 1 1 18 18 LYS HA H 1 4.022 0.01 . 1 . 179 . . 18 LYS HA . 25213 1
208 . 1 1 18 18 LYS HB2 H 1 1.935 0.01 . 2 . 182 . . 18 LYS HB2 . 25213 1
209 . 1 1 18 18 LYS HB3 H 1 1.916 0.01 . 2 . 183 . . 18 LYS HB3 . 25213 1
210 . 1 1 18 18 LYS HG2 H 1 1.467 0.01 . 2 . 184 . . 18 LYS HG2 . 25213 1
211 . 1 1 18 18 LYS HG3 H 1 1.596 0.01 . 2 . 185 . . 18 LYS HG3 . 25213 1
212 . 1 1 18 18 LYS HD2 H 1 1.590 0.01 . 1 . 186 . . 18 LYS HD2 . 25213 1
213 . 1 1 18 18 LYS HD3 H 1 1.590 0.01 . 1 . 187 . . 18 LYS HD3 . 25213 1
214 . 1 1 18 18 LYS HE2 H 1 2.935 0.01 . 1 . 188 . . 18 LYS HE2 . 25213 1
215 . 1 1 18 18 LYS HE3 H 1 2.935 0.01 . 1 . 189 . . 18 LYS HE3 . 25213 1
216 . 1 1 18 18 LYS C C 13 178.330 0.10 . 1 . 180 . . 18 LYS C . 25213 1
217 . 1 1 18 18 LYS CA C 13 59.900 0.10 . 1 . 178 . . 18 LYS CA . 25213 1
218 . 1 1 18 18 LYS CB C 13 32.920 0.10 . 1 . 181 . . 18 LYS CB . 25213 1
219 . 1 1 18 18 LYS N N 15 123.160 0.10 . 1 . 176 . . 18 LYS N . 25213 1
220 . 1 1 19 19 ARG H H 1 7.263 0.01 . 1 . 191 . . 19 ARG H . 25213 1
221 . 1 1 19 19 ARG HA H 1 4.283 0.01 . 1 . 193 . . 19 ARG HA . 25213 1
222 . 1 1 19 19 ARG HB2 H 1 2.031 0.01 . 1 . 196 . . 19 ARG HB2 . 25213 1
223 . 1 1 19 19 ARG HB3 H 1 1.482 0.01 . 1 . 197 . . 19 ARG HB3 . 25213 1
224 . 1 1 19 19 ARG HG2 H 1 1.781 0.01 . 2 . 198 . . 19 ARG HG2 . 25213 1
225 . 1 1 19 19 ARG HG3 H 1 1.585 0.01 . 2 . 199 . . 19 ARG HG3 . 25213 1
226 . 1 1 19 19 ARG HD2 H 1 3.325 0.01 . 2 . 200 . . 19 ARG HD2 . 25213 1
227 . 1 1 19 19 ARG HD3 H 1 2.649 0.01 . 2 . 201 . . 19 ARG HD3 . 25213 1
228 . 1 1 19 19 ARG HE H 1 6.745 0.01 . 1 . 202 . . 19 ARG HE . 25213 1
229 . 1 1 19 19 ARG C C 13 175.250 0.10 . 1 . 194 . . 19 ARG C . 25213 1
230 . 1 1 19 19 ARG CA C 13 56.370 0.10 . 1 . 192 . . 19 ARG CA . 25213 1
231 . 1 1 19 19 ARG CB C 13 32.000 0.10 . 1 . 195 . . 19 ARG CB . 25213 1
232 . 1 1 19 19 ARG N N 15 116.290 0.10 . 1 . 190 . . 19 ARG N . 25213 1
233 . 1 1 20 20 ASN H H 1 8.036 0.01 . 1 . 204 . . 20 ASN H . 25213 1
234 . 1 1 20 20 ASN HA H 1 4.344 0.01 . 1 . 206 . . 20 ASN HA . 25213 1
235 . 1 1 20 20 ASN HB2 H 1 2.770 0.01 . 2 . 209 . . 20 ASN HB2 . 25213 1
236 . 1 1 20 20 ASN HB3 H 1 3.073 0.01 . 2 . 210 . . 20 ASN HB3 . 25213 1
237 . 1 1 20 20 ASN HD21 H 1 6.755 0.01 . 1 . 211 . . 20 ASN HD21 . 25213 1
238 . 1 1 20 20 ASN HD22 H 1 7.524 0.01 . 1 . 212 . . 20 ASN HD22 . 25213 1
239 . 1 1 20 20 ASN C C 13 174.580 0.10 . 1 . 207 . . 20 ASN C . 25213 1
240 . 1 1 20 20 ASN CA C 13 55.060 0.10 . 1 . 205 . . 20 ASN CA . 25213 1
241 . 1 1 20 20 ASN CB C 13 37.700 0.10 . 1 . 208 . . 20 ASN CB . 25213 1
242 . 1 1 20 20 ASN N N 15 115.360 0.10 . 1 . 203 . . 20 ASN N . 25213 1
243 . 1 1 21 21 LEU H H 1 7.911 0.01 . 1 . 214 . . 21 LEU H . 25213 1
244 . 1 1 21 21 LEU HA H 1 4.610 0.01 . 1 . 216 . . 21 LEU HA . 25213 1
245 . 1 1 21 21 LEU HB2 H 1 1.186 0.01 . 1 . 219 . . 21 LEU HB2 . 25213 1
246 . 1 1 21 21 LEU HB3 H 1 1.551 0.01 . 1 . 220 . . 21 LEU HB3 . 25213 1
247 . 1 1 21 21 LEU HG H 1 1.486 0.01 . 1 . 221 . . 21 LEU HG . 25213 1
248 . 1 1 21 21 LEU HD11 H 1 0.682 0.01 . 2 . 223 . . 21 LEU HD11 . 25213 1
249 . 1 1 21 21 LEU HD12 H 1 0.682 0.01 . 2 . 223 . . 21 LEU HD12 . 25213 1
250 . 1 1 21 21 LEU HD13 H 1 0.682 0.01 . 2 . 223 . . 21 LEU HD13 . 25213 1
251 . 1 1 21 21 LEU HD21 H 1 0.812 0.01 . 2 . 225 . . 21 LEU HD21 . 25213 1
252 . 1 1 21 21 LEU HD22 H 1 0.812 0.01 . 2 . 225 . . 21 LEU HD22 . 25213 1
253 . 1 1 21 21 LEU HD23 H 1 0.812 0.01 . 2 . 225 . . 21 LEU HD23 . 25213 1
254 . 1 1 21 21 LEU C C 13 176.300 0.10 . 1 . 217 . . 21 LEU C . 25213 1
255 . 1 1 21 21 LEU CA C 13 53.250 0.10 . 1 . 215 . . 21 LEU CA . 25213 1
256 . 1 1 21 21 LEU CB C 13 46.160 0.10 . 1 . 218 . . 21 LEU CB . 25213 1
257 . 1 1 21 21 LEU CD1 C 13 24.000 0.10 . 1 . 222 . . 21 LEU CD1 . 25213 1
258 . 1 1 21 21 LEU CD2 C 13 20.540 0.10 . 1 . 224 . . 21 LEU CD2 . 25213 1
259 . 1 1 21 21 LEU N N 15 117.720 0.10 . 1 . 213 . . 21 LEU N . 25213 1
260 . 1 1 22 22 SER H H 1 8.064 0.01 . 1 . 227 . . 22 SER H . 25213 1
261 . 1 1 22 22 SER HA H 1 4.203 0.01 . 1 . 229 . . 22 SER HA . 25213 1
262 . 1 1 22 22 SER HB2 H 1 3.910 0.01 . 2 . 232 . . 22 SER HB2 . 25213 1
263 . 1 1 22 22 SER HB3 H 1 3.553 0.01 . 2 . 233 . . 22 SER HB3 . 25213 1
264 . 1 1 22 22 SER C C 13 176.880 0.10 . 1 . 230 . . 22 SER C . 25213 1
265 . 1 1 22 22 SER CA C 13 58.870 0.10 . 1 . 228 . . 22 SER CA . 25213 1
266 . 1 1 22 22 SER CB C 13 64.320 0.10 . 1 . 231 . . 22 SER CB . 25213 1
267 . 1 1 22 22 SER N N 15 112.460 0.10 . 1 . 226 . . 22 SER N . 25213 1
268 . 1 1 23 23 VAL H H 1 8.025 0.01 . 1 . 235 . . 23 VAL H . 25213 1
269 . 1 1 23 23 VAL HA H 1 4.341 0.01 . 1 . 237 . . 23 VAL HA . 25213 1
270 . 1 1 23 23 VAL HB H 1 2.361 0.01 . 1 . 240 . . 23 VAL HB . 25213 1
271 . 1 1 23 23 VAL HG11 H 1 0.929 0.01 . 2 . 242 . . 23 VAL HG11 . 25213 1
272 . 1 1 23 23 VAL HG12 H 1 0.929 0.01 . 2 . 242 . . 23 VAL HG12 . 25213 1
273 . 1 1 23 23 VAL HG13 H 1 0.929 0.01 . 2 . 242 . . 23 VAL HG13 . 25213 1
274 . 1 1 23 23 VAL HG21 H 1 0.772 0.01 . 2 . 244 . . 23 VAL HG21 . 25213 1
275 . 1 1 23 23 VAL HG22 H 1 0.772 0.01 . 2 . 244 . . 23 VAL HG22 . 25213 1
276 . 1 1 23 23 VAL HG23 H 1 0.772 0.01 . 2 . 244 . . 23 VAL HG23 . 25213 1
277 . 1 1 23 23 VAL C C 13 176.070 0.10 . 1 . 238 . . 23 VAL C . 25213 1
278 . 1 1 23 23 VAL CA C 13 61.250 0.10 . 1 . 236 . . 23 VAL CA . 25213 1
279 . 1 1 23 23 VAL CB C 13 32.160 0.10 . 1 . 239 . . 23 VAL CB . 25213 1
280 . 1 1 23 23 VAL CG1 C 13 20.330 0.10 . 1 . 241 . . 23 VAL CG1 . 25213 1
281 . 1 1 23 23 VAL CG2 C 13 16.170 0.10 . 1 . 243 . . 23 VAL CG2 . 25213 1
282 . 1 1 23 23 VAL N N 15 114.710 0.10 . 1 . 234 . . 23 VAL N . 25213 1
283 . 1 1 24 24 GLY H H 1 7.981 0.01 . 1 . 246 . . 24 GLY H . 25213 1
284 . 1 1 24 24 GLY HA2 H 1 4.001 0.01 . 2 . 248 . . 24 GLY HA2 . 25213 1
285 . 1 1 24 24 GLY HA3 H 1 3.594 0.01 . 2 . 249 . . 24 GLY HA3 . 25213 1
286 . 1 1 24 24 GLY C C 13 174.300 0.10 . 1 . 250 . . 24 GLY C . 25213 1
287 . 1 1 24 24 GLY CA C 13 45.950 0.10 . 1 . 247 . . 24 GLY CA . 25213 1
288 . 1 1 24 24 GLY N N 15 108.790 0.10 . 1 . 245 . . 24 GLY N . 25213 1
289 . 1 1 25 25 GLY H H 1 8.089 0.01 . 1 . 252 . . 25 GLY H . 25213 1
290 . 1 1 25 25 GLY HA2 H 1 3.634 0.01 . 2 . 254 . . 25 GLY HA2 . 25213 1
291 . 1 1 25 25 GLY HA3 H 1 4.494 0.01 . 2 . 255 . . 25 GLY HA3 . 25213 1
292 . 1 1 25 25 GLY C C 13 174.930 0.10 . 1 . 256 . . 25 GLY C . 25213 1
293 . 1 1 25 25 GLY CA C 13 44.270 0.10 . 1 . 253 . . 25 GLY CA . 25213 1
294 . 1 1 25 25 GLY N N 15 108.740 0.10 . 1 . 251 . . 25 GLY N . 25213 1
295 . 1 1 26 26 LEU H H 1 8.363 0.01 . 1 . 258 . . 26 LEU H . 25213 1
296 . 1 1 26 26 LEU HA H 1 4.362 0.01 . 1 . 260 . . 26 LEU HA . 25213 1
297 . 1 1 26 26 LEU HB2 H 1 1.720 0.01 . 1 . 263 . . 26 LEU HB2 . 25213 1
298 . 1 1 26 26 LEU HB3 H 1 1.720 0.01 . 1 . 264 . . 26 LEU HB3 . 25213 1
299 . 1 1 26 26 LEU HG H 1 1.721 0.01 . 1 . 265 . . 26 LEU HG . 25213 1
300 . 1 1 26 26 LEU HD11 H 1 0.924 0.01 . 2 . 267 . . 26 LEU HD11 . 25213 1
301 . 1 1 26 26 LEU HD12 H 1 0.924 0.01 . 2 . 267 . . 26 LEU HD12 . 25213 1
302 . 1 1 26 26 LEU HD13 H 1 0.924 0.01 . 2 . 267 . . 26 LEU HD13 . 25213 1
303 . 1 1 26 26 LEU HD21 H 1 0.878 0.01 . 2 . 269 . . 26 LEU HD21 . 25213 1
304 . 1 1 26 26 LEU HD22 H 1 0.878 0.01 . 2 . 269 . . 26 LEU HD22 . 25213 1
305 . 1 1 26 26 LEU HD23 H 1 0.878 0.01 . 2 . 269 . . 26 LEU HD23 . 25213 1
306 . 1 1 26 26 LEU C C 13 179.080 0.10 . 1 . 261 . . 26 LEU C . 25213 1
307 . 1 1 26 26 LEU CA C 13 54.710 0.10 . 1 . 259 . . 26 LEU CA . 25213 1
308 . 1 1 26 26 LEU CB C 13 43.130 0.10 . 1 . 262 . . 26 LEU CB . 25213 1
309 . 1 1 26 26 LEU CD1 C 13 23.450 0.10 . 1 . 266 . . 26 LEU CD1 . 25213 1
310 . 1 1 26 26 LEU CD2 C 13 20.380 0.10 . 1 . 268 . . 26 LEU CD2 . 25213 1
311 . 1 1 26 26 LEU N N 15 117.930 0.10 . 1 . 257 . . 26 LEU N . 25213 1
312 . 1 1 27 27 LYS H H 1 8.729 0.01 . 1 . 271 . . 27 LYS H . 25213 1
313 . 1 1 27 27 LYS HA H 1 3.622 0.01 . 1 . 273 . . 27 LYS HA . 25213 1
314 . 1 1 27 27 LYS HB2 H 1 1.786 0.01 . 1 . 276 . . 27 LYS HB2 . 25213 1
315 . 1 1 27 27 LYS HB3 H 1 1.786 0.01 . 1 . 277 . . 27 LYS HB3 . 25213 1
316 . 1 1 27 27 LYS HG2 H 1 1.120 0.01 . 2 . 278 . . 27 LYS HG2 . 25213 1
317 . 1 1 27 27 LYS HG3 H 1 1.249 0.01 . 2 . 279 . . 27 LYS HG3 . 25213 1
318 . 1 1 27 27 LYS HD2 H 1 1.669 0.01 . 2 . 280 . . 27 LYS HD2 . 25213 1
319 . 1 1 27 27 LYS HD3 H 1 1.601 0.01 . 2 . 281 . . 27 LYS HD3 . 25213 1
320 . 1 1 27 27 LYS HE2 H 1 2.915 0.01 . 1 . 282 . . 27 LYS HE2 . 25213 1
321 . 1 1 27 27 LYS HE3 H 1 2.915 0.01 . 1 . 283 . . 27 LYS HE3 . 25213 1
322 . 1 1 27 27 LYS C C 13 177.980 0.10 . 1 . 274 . . 27 LYS C . 25213 1
323 . 1 1 27 27 LYS CA C 13 62.600 0.10 . 1 . 272 . . 27 LYS CA . 25213 1
324 . 1 1 27 27 LYS CB C 13 32.750 0.10 . 1 . 275 . . 27 LYS CB . 25213 1
325 . 1 1 27 27 LYS N N 15 120.460 0.10 . 1 . 270 . . 27 LYS N . 25213 1
326 . 1 1 28 28 ASN H H 1 8.800 0.01 . 1 . 285 . . 28 ASN H . 25213 1
327 . 1 1 28 28 ASN HA H 1 4.283 0.01 . 1 . 287 . . 28 ASN HA . 25213 1
328 . 1 1 28 28 ASN HB2 H 1 2.707 0.01 . 1 . 290 . . 28 ASN HB2 . 25213 1
329 . 1 1 28 28 ASN HB3 H 1 2.707 0.01 . 1 . 291 . . 28 ASN HB3 . 25213 1
330 . 1 1 28 28 ASN HD21 H 1 6.978 0.01 . 1 . 292 . . 28 ASN HD21 . 25213 1
331 . 1 1 28 28 ASN HD22 H 1 7.650 0.01 . 1 . 293 . . 28 ASN HD22 . 25213 1
332 . 1 1 28 28 ASN C C 13 178.150 0.10 . 1 . 288 . . 28 ASN C . 25213 1
333 . 1 1 28 28 ASN CA C 13 57.280 0.10 . 1 . 286 . . 28 ASN CA . 25213 1
334 . 1 1 28 28 ASN CB C 13 38.050 0.10 . 1 . 289 . . 28 ASN CB . 25213 1
335 . 1 1 28 28 ASN N N 15 112.450 0.10 . 1 . 284 . . 28 ASN N . 25213 1
336 . 1 1 29 29 GLU H H 1 7.351 0.01 . 1 . 295 . . 29 GLU H . 25213 1
337 . 1 1 29 29 GLU HA H 1 3.986 0.01 . 1 . 297 . . 29 GLU HA . 25213 1
338 . 1 1 29 29 GLU HB2 H 1 1.981 0.01 . 2 . 300 . . 29 GLU HB2 . 25213 1
339 . 1 1 29 29 GLU HB3 H 1 2.363 0.01 . 2 . 301 . . 29 GLU HB3 . 25213 1
340 . 1 1 29 29 GLU HG2 H 1 2.211 0.01 . 1 . 302 . . 29 GLU HG2 . 25213 1
341 . 1 1 29 29 GLU HG3 H 1 2.211 0.01 . 1 . 303 . . 29 GLU HG3 . 25213 1
342 . 1 1 29 29 GLU C C 13 179.790 0.10 . 1 . 298 . . 29 GLU C . 25213 1
343 . 1 1 29 29 GLU CA C 13 59.510 0.10 . 1 . 296 . . 29 GLU CA . 25213 1
344 . 1 1 29 29 GLU CB C 13 30.150 0.10 . 1 . 299 . . 29 GLU CB . 25213 1
345 . 1 1 29 29 GLU N N 15 119.380 0.10 . 1 . 294 . . 29 GLU N . 25213 1
346 . 1 1 30 30 LEU H H 1 7.809 0.01 . 1 . 305 . . 30 LEU H . 25213 1
347 . 1 1 30 30 LEU HA H 1 3.731 0.01 . 1 . 307 . . 30 LEU HA . 25213 1
348 . 1 1 30 30 LEU HB2 H 1 1.169 0.01 . 1 . 310 . . 30 LEU HB2 . 25213 1
349 . 1 1 30 30 LEU HB3 H 1 2.107 0.01 . 1 . 311 . . 30 LEU HB3 . 25213 1
350 . 1 1 30 30 LEU HG H 1 1.667 0.01 . 1 . 312 . . 30 LEU HG . 25213 1
351 . 1 1 30 30 LEU HD11 H 1 0.735 0.01 . 2 . 314 . . 30 LEU HD11 . 25213 1
352 . 1 1 30 30 LEU HD12 H 1 0.735 0.01 . 2 . 314 . . 30 LEU HD12 . 25213 1
353 . 1 1 30 30 LEU HD13 H 1 0.735 0.01 . 2 . 314 . . 30 LEU HD13 . 25213 1
354 . 1 1 30 30 LEU HD21 H 1 0.339 0.01 . 2 . 316 . . 30 LEU HD21 . 25213 1
355 . 1 1 30 30 LEU HD22 H 1 0.339 0.01 . 2 . 316 . . 30 LEU HD22 . 25213 1
356 . 1 1 30 30 LEU HD23 H 1 0.339 0.01 . 2 . 316 . . 30 LEU HD23 . 25213 1
357 . 1 1 30 30 LEU C C 13 178.970 0.10 . 1 . 308 . . 30 LEU C . 25213 1
358 . 1 1 30 30 LEU CA C 13 58.710 0.10 . 1 . 306 . . 30 LEU CA . 25213 1
359 . 1 1 30 30 LEU CB C 13 41.550 0.10 . 1 . 309 . . 30 LEU CB . 25213 1
360 . 1 1 30 30 LEU CD1 C 13 25.060 0.10 . 1 . 313 . . 30 LEU CD1 . 25213 1
361 . 1 1 30 30 LEU CD2 C 13 19.780 0.10 . 1 . 315 . . 30 LEU CD2 . 25213 1
362 . 1 1 30 30 LEU N N 15 120.360 0.10 . 1 . 304 . . 30 LEU N . 25213 1
363 . 1 1 31 31 VAL H H 1 7.886 0.01 . 1 . 318 . . 31 VAL H . 25213 1
364 . 1 1 31 31 VAL HA H 1 3.198 0.01 . 1 . 320 . . 31 VAL HA . 25213 1
365 . 1 1 31 31 VAL HB H 1 2.062 0.01 . 1 . 323 . . 31 VAL HB . 25213 1
366 . 1 1 31 31 VAL HG11 H 1 0.973 0.01 . 2 . 325 . . 31 VAL HG11 . 25213 1
367 . 1 1 31 31 VAL HG12 H 1 0.973 0.01 . 2 . 325 . . 31 VAL HG12 . 25213 1
368 . 1 1 31 31 VAL HG13 H 1 0.973 0.01 . 2 . 325 . . 31 VAL HG13 . 25213 1
369 . 1 1 31 31 VAL HG21 H 1 0.941 0.01 . 2 . 327 . . 31 VAL HG21 . 25213 1
370 . 1 1 31 31 VAL HG22 H 1 0.941 0.01 . 2 . 327 . . 31 VAL HG22 . 25213 1
371 . 1 1 31 31 VAL HG23 H 1 0.941 0.01 . 2 . 327 . . 31 VAL HG23 . 25213 1
372 . 1 1 31 31 VAL C C 13 178.300 0.10 . 1 . 321 . . 31 VAL C . 25213 1
373 . 1 1 31 31 VAL CA C 13 67.680 0.10 . 1 . 319 . . 31 VAL CA . 25213 1
374 . 1 1 31 31 VAL CB C 13 32.790 0.10 . 1 . 322 . . 31 VAL CB . 25213 1
375 . 1 1 31 31 VAL CG1 C 13 19.740 0.10 . 1 . 324 . . 31 VAL CG1 . 25213 1
376 . 1 1 31 31 VAL CG2 C 13 21.890 0.10 . 1 . 326 . . 31 VAL CG2 . 25213 1
377 . 1 1 31 31 VAL N N 15 116.800 0.10 . 1 . 317 . . 31 VAL N . 25213 1
378 . 1 1 32 32 GLN H H 1 7.750 0.01 . 1 . 329 . . 32 GLN H . 25213 1
379 . 1 1 32 32 GLN HA H 1 3.886 0.01 . 1 . 331 . . 32 GLN HA . 25213 1
380 . 1 1 32 32 GLN HB2 H 1 2.059 0.01 . 1 . 334 . . 32 GLN HB2 . 25213 1
381 . 1 1 32 32 GLN HB3 H 1 2.059 0.01 . 1 . 335 . . 32 GLN HB3 . 25213 1
382 . 1 1 32 32 GLN HG2 H 1 2.469 0.01 . 1 . 336 . . 32 GLN HG2 . 25213 1
383 . 1 1 32 32 GLN HG3 H 1 2.469 0.01 . 1 . 337 . . 32 GLN HG3 . 25213 1
384 . 1 1 32 32 GLN HE21 H 1 6.907 0.01 . 1 . 338 . . 32 GLN HE21 . 25213 1
385 . 1 1 32 32 GLN HE22 H 1 7.412 0.01 . 1 . 339 . . 32 GLN HE22 . 25213 1
386 . 1 1 32 32 GLN C C 13 178.010 0.10 . 1 . 332 . . 32 GLN C . 25213 1
387 . 1 1 32 32 GLN CA C 13 59.040 0.10 . 1 . 330 . . 32 GLN CA . 25213 1
388 . 1 1 32 32 GLN CB C 13 28.740 0.10 . 1 . 333 . . 32 GLN CB . 25213 1
389 . 1 1 32 32 GLN N N 15 115.150 0.10 . 1 . 328 . . 32 GLN N . 25213 1
390 . 1 1 33 33 ARG H H 1 7.795 0.01 . 1 . 341 . . 33 ARG H . 25213 1
391 . 1 1 33 33 ARG HA H 1 3.883 0.01 . 1 . 343 . . 33 ARG HA . 25213 1
392 . 1 1 33 33 ARG HB2 H 1 1.805 0.01 . 1 . 346 . . 33 ARG HB2 . 25213 1
393 . 1 1 33 33 ARG HB3 H 1 2.010 0.01 . 1 . 347 . . 33 ARG HB3 . 25213 1
394 . 1 1 33 33 ARG HG2 H 1 1.408 0.01 . 2 . 348 . . 33 ARG HG2 . 25213 1
395 . 1 1 33 33 ARG HG3 H 1 1.680 0.01 . 2 . 349 . . 33 ARG HG3 . 25213 1
396 . 1 1 33 33 ARG HD2 H 1 3.143 0.01 . 2 . 350 . . 33 ARG HD2 . 25213 1
397 . 1 1 33 33 ARG HD3 H 1 3.383 0.01 . 2 . 351 . . 33 ARG HD3 . 25213 1
398 . 1 1 33 33 ARG HE H 1 7.232 0.01 . 1 . 352 . . 33 ARG HE . 25213 1
399 . 1 1 33 33 ARG HH11 H 1 6.274 0.01 . 1 . 353 . . 33 ARG HH11 . 25213 1
400 . 1 1 33 33 ARG HH12 H 1 6.274 0.01 . 1 . 354 . . 33 ARG HH12 . 25213 1
401 . 1 1 33 33 ARG HH21 H 1 6.274 0.01 . 1 . 355 . . 33 ARG HH21 . 25213 1
402 . 1 1 33 33 ARG HH22 H 1 6.274 0.01 . 1 . 356 . . 33 ARG HH22 . 25213 1
403 . 1 1 33 33 ARG C C 13 179.910 0.10 . 1 . 344 . . 33 ARG C . 25213 1
404 . 1 1 33 33 ARG CA C 13 60.350 0.10 . 1 . 342 . . 33 ARG CA . 25213 1
405 . 1 1 33 33 ARG CB C 13 30.510 0.10 . 1 . 345 . . 33 ARG CB . 25213 1
406 . 1 1 33 33 ARG N N 15 120.720 0.10 . 1 . 340 . . 33 ARG N . 25213 1
407 . 1 1 34 34 LEU H H 1 7.313 0.01 . 1 . 358 . . 34 LEU H . 25213 1
408 . 1 1 34 34 LEU HA H 1 3.650 0.01 . 1 . 360 . . 34 LEU HA . 25213 1
409 . 1 1 34 34 LEU HB2 H 1 0.440 0.01 . 1 . 363 . . 34 LEU HB2 . 25213 1
410 . 1 1 34 34 LEU HB3 H 1 1.294 0.01 . 1 . 364 . . 34 LEU HB3 . 25213 1
411 . 1 1 34 34 LEU HG H 1 1.293 0.01 . 1 . 365 . . 34 LEU HG . 25213 1
412 . 1 1 34 34 LEU HD11 H 1 0.351 0.01 . 2 . 367 . . 34 LEU HD11 . 25213 1
413 . 1 1 34 34 LEU HD12 H 1 0.351 0.01 . 2 . 367 . . 34 LEU HD12 . 25213 1
414 . 1 1 34 34 LEU HD13 H 1 0.351 0.01 . 2 . 367 . . 34 LEU HD13 . 25213 1
415 . 1 1 34 34 LEU HD21 H 1 0.382 0.01 . 2 . 369 . . 34 LEU HD21 . 25213 1
416 . 1 1 34 34 LEU HD22 H 1 0.382 0.01 . 2 . 369 . . 34 LEU HD22 . 25213 1
417 . 1 1 34 34 LEU HD23 H 1 0.382 0.01 . 2 . 369 . . 34 LEU HD23 . 25213 1
418 . 1 1 34 34 LEU C C 13 178.420 0.10 . 1 . 361 . . 34 LEU C . 25213 1
419 . 1 1 34 34 LEU CA C 13 58.690 0.10 . 1 . 359 . . 34 LEU CA . 25213 1
420 . 1 1 34 34 LEU CB C 13 42.190 0.10 . 1 . 362 . . 34 LEU CB . 25213 1
421 . 1 1 34 34 LEU CD1 C 13 25.160 0.10 . 1 . 366 . . 34 LEU CD1 . 25213 1
422 . 1 1 34 34 LEU CD2 C 13 20.880 0.10 . 1 . 368 . . 34 LEU CD2 . 25213 1
423 . 1 1 34 34 LEU N N 15 121.220 0.10 . 1 . 357 . . 34 LEU N . 25213 1
424 . 1 1 35 35 ILE H H 1 8.010 0.01 . 1 . 371 . . 35 ILE H . 25213 1
425 . 1 1 35 35 ILE HA H 1 3.784 0.01 . 1 . 373 . . 35 ILE HA . 25213 1
426 . 1 1 35 35 ILE HB H 1 1.771 0.01 . 1 . 376 . . 35 ILE HB . 25213 1
427 . 1 1 35 35 ILE HG12 H 1 1.976 0.01 . 2 . 377 . . 35 ILE HG12 . 25213 1
428 . 1 1 35 35 ILE HG13 H 1 1.251 0.01 . 2 . 378 . . 35 ILE HG13 . 25213 1
429 . 1 1 35 35 ILE HG21 H 1 0.935 0.01 . 1 . 380 . . 35 ILE HG21 . 25213 1
430 . 1 1 35 35 ILE HG22 H 1 0.935 0.01 . 1 . 380 . . 35 ILE HG22 . 25213 1
431 . 1 1 35 35 ILE HG23 H 1 0.935 0.01 . 1 . 380 . . 35 ILE HG23 . 25213 1
432 . 1 1 35 35 ILE HD11 H 1 0.910 0.01 . 1 . 382 . . 35 ILE HD11 . 25213 1
433 . 1 1 35 35 ILE HD12 H 1 0.910 0.01 . 1 . 382 . . 35 ILE HD12 . 25213 1
434 . 1 1 35 35 ILE HD13 H 1 0.910 0.01 . 1 . 382 . . 35 ILE HD13 . 25213 1
435 . 1 1 35 35 ILE C C 13 179.580 0.10 . 1 . 374 . . 35 ILE C . 25213 1
436 . 1 1 35 35 ILE CA C 13 66.290 0.10 . 1 . 372 . . 35 ILE CA . 25213 1
437 . 1 1 35 35 ILE CB C 13 38.930 0.10 . 1 . 375 . . 35 ILE CB . 25213 1
438 . 1 1 35 35 ILE CG2 C 13 14.950 0.10 . 1 . 379 . . 35 ILE CG2 . 25213 1
439 . 1 1 35 35 ILE CD1 C 13 12.330 0.10 . 1 . 381 . . 35 ILE CD1 . 25213 1
440 . 1 1 35 35 ILE N N 15 119.550 0.10 . 1 . 370 . . 35 ILE N . 25213 1
441 . 1 1 36 36 LYS H H 1 8.350 0.01 . 1 . 384 . . 36 LYS H . 25213 1
442 . 1 1 36 36 LYS HA H 1 4.060 0.01 . 1 . 386 . . 36 LYS HA . 25213 1
443 . 1 1 36 36 LYS HB2 H 1 1.867 0.01 . 2 . 389 . . 36 LYS HB2 . 25213 1
444 . 1 1 36 36 LYS HB3 H 1 1.773 0.01 . 2 . 390 . . 36 LYS HB3 . 25213 1
445 . 1 1 36 36 LYS HG2 H 1 1.477 0.01 . 2 . 391 . . 36 LYS HG2 . 25213 1
446 . 1 1 36 36 LYS HG3 H 1 1.408 0.01 . 2 . 392 . . 36 LYS HG3 . 25213 1
447 . 1 1 36 36 LYS HD2 H 1 1.673 0.01 . 1 . 393 . . 36 LYS HD2 . 25213 1
448 . 1 1 36 36 LYS HD3 H 1 1.673 0.01 . 1 . 394 . . 36 LYS HD3 . 25213 1
449 . 1 1 36 36 LYS HE2 H 1 2.946 0.01 . 1 . 395 . . 36 LYS HE2 . 25213 1
450 . 1 1 36 36 LYS HE3 H 1 2.946 0.01 . 1 . 396 . . 36 LYS HE3 . 25213 1
451 . 1 1 36 36 LYS C C 13 179.330 0.10 . 1 . 387 . . 36 LYS C . 25213 1
452 . 1 1 36 36 LYS CA C 13 59.430 0.10 . 1 . 385 . . 36 LYS CA . 25213 1
453 . 1 1 36 36 LYS CB C 13 32.420 0.10 . 1 . 388 . . 36 LYS CB . 25213 1
454 . 1 1 36 36 LYS N N 15 119.290 0.10 . 1 . 383 . . 36 LYS N . 25213 1
455 . 1 1 37 37 ASP H H 1 7.571 0.01 . 1 . 398 . . 37 ASP H . 25213 1
456 . 1 1 37 37 ASP HA H 1 4.388 0.01 . 1 . 400 . . 37 ASP HA . 25213 1
457 . 1 1 37 37 ASP HB2 H 1 2.530 0.01 . 2 . 403 . . 37 ASP HB2 . 25213 1
458 . 1 1 37 37 ASP HB3 H 1 2.567 0.01 . 2 . 404 . . 37 ASP HB3 . 25213 1
459 . 1 1 37 37 ASP C C 13 179.150 0.10 . 1 . 401 . . 37 ASP C . 25213 1
460 . 1 1 37 37 ASP CA C 13 58.660 0.10 . 1 . 399 . . 37 ASP CA . 25213 1
461 . 1 1 37 37 ASP CB C 13 43.300 0.10 . 1 . 402 . . 37 ASP CB . 25213 1
462 . 1 1 37 37 ASP N N 15 118.980 0.10 . 1 . 397 . . 37 ASP N . 25213 1
463 . 1 1 38 38 ASP H H 1 8.495 0.01 . 1 . 406 . . 38 ASP H . 25213 1
464 . 1 1 38 38 ASP HA H 1 4.319 0.01 . 1 . 408 . . 38 ASP HA . 25213 1
465 . 1 1 38 38 ASP HB2 H 1 2.684 0.01 . 1 . 411 . . 38 ASP HB2 . 25213 1
466 . 1 1 38 38 ASP HB3 H 1 3.224 0.01 . 1 . 412 . . 38 ASP HB3 . 25213 1
467 . 1 1 38 38 ASP C C 13 179.410 0.10 . 1 . 409 . . 38 ASP C . 25213 1
468 . 1 1 38 38 ASP CA C 13 57.600 0.10 . 1 . 407 . . 38 ASP CA . 25213 1
469 . 1 1 38 38 ASP CB C 13 40.290 0.10 . 1 . 410 . . 38 ASP CB . 25213 1
470 . 1 1 38 38 ASP N N 15 119.710 0.10 . 1 . 405 . . 38 ASP N . 25213 1
471 . 1 1 39 39 GLU H H 1 8.032 0.01 . 1 . 414 . . 39 GLU H . 25213 1
472 . 1 1 39 39 GLU HA H 1 4.053 0.01 . 1 . 416 . . 39 GLU HA . 25213 1
473 . 1 1 39 39 GLU HB2 H 1 2.097 0.01 . 1 . 419 . . 39 GLU HB2 . 25213 1
474 . 1 1 39 39 GLU HB3 H 1 2.200 0.01 . 1 . 420 . . 39 GLU HB3 . 25213 1
475 . 1 1 39 39 GLU HG2 H 1 2.258 0.01 . 2 . 421 . . 39 GLU HG2 . 25213 1
476 . 1 1 39 39 GLU HG3 H 1 2.525 0.01 . 2 . 422 . . 39 GLU HG3 . 25213 1
477 . 1 1 39 39 GLU C C 13 179.220 0.10 . 1 . 417 . . 39 GLU C . 25213 1
478 . 1 1 39 39 GLU CA C 13 59.150 0.10 . 1 . 415 . . 39 GLU CA . 25213 1
479 . 1 1 39 39 GLU CB C 13 30.380 0.10 . 1 . 418 . . 39 GLU CB . 25213 1
480 . 1 1 39 39 GLU N N 15 119.210 0.10 . 1 . 413 . . 39 GLU N . 25213 1
481 . 1 1 40 40 GLU H H 1 8.120 0.01 . 1 . 424 . . 40 GLU H . 25213 1
482 . 1 1 40 40 GLU HA H 1 4.184 0.01 . 1 . 426 . . 40 GLU HA . 25213 1
483 . 1 1 40 40 GLU HB2 H 1 2.084 0.01 . 1 . 429 . . 40 GLU HB2 . 25213 1
484 . 1 1 40 40 GLU HB3 H 1 2.084 0.01 . 1 . 430 . . 40 GLU HB3 . 25213 1
485 . 1 1 40 40 GLU HG2 H 1 2.275 0.01 . 2 . 431 . . 40 GLU HG2 . 25213 1
486 . 1 1 40 40 GLU HG3 H 1 2.474 0.01 . 2 . 432 . . 40 GLU HG3 . 25213 1
487 . 1 1 40 40 GLU C C 13 178.440 0.10 . 1 . 427 . . 40 GLU C . 25213 1
488 . 1 1 40 40 GLU CA C 13 58.350 0.10 . 1 . 425 . . 40 GLU CA . 25213 1
489 . 1 1 40 40 GLU CB C 13 30.530 0.10 . 1 . 428 . . 40 GLU CB . 25213 1
490 . 1 1 40 40 GLU N N 15 119.010 0.10 . 1 . 423 . . 40 GLU N . 25213 1
491 . 1 1 41 41 SER H H 1 8.129 0.01 . 1 . 434 . . 41 SER H . 25213 1
492 . 1 1 41 41 SER HA H 1 4.393 0.01 . 1 . 436 . . 41 SER HA . 25213 1
493 . 1 1 41 41 SER HB2 H 1 3.926 0.01 . 2 . 439 . . 41 SER HB2 . 25213 1
494 . 1 1 41 41 SER HB3 H 1 3.946 0.01 . 2 . 440 . . 41 SER HB3 . 25213 1
495 . 1 1 41 41 SER C C 13 175.700 0.10 . 1 . 437 . . 41 SER C . 25213 1
496 . 1 1 41 41 SER CA C 13 59.850 0.10 . 1 . 435 . . 41 SER CA . 25213 1
497 . 1 1 41 41 SER CB C 13 64.160 0.10 . 1 . 438 . . 41 SER CB . 25213 1
498 . 1 1 41 41 SER N N 15 115.170 0.10 . 1 . 433 . . 41 SER N . 25213 1
499 . 1 1 42 42 LYS H H 1 7.980 0.01 . 1 . 442 . . 42 LYS H . 25213 1
500 . 1 1 42 42 LYS HA H 1 4.299 0.01 . 1 . 444 . . 42 LYS HA . 25213 1
501 . 1 1 42 42 LYS HB2 H 1 1.885 0.01 . 2 . 447 . . 42 LYS HB2 . 25213 1
502 . 1 1 42 42 LYS HB3 H 1 1.820 0.01 . 2 . 448 . . 42 LYS HB3 . 25213 1
503 . 1 1 42 42 LYS HG2 H 1 1.481 0.01 . 2 . 449 . . 42 LYS HG2 . 25213 1
504 . 1 1 42 42 LYS HG3 H 1 1.432 0.01 . 2 . 450 . . 42 LYS HG3 . 25213 1
505 . 1 1 42 42 LYS HD2 H 1 1.653 0.01 . 1 . 451 . . 42 LYS HD2 . 25213 1
506 . 1 1 42 42 LYS HD3 H 1 1.653 0.01 . 1 . 452 . . 42 LYS HD3 . 25213 1
507 . 1 1 42 42 LYS HE2 H 1 2.962 0.01 . 1 . 453 . . 42 LYS HE2 . 25213 1
508 . 1 1 42 42 LYS HE3 H 1 2.962 0.01 . 1 . 454 . . 42 LYS HE3 . 25213 1
509 . 1 1 42 42 LYS C C 13 177.900 0.10 . 1 . 445 . . 42 LYS C . 25213 1
510 . 1 1 42 42 LYS CA C 13 57.400 0.10 . 1 . 443 . . 42 LYS CA . 25213 1
511 . 1 1 42 42 LYS CB C 13 33.230 0.10 . 1 . 446 . . 42 LYS CB . 25213 1
512 . 1 1 42 42 LYS N N 15 122.220 0.10 . 1 . 441 . . 42 LYS N . 25213 1
513 . 1 1 43 43 GLY H H 1 8.242 0.01 . 1 . 456 . . 43 GLY H . 25213 1
514 . 1 1 43 43 GLY HA2 H 1 3.922 0.01 . 2 . 458 . . 43 GLY HA2 . 25213 1
515 . 1 1 43 43 GLY HA3 H 1 3.950 0.01 . 2 . 459 . . 43 GLY HA3 . 25213 1
516 . 1 1 43 43 GLY C C 13 174.940 0.10 . 1 . 460 . . 43 GLY C . 25213 1
517 . 1 1 43 43 GLY CA C 13 45.990 0.10 . 1 . 457 . . 43 GLY CA . 25213 1
518 . 1 1 43 43 GLY N N 15 108.750 0.10 . 1 . 455 . . 43 GLY N . 25213 1
519 . 1 1 44 44 GLU H H 1 8.286 0.01 . 1 . 462 . . 44 GLU H . 25213 1
520 . 1 1 44 44 GLU HA H 1 4.301 0.01 . 1 . 464 . . 44 GLU HA . 25213 1
521 . 1 1 44 44 GLU HB2 H 1 1.894 0.01 . 2 . 467 . . 44 GLU HB2 . 25213 1
522 . 1 1 44 44 GLU HB3 H 1 2.044 0.01 . 2 . 468 . . 44 GLU HB3 . 25213 1
523 . 1 1 44 44 GLU HG2 H 1 2.215 0.01 . 2 . 469 . . 44 GLU HG2 . 25213 1
524 . 1 1 44 44 GLU HG3 H 1 2.245 0.01 . 2 . 470 . . 44 GLU HG3 . 25213 1
525 . 1 1 44 44 GLU C C 13 177.230 0.10 . 1 . 465 . . 44 GLU C . 25213 1
526 . 1 1 44 44 GLU CA C 13 57.020 0.10 . 1 . 463 . . 44 GLU CA . 25213 1
527 . 1 1 44 44 GLU CB C 13 30.800 0.10 . 1 . 466 . . 44 GLU CB . 25213 1
528 . 1 1 44 44 GLU N N 15 120.390 0.10 . 1 . 461 . . 44 GLU N . 25213 1
529 . 1 1 45 45 SER H H 1 8.330 0.01 . 1 . 472 . . 45 SER H . 25213 1
530 . 1 1 45 45 SER HA H 1 4.408 0.01 . 1 . 474 . . 45 SER HA . 25213 1
531 . 1 1 45 45 SER HB2 H 1 3.820 0.01 . 1 . 477 . . 45 SER HB2 . 25213 1
532 . 1 1 45 45 SER HB3 H 1 3.820 0.01 . 1 . 478 . . 45 SER HB3 . 25213 1
533 . 1 1 45 45 SER C C 13 174.960 0.10 . 1 . 475 . . 45 SER C . 25213 1
534 . 1 1 45 45 SER CA C 13 59.090 0.10 . 1 . 473 . . 45 SER CA . 25213 1
535 . 1 1 45 45 SER CB C 13 64.440 0.10 . 1 . 476 . . 45 SER CB . 25213 1
536 . 1 1 45 45 SER N N 15 116.340 0.10 . 1 . 471 . . 45 SER N . 25213 1
537 . 1 1 46 46 GLU H H 1 8.409 0.01 . 1 . 480 . . 46 GLU H . 25213 1
538 . 1 1 46 46 GLU HA H 1 4.287 0.01 . 1 . 482 . . 46 GLU HA . 25213 1
539 . 1 1 46 46 GLU HB2 H 1 1.894 0.01 . 2 . 485 . . 46 GLU HB2 . 25213 1
540 . 1 1 46 46 GLU HB3 H 1 2.000 0.01 . 2 . 486 . . 46 GLU HB3 . 25213 1
541 . 1 1 46 46 GLU HG2 H 1 2.180 0.01 . 2 . 487 . . 46 GLU HG2 . 25213 1
542 . 1 1 46 46 GLU HG3 H 1 2.229 0.01 . 2 . 488 . . 46 GLU HG3 . 25213 1
543 . 1 1 46 46 GLU C C 13 176.630 0.10 . 1 . 483 . . 46 GLU C . 25213 1
544 . 1 1 46 46 GLU CA C 13 57.020 0.10 . 1 . 481 . . 46 GLU CA . 25213 1
545 . 1 1 46 46 GLU CB C 13 30.810 0.10 . 1 . 484 . . 46 GLU CB . 25213 1
546 . 1 1 46 46 GLU N N 15 122.780 0.10 . 1 . 479 . . 46 GLU N . 25213 1
547 . 1 1 47 47 VAL H H 1 8.160 0.01 . 1 . 490 . . 47 VAL H . 25213 1
548 . 1 1 47 47 VAL HA H 1 4.093 0.01 . 1 . 492 . . 47 VAL HA . 25213 1
549 . 1 1 47 47 VAL HB H 1 2.005 0.01 . 1 . 495 . . 47 VAL HB . 25213 1
550 . 1 1 47 47 VAL HG11 H 1 0.872 0.01 . 2 . 497 . . 47 VAL HG11 . 25213 1
551 . 1 1 47 47 VAL HG12 H 1 0.872 0.01 . 2 . 497 . . 47 VAL HG12 . 25213 1
552 . 1 1 47 47 VAL HG13 H 1 0.872 0.01 . 2 . 497 . . 47 VAL HG13 . 25213 1
553 . 1 1 47 47 VAL HG21 H 1 0.880 0.01 . 2 . 499 . . 47 VAL HG21 . 25213 1
554 . 1 1 47 47 VAL HG22 H 1 0.880 0.01 . 2 . 499 . . 47 VAL HG22 . 25213 1
555 . 1 1 47 47 VAL HG23 H 1 0.880 0.01 . 2 . 499 . . 47 VAL HG23 . 25213 1
556 . 1 1 47 47 VAL C C 13 176.660 0.10 . 1 . 493 . . 47 VAL C . 25213 1
557 . 1 1 47 47 VAL CA C 13 62.530 0.10 . 1 . 491 . . 47 VAL CA . 25213 1
558 . 1 1 47 47 VAL CB C 13 33.290 0.10 . 1 . 494 . . 47 VAL CB . 25213 1
559 . 1 1 47 47 VAL CG1 C 13 19.190 0.10 . 2 . 496 . . 47 VAL CG1 . 25213 1
560 . 1 1 47 47 VAL CG2 C 13 18.560 0.10 . 2 . 498 . . 47 VAL CG2 . 25213 1
561 . 1 1 47 47 VAL N N 15 121.160 0.10 . 1 . 489 . . 47 VAL N . 25213 1
562 . 1 1 48 48 SER H H 1 8.444 0.01 . 1 . 501 . . 48 SER H . 25213 1
563 . 1 1 48 48 SER HA H 1 4.720 0.01 . 1 . 503 . . 48 SER HA . 25213 1
564 . 1 1 48 48 SER HB2 H 1 3.751 0.01 . 2 . 505 . . 48 SER HB2 . 25213 1
565 . 1 1 48 48 SER HB3 H 1 3.842 0.01 . 2 . 506 . . 48 SER HB3 . 25213 1
566 . 1 1 48 48 SER CA C 13 56.920 0.10 . 1 . 502 . . 48 SER CA . 25213 1
567 . 1 1 48 48 SER CB C 13 63.860 0.10 . 1 . 504 . . 48 SER CB . 25213 1
568 . 1 1 48 48 SER N N 15 121.350 0.10 . 1 . 500 . . 48 SER N . 25213 1
569 . 1 1 49 49 PRO HA H 1 4.394 0.01 . 1 . 508 . . 49 PRO HA . 25213 1
570 . 1 1 49 49 PRO HB2 H 1 1.933 0.01 . 2 . 511 . . 49 PRO HB2 . 25213 1
571 . 1 1 49 49 PRO HB3 H 1 2.241 0.01 . 2 . 512 . . 49 PRO HB3 . 25213 1
572 . 1 1 49 49 PRO HG2 H 1 1.970 0.01 . 1 . 513 . . 49 PRO HG2 . 25213 1
573 . 1 1 49 49 PRO HG3 H 1 1.970 0.01 . 1 . 514 . . 49 PRO HG3 . 25213 1
574 . 1 1 49 49 PRO HD2 H 1 3.689 0.01 . 2 . 515 . . 49 PRO HD2 . 25213 1
575 . 1 1 49 49 PRO HD3 H 1 3.790 0.01 . 2 . 516 . . 49 PRO HD3 . 25213 1
576 . 1 1 49 49 PRO C C 13 176.720 0.10 . 1 . 509 . . 49 PRO C . 25213 1
577 . 1 1 49 49 PRO CA C 13 64.010 0.10 . 1 . 507 . . 49 PRO CA . 25213 1
578 . 1 1 49 49 PRO CB C 13 32.600 0.10 . 1 . 510 . . 49 PRO CB . 25213 1
579 . 1 1 50 50 GLN H H 1 7.970 0.01 . 1 . 518 . . 50 GLN H . 25213 1
580 . 1 1 50 50 GLN HA H 1 4.090 0.01 . 1 . 520 . . 50 GLN HA . 25213 1
581 . 1 1 50 50 GLN HB2 H 1 1.849 0.01 . 2 . 522 . . 50 GLN HB2 . 25213 1
582 . 1 1 50 50 GLN HB3 H 1 2.061 0.01 . 2 . 523 . . 50 GLN HB3 . 25213 1
583 . 1 1 50 50 GLN HG2 H 1 2.271 0.01 . 1 . 524 . . 50 GLN HG2 . 25213 1
584 . 1 1 50 50 GLN HG3 H 1 2.271 0.01 . 1 . 525 . . 50 GLN HG3 . 25213 1
585 . 1 1 50 50 GLN HE21 H 1 6.784 0.01 . 1 . 526 . . 50 GLN HE21 . 25213 1
586 . 1 1 50 50 GLN HE22 H 1 7.514 0.01 . 1 . 527 . . 50 GLN HE22 . 25213 1
587 . 1 1 50 50 GLN CA C 13 57.870 0.10 . 1 . 519 . . 50 GLN CA . 25213 1
588 . 1 1 50 50 GLN CB C 13 31.120 0.10 . 1 . 521 . . 50 GLN CB . 25213 1
589 . 1 1 50 50 GLN N N 15 125.340 0.10 . 1 . 517 . . 50 GLN N . 25213 1
stop_
save_