Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 51850
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'Assigned Chemical shift list for major conformer of MazE9_CTD'
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
2 '2D 1H-15N HSQC' . . . 51850 1
3 '3D HNCACB' . . . 51850 1
4 '3D CBCA(CO)NH' . . . 51850 1
5 '3D CC(CO)NH-TOCSY' . . . 51850 1
6 '3D HNCO' . . . 51850 1
7 '3D HN(CA)CO' . . . 51850 1
8 '2D 1H-13C HSQC' . . . 51850 1
9 '3D HC(CO)NH' . . . 51850 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
2 $software_2 . . 51850 1
3 $software_3 . . 51850 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 3 3 PRO HA H 1 4.337 0.001 . 1 . . . . . 44 PRO HA . 51850 1
2 . 1 . 1 3 3 PRO HB2 H 1 2.119 0.001 . 1 . . . . . 44 PRO HB2 . 51850 1
3 . 1 . 1 3 3 PRO HB3 H 1 2.119 0.001 . 1 . . . . . 44 PRO HB3 . 51850 1
4 . 1 . 1 3 3 PRO HG2 H 1 1.843 0.003 . 2 . . . . . 44 PRO HG2 . 51850 1
5 . 1 . 1 3 3 PRO HG3 H 1 1.762 0.003 . 2 . . . . . 44 PRO HG3 . 51850 1
6 . 1 . 1 3 3 PRO HD2 H 1 3.565 0.000 . 2 . . . . . 44 PRO HD2 . 51850 1
7 . 1 . 1 3 3 PRO HD3 H 1 3.641 0.000 . 2 . . . . . 44 PRO HD3 . 51850 1
8 . 1 . 1 3 3 PRO C C 13 176.855 0.001 . 1 . . . . . 44 PRO C . 51850 1
9 . 1 . 1 3 3 PRO CA C 13 63.385 0.021 . 1 . . . . . 44 PRO CA . 51850 1
10 . 1 . 1 3 3 PRO CB C 13 31.999 0.053 . 1 . . . . . 44 PRO CB . 51850 1
11 . 1 . 1 3 3 PRO CG C 13 27.215 0.006 . 1 . . . . . 44 PRO CG . 51850 1
12 . 1 . 1 3 3 PRO CD C 13 50.689 0.041 . 1 . . . . . 44 PRO CD . 51850 1
13 . 1 . 1 4 4 THR H H 1 8.077 0.001 . 1 . . . . . 45 THR H . 51850 1
14 . 1 . 1 4 4 THR HA H 1 4.156 0.000 . 1 . . . . . 45 THR HA . 51850 1
15 . 1 . 1 4 4 THR HB H 1 4.057 0.000 . 1 . . . . . 45 THR HB . 51850 1
16 . 1 . 1 4 4 THR HG21 H 1 1.027 0.002 . 1 . . . . . 45 THR HG21 . 51850 1
17 . 1 . 1 4 4 THR HG22 H 1 1.027 0.002 . 1 . . . . . 45 THR HG22 . 51850 1
18 . 1 . 1 4 4 THR HG23 H 1 1.027 0.002 . 1 . . . . . 45 THR HG23 . 51850 1
19 . 1 . 1 4 4 THR C C 13 174.383 0.005 . 1 . . . . . 45 THR C . 51850 1
20 . 1 . 1 4 4 THR CA C 13 61.509 0.015 . 1 . . . . . 45 THR CA . 51850 1
21 . 1 . 1 4 4 THR CB C 13 69.783 0.079 . 1 . . . . . 45 THR CB . 51850 1
22 . 1 . 1 4 4 THR CG2 C 13 21.610 0.010 . 1 . . . . . 45 THR CG2 . 51850 1
23 . 1 . 1 4 4 THR N N 15 114.066 0.007 . 1 . . . . . 45 THR N . 51850 1
24 . 1 . 1 5 5 LEU H H 1 8.103 0.001 . 1 . . . . . 46 LEU H . 51850 1
25 . 1 . 1 5 5 LEU HA H 1 4.179 0.001 . 1 . . . . . 46 LEU HA . 51850 1
26 . 1 . 1 5 5 LEU HB2 H 1 1.476 0.000 . 2 . . . . . 46 LEU HB2 . 51850 1
27 . 1 . 1 5 5 LEU HB3 H 1 1.421 0.000 . 2 . . . . . 46 LEU HB3 . 51850 1
28 . 1 . 1 5 5 LEU HG H 1 1.442 0.003 . 1 . . . . . 46 LEU HG . 51850 1
29 . 1 . 1 5 5 LEU HD11 H 1 0.682 0.000 . 2 . . . . . 46 LEU HD11 . 51850 1
30 . 1 . 1 5 5 LEU HD12 H 1 0.682 0.000 . 2 . . . . . 46 LEU HD12 . 51850 1
31 . 1 . 1 5 5 LEU HD13 H 1 0.682 0.000 . 2 . . . . . 46 LEU HD13 . 51850 1
32 . 1 . 1 5 5 LEU HD21 H 1 0.736 0.000 . 2 . . . . . 46 LEU HD21 . 51850 1
33 . 1 . 1 5 5 LEU HD22 H 1 0.736 0.000 . 2 . . . . . 46 LEU HD22 . 51850 1
34 . 1 . 1 5 5 LEU HD23 H 1 0.736 0.000 . 2 . . . . . 46 LEU HD23 . 51850 1
35 . 1 . 1 5 5 LEU C C 13 177.265 0.001 . 1 . . . . . 46 LEU C . 51850 1
36 . 1 . 1 5 5 LEU CA C 13 55.254 0.015 . 1 . . . . . 46 LEU CA . 51850 1
37 . 1 . 1 5 5 LEU CB C 13 42.134 0.016 . 1 . . . . . 46 LEU CB . 51850 1
38 . 1 . 1 5 5 LEU CG C 13 26.911 0.091 . 1 . . . . . 46 LEU CG . 51850 1
39 . 1 . 1 5 5 LEU CD1 C 13 23.317 0.034 . 2 . . . . . 46 LEU CD1 . 51850 1
40 . 1 . 1 5 5 LEU CD2 C 13 24.751 0.030 . 2 . . . . . 46 LEU CD2 . 51850 1
41 . 1 . 1 5 5 LEU N N 15 124.084 0.011 . 1 . . . . . 46 LEU N . 51850 1
42 . 1 . 1 6 6 GLU H H 1 8.215 0.001 . 1 . . . . . 47 GLU H . 51850 1
43 . 1 . 1 6 6 GLU HA H 1 4.044 0.000 . 1 . . . . . 47 GLU HA . 51850 1
44 . 1 . 1 6 6 GLU HB2 H 1 2.083 0.005 . 2 . . . . . 47 GLU HB2 . 51850 1
45 . 1 . 1 6 6 GLU HB3 H 1 1.734 0.004 . 2 . . . . . 47 GLU HB3 . 51850 1
46 . 1 . 1 6 6 GLU HG2 H 1 2.085 0.003 . 1 . . . . . 47 GLU HG2 . 51850 1
47 . 1 . 1 6 6 GLU HG3 H 1 2.085 0.003 . 1 . . . . . 47 GLU HG3 . 51850 1
48 . 1 . 1 6 6 GLU C C 13 176.319 0.069 . 1 . . . . . 47 GLU C . 51850 1
49 . 1 . 1 6 6 GLU CA C 13 56.765 0.025 . 1 . . . . . 47 GLU CA . 51850 1
50 . 1 . 1 6 6 GLU CB C 13 30.069 0.030 . 1 . . . . . 47 GLU CB . 51850 1
51 . 1 . 1 6 6 GLU CG C 13 36.249 0.007 . 1 . . . . . 47 GLU CG . 51850 1
52 . 1 . 1 6 6 GLU N N 15 120.870 0.017 . 1 . . . . . 47 GLU N . 51850 1
53 . 1 . 1 7 7 ASP H H 1 8.028 0.001 . 1 . . . . . 48 ASP H . 51850 1
54 . 1 . 1 7 7 ASP HA H 1 4.344 0.000 . 1 . . . . . 48 ASP HA . 51850 1
55 . 1 . 1 7 7 ASP HB2 H 1 2.435 0.000 . 1 . . . . . 48 ASP HB2 . 51850 1
56 . 1 . 1 7 7 ASP HB3 H 1 2.435 0.000 . 1 . . . . . 48 ASP HB3 . 51850 1
57 . 1 . 1 7 7 ASP C C 13 175.925 0.001 . 1 . . . . . 48 ASP C . 51850 1
58 . 1 . 1 7 7 ASP CA C 13 54.561 0.000 . 1 . . . . . 48 ASP CA . 51850 1
59 . 1 . 1 7 7 ASP CB C 13 41.084 0.000 . 1 . . . . . 48 ASP CB . 51850 1
60 . 1 . 1 7 7 ASP N N 15 120.584 0.042 . 1 . . . . . 48 ASP N . 51850 1
61 . 1 . 1 8 8 ASP H H 1 8.040 0.001 . 1 . . . . . 49 ASP H . 51850 1
62 . 1 . 1 8 8 ASP HA H 1 4.347 0.000 . 1 . . . . . 49 ASP HA . 51850 1
63 . 1 . 1 8 8 ASP HB2 H 1 2.406 0.000 . 1 . . . . . 49 ASP HB2 . 51850 1
64 . 1 . 1 8 8 ASP HB3 H 1 2.406 0.000 . 1 . . . . . 49 ASP HB3 . 51850 1
65 . 1 . 1 8 8 ASP C C 13 176.487 0.036 . 1 . . . . . 49 ASP C . 51850 1
66 . 1 . 1 8 8 ASP CA C 13 54.478 0.002 . 1 . . . . . 49 ASP CA . 51850 1
67 . 1 . 1 8 8 ASP CB C 13 40.869 0.004 . 1 . . . . . 49 ASP CB . 51850 1
68 . 1 . 1 8 8 ASP N N 15 120.363 0.016 . 1 . . . . . 49 ASP N . 51850 1
69 . 1 . 1 9 9 TYR H H 1 7.923 0.001 . 1 . . . . . 50 TYR H . 51850 1
70 . 1 . 1 9 9 TYR HA H 1 4.268 0.002 . 1 . . . . . 50 TYR HA . 51850 1
71 . 1 . 1 9 9 TYR HB2 H 1 2.810 0.001 . 2 . . . . . 50 TYR HB2 . 51850 1
72 . 1 . 1 9 9 TYR HB3 H 1 2.921 0.001 . 2 . . . . . 50 TYR HB3 . 51850 1
73 . 1 . 1 9 9 TYR C C 13 176.102 0.016 . 1 . . . . . 50 TYR C . 51850 1
74 . 1 . 1 9 9 TYR CA C 13 58.374 0.016 . 1 . . . . . 50 TYR CA . 51850 1
75 . 1 . 1 9 9 TYR CB C 13 38.071 0.015 . 1 . . . . . 50 TYR CB . 51850 1
76 . 1 . 1 9 9 TYR N N 15 120.373 0.024 . 1 . . . . . 50 TYR N . 51850 1
77 . 1 . 1 10 10 ALA H H 1 7.880 0.001 . 1 . . . . . 51 ALA H . 51850 1
78 . 1 . 1 10 10 ALA HA H 1 4.003 0.001 . 1 . . . . . 51 ALA HA . 51850 1
79 . 1 . 1 10 10 ALA HB1 H 1 1.180 0.000 . 1 . . . . . 51 ALA HB1 . 51850 1
80 . 1 . 1 10 10 ALA HB2 H 1 1.180 0.000 . 1 . . . . . 51 ALA HB2 . 51850 1
81 . 1 . 1 10 10 ALA HB3 H 1 1.180 0.000 . 1 . . . . . 51 ALA HB3 . 51850 1
82 . 1 . 1 10 10 ALA C C 13 177.642 0.006 . 1 . . . . . 51 ALA C . 51850 1
83 . 1 . 1 10 10 ALA CA C 13 53.150 0.004 . 1 . . . . . 51 ALA CA . 51850 1
84 . 1 . 1 10 10 ALA CB C 13 18.814 0.030 . 1 . . . . . 51 ALA CB . 51850 1
85 . 1 . 1 10 10 ALA N N 15 123.652 0.015 . 1 . . . . . 51 ALA N . 51850 1
86 . 1 . 1 11 11 ASN H H 1 7.909 0.001 . 1 . . . . . 52 ASN H . 51850 1
87 . 1 . 1 11 11 ASN HA H 1 4.442 0.000 . 1 . . . . . 52 ASN HA . 51850 1
88 . 1 . 1 11 11 ASN HB2 H 1 2.474 0.000 . 2 . . . . . 52 ASN HB2 . 51850 1
89 . 1 . 1 11 11 ASN HB3 H 1 2.519 0.000 . 2 . . . . . 52 ASN HB3 . 51850 1
90 . 1 . 1 11 11 ASN HD21 H 1 7.477 0.002 . 1 . . . . . 52 ASN HD21 . 51850 1
91 . 1 . 1 11 11 ASN HD22 H 1 6.723 0.002 . 1 . . . . . 52 ASN HD22 . 51850 1
92 . 1 . 1 11 11 ASN C C 13 175.135 0.013 . 1 . . . . . 52 ASN C . 51850 1
93 . 1 . 1 11 11 ASN CA C 13 53.179 0.077 . 1 . . . . . 52 ASN CA . 51850 1
94 . 1 . 1 11 11 ASN CB C 13 38.714 0.029 . 1 . . . . . 52 ASN CB . 51850 1
95 . 1 . 1 11 11 ASN CG C 13 176.851 0.001 . 1 . . . . . 52 ASN CG . 51850 1
96 . 1 . 1 11 11 ASN N N 15 116.319 0.021 . 1 . . . . . 52 ASN N . 51850 1
97 . 1 . 1 11 11 ASN ND2 N 15 112.679 0.064 . 1 . . . . . 52 ASN ND2 . 51850 1
98 . 1 . 1 12 12 ALA H H 1 7.852 0.002 . 1 . . . . . 53 ALA H . 51850 1
99 . 1 . 1 12 12 ALA HA H 1 4.057 0.000 . 1 . . . . . 53 ALA HA . 51850 1
100 . 1 . 1 12 12 ALA HB1 H 1 1.121 0.005 . 1 . . . . . 53 ALA HB1 . 51850 1
101 . 1 . 1 12 12 ALA HB2 H 1 1.121 0.005 . 1 . . . . . 53 ALA HB2 . 51850 1
102 . 1 . 1 12 12 ALA HB3 H 1 1.121 0.005 . 1 . . . . . 53 ALA HB3 . 51850 1
103 . 1 . 1 12 12 ALA C C 13 177.438 0.005 . 1 . . . . . 53 ALA C . 51850 1
104 . 1 . 1 12 12 ALA CA C 13 52.929 0.025 . 1 . . . . . 53 ALA CA . 51850 1
105 . 1 . 1 12 12 ALA CB C 13 18.786 0.049 . 1 . . . . . 53 ALA CB . 51850 1
106 . 1 . 1 12 12 ALA N N 15 123.672 0.020 . 1 . . . . . 53 ALA N . 51850 1
107 . 1 . 1 13 13 TRP H H 1 7.809 0.001 . 1 . . . . . 54 TRP H . 51850 1
108 . 1 . 1 13 13 TRP HA H 1 4.300 0.004 . 1 . . . . . 54 TRP HA . 51850 1
109 . 1 . 1 13 13 TRP HB2 H 1 3.049 0.000 . 1 . . . . . 54 TRP HB2 . 51850 1
110 . 1 . 1 13 13 TRP HB3 H 1 3.049 0.000 . 1 . . . . . 54 TRP HB3 . 51850 1
111 . 1 . 1 13 13 TRP C C 13 176.166 0.003 . 1 . . . . . 54 TRP C . 51850 1
112 . 1 . 1 13 13 TRP CA C 13 57.444 0.020 . 1 . . . . . 54 TRP CA . 51850 1
113 . 1 . 1 13 13 TRP CB C 13 28.988 0.032 . 1 . . . . . 54 TRP CB . 51850 1
114 . 1 . 1 13 13 TRP N N 15 119.337 0.015 . 1 . . . . . 54 TRP N . 51850 1
115 . 1 . 1 14 14 GLN H H 1 7.613 0.001 . 1 . . . . . 55 GLN H . 51850 1
116 . 1 . 1 14 14 GLN HA H 1 3.874 0.001 . 1 . . . . . 55 GLN HA . 51850 1
117 . 1 . 1 14 14 GLN HB2 H 1 1.494 0.000 . 2 . . . . . 55 GLN HB2 . 51850 1
118 . 1 . 1 14 14 GLN HB3 H 1 1.578 0.000 . 2 . . . . . 55 GLN HB3 . 51850 1
119 . 1 . 1 14 14 GLN HG2 H 1 1.768 0.000 . 2 . . . . . 55 GLN HG2 . 51850 1
120 . 1 . 1 14 14 GLN HG3 H 1 1.840 0.000 . 2 . . . . . 55 GLN HG3 . 51850 1
121 . 1 . 1 14 14 GLN HE21 H 1 7.128 0.001 . 1 . . . . . 55 GLN HE21 . 51850 1
122 . 1 . 1 14 14 GLN HE22 H 1 6.588 0.002 . 1 . . . . . 55 GLN HE22 . 51850 1
123 . 1 . 1 14 14 GLN C C 13 175.446 0.038 . 1 . . . . . 55 GLN C . 51850 1
124 . 1 . 1 14 14 GLN CA C 13 55.740 0.017 . 1 . . . . . 55 GLN CA . 51850 1
125 . 1 . 1 14 14 GLN CB C 13 29.296 0.065 . 1 . . . . . 55 GLN CB . 51850 1
126 . 1 . 1 14 14 GLN CG C 13 33.256 0.033 . 1 . . . . . 55 GLN CG . 51850 1
127 . 1 . 1 14 14 GLN CD C 13 180.209 0.006 . 1 . . . . . 55 GLN CD . 51850 1
128 . 1 . 1 14 14 GLN N N 15 121.598 0.015 . 1 . . . . . 55 GLN N . 51850 1
129 . 1 . 1 14 14 GLN NE2 N 15 111.318 0.062 . 1 . . . . . 55 GLN NE2 . 51850 1
130 . 1 . 1 15 15 GLU H H 1 7.928 0.002 . 1 . . . . . 56 GLU H . 51850 1
131 . 1 . 1 15 15 GLU HA H 1 3.889 0.005 . 1 . . . . . 56 GLU HA . 51850 1
132 . 1 . 1 15 15 GLU HB2 H 1 1.693 0.019 . 2 . . . . . 56 GLU HB2 . 51850 1
133 . 1 . 1 15 15 GLU HB3 H 1 2.004 0.000 . 2 . . . . . 56 GLU HB3 . 51850 1
134 . 1 . 1 15 15 GLU HG2 H 1 2.011 0.000 . 2 . . . . . 56 GLU HG2 . 51850 1
135 . 1 . 1 15 15 GLU HG3 H 1 1.950 0.000 . 2 . . . . . 56 GLU HG3 . 51850 1
136 . 1 . 1 15 15 GLU C C 13 176.182 0.008 . 1 . . . . . 56 GLU C . 51850 1
137 . 1 . 1 15 15 GLU CA C 13 56.619 0.054 . 1 . . . . . 56 GLU CA . 51850 1
138 . 1 . 1 15 15 GLU CB C 13 29.957 0.112 . 1 . . . . . 56 GLU CB . 51850 1
139 . 1 . 1 15 15 GLU CG C 13 36.017 0.002 . 1 . . . . . 56 GLU CG . 51850 1
140 . 1 . 1 15 15 GLU N N 15 121.152 0.016 . 1 . . . . . 56 GLU N . 51850 1
141 . 1 . 1 16 16 TRP H H 1 7.865 0.001 . 1 . . . . . 57 TRP H . 51850 1
142 . 1 . 1 16 16 TRP HA H 1 4.431 0.003 . 1 . . . . . 57 TRP HA . 51850 1
143 . 1 . 1 16 16 TRP HB2 H 1 3.080 0.002 . 1 . . . . . 57 TRP HB2 . 51850 1
144 . 1 . 1 16 16 TRP HB3 H 1 3.080 0.002 . 1 . . . . . 57 TRP HB3 . 51850 1
145 . 1 . 1 16 16 TRP HE1 H 1 9.895 0.000 . 1 . . . . . 57 TRP HE1 . 51850 1
146 . 1 . 1 16 16 TRP C C 13 176.152 0.017 . 1 . . . . . 57 TRP C . 51850 1
147 . 1 . 1 16 16 TRP CA C 13 57.332 0.062 . 1 . . . . . 57 TRP CA . 51850 1
148 . 1 . 1 16 16 TRP CB C 13 29.451 0.058 . 1 . . . . . 57 TRP CB . 51850 1
149 . 1 . 1 16 16 TRP N N 15 121.539 0.031 . 1 . . . . . 57 TRP N . 51850 1
150 . 1 . 1 16 16 TRP NE1 N 15 129.033 0.125 . 1 . . . . . 57 TRP NE1 . 51850 1
151 . 1 . 1 17 17 SER H H 1 7.720 0.001 . 1 . . . . . 58 SER H . 51850 1
152 . 1 . 1 17 17 SER HA H 1 4.071 0.003 . 1 . . . . . 58 SER HA . 51850 1
153 . 1 . 1 17 17 SER HB2 H 1 3.514 0.000 . 2 . . . . . 58 SER HB2 . 51850 1
154 . 1 . 1 17 17 SER HB3 H 1 3.453 0.000 . 2 . . . . . 58 SER HB3 . 51850 1
155 . 1 . 1 17 17 SER C C 13 173.696 0.018 . 1 . . . . . 58 SER C . 51850 1
156 . 1 . 1 17 17 SER CA C 13 57.914 0.042 . 1 . . . . . 58 SER CA . 51850 1
157 . 1 . 1 17 17 SER CB C 13 63.831 0.045 . 1 . . . . . 58 SER CB . 51850 1
158 . 1 . 1 17 17 SER N N 15 117.407 0.063 . 1 . . . . . 58 SER N . 51850 1
159 . 1 . 1 18 18 ALA H H 1 7.922 0.001 . 1 . . . . . 59 ALA H . 51850 1
160 . 1 . 1 18 18 ALA HA H 1 4.007 0.000 . 1 . . . . . 59 ALA HA . 51850 1
161 . 1 . 1 18 18 ALA HB1 H 1 1.185 0.001 . 1 . . . . . 59 ALA HB1 . 51850 1
162 . 1 . 1 18 18 ALA HB2 H 1 1.185 0.001 . 1 . . . . . 59 ALA HB2 . 51850 1
163 . 1 . 1 18 18 ALA HB3 H 1 1.185 0.001 . 1 . . . . . 59 ALA HB3 . 51850 1
164 . 1 . 1 18 18 ALA C C 13 177.392 0.015 . 1 . . . . . 59 ALA C . 51850 1
165 . 1 . 1 18 18 ALA CA C 13 52.389 0.024 . 1 . . . . . 59 ALA CA . 51850 1
166 . 1 . 1 18 18 ALA CB C 13 18.988 0.047 . 1 . . . . . 59 ALA CB . 51850 1
167 . 1 . 1 18 18 ALA N N 15 125.858 0.014 . 1 . . . . . 59 ALA N . 51850 1
168 . 1 . 1 19 19 ALA H H 1 7.961 0.002 . 1 . . . . . 60 ALA H . 51850 1
169 . 1 . 1 19 19 ALA HA H 1 4.078 0.002 . 1 . . . . . 60 ALA HA . 51850 1
170 . 1 . 1 19 19 ALA HB1 H 1 1.194 0.000 . 1 . . . . . 60 ALA HB1 . 51850 1
171 . 1 . 1 19 19 ALA HB2 H 1 1.194 0.000 . 1 . . . . . 60 ALA HB2 . 51850 1
172 . 1 . 1 19 19 ALA HB3 H 1 1.194 0.000 . 1 . . . . . 60 ALA HB3 . 51850 1
173 . 1 . 1 19 19 ALA C C 13 178.090 0.006 . 1 . . . . . 60 ALA C . 51850 1
174 . 1 . 1 19 19 ALA CA C 13 52.576 0.055 . 1 . . . . . 60 ALA CA . 51850 1
175 . 1 . 1 19 19 ALA CB C 13 19.093 0.033 . 1 . . . . . 60 ALA CB . 51850 1
176 . 1 . 1 19 19 ALA N N 15 122.724 0.019 . 1 . . . . . 60 ALA N . 51850 1
177 . 1 . 1 20 20 GLY H H 1 8.020 0.001 . 1 . . . . . 61 GLY H . 51850 1
178 . 1 . 1 20 20 GLY HA2 H 1 3.694 0.000 . 2 . . . . . 61 GLY HA2 . 51850 1
179 . 1 . 1 20 20 GLY HA3 H 1 3.724 0.001 . 2 . . . . . 61 GLY HA3 . 51850 1
180 . 1 . 1 20 20 GLY C C 13 173.810 0.000 . 1 . . . . . 61 GLY C . 51850 1
181 . 1 . 1 20 20 GLY CA C 13 45.080 0.018 . 1 . . . . . 61 GLY CA . 51850 1
182 . 1 . 1 20 20 GLY N N 15 107.583 0.015 . 1 . . . . . 61 GLY N . 51850 1
183 . 1 . 1 21 21 ASP H H 1 8.049 0.001 . 1 . . . . . 62 ASP H . 51850 1
184 . 1 . 1 21 21 ASP HA H 1 4.498 0.000 . 1 . . . . . 62 ASP HA . 51850 1
185 . 1 . 1 21 21 ASP HB2 H 1 2.556 0.000 . 2 . . . . . 62 ASP HB2 . 51850 1
186 . 1 . 1 21 21 ASP HB3 H 1 2.463 0.000 . 2 . . . . . 62 ASP HB3 . 51850 1
187 . 1 . 1 21 21 ASP C C 13 176.558 0.006 . 1 . . . . . 62 ASP C . 51850 1
188 . 1 . 1 21 21 ASP CA C 13 54.222 0.011 . 1 . . . . . 62 ASP CA . 51850 1
189 . 1 . 1 21 21 ASP CB C 13 41.073 0.020 . 1 . . . . . 62 ASP CB . 51850 1
190 . 1 . 1 21 21 ASP N N 15 120.312 0.014 . 1 . . . . . 62 ASP N . 51850 1
191 . 1 . 1 22 22 THR H H 1 7.950 0.001 . 1 . . . . . 63 THR H . 51850 1
192 . 1 . 1 22 22 THR HA H 1 4.089 0.000 . 1 . . . . . 63 THR HA . 51850 1
193 . 1 . 1 22 22 THR HB H 1 4.054 0.000 . 1 . . . . . 63 THR HB . 51850 1
194 . 1 . 1 22 22 THR HG21 H 1 0.987 0.000 . 1 . . . . . 63 THR HG21 . 51850 1
195 . 1 . 1 22 22 THR HG22 H 1 0.987 0.000 . 1 . . . . . 63 THR HG22 . 51850 1
196 . 1 . 1 22 22 THR HG23 H 1 0.987 0.000 . 1 . . . . . 63 THR HG23 . 51850 1
197 . 1 . 1 22 22 THR C C 13 174.394 0.010 . 1 . . . . . 63 THR C . 51850 1
198 . 1 . 1 22 22 THR CA C 13 61.901 0.024 . 1 . . . . . 63 THR CA . 51850 1
199 . 1 . 1 22 22 THR CB C 13 69.689 0.070 . 1 . . . . . 63 THR CB . 51850 1
200 . 1 . 1 22 22 THR CG2 C 13 21.278 0.003 . 1 . . . . . 63 THR CG2 . 51850 1
201 . 1 . 1 22 22 THR N N 15 113.689 0.008 . 1 . . . . . 63 THR N . 51850 1
202 . 1 . 1 23 23 ASP H H 1 8.166 0.002 . 1 . . . . . 64 ASP H . 51850 1
203 . 1 . 1 23 23 ASP HA H 1 4.374 0.000 . 1 . . . . . 64 ASP HA . 51850 1
204 . 1 . 1 23 23 ASP HB2 H 1 2.408 0.000 . 1 . . . . . 64 ASP HB2 . 51850 1
205 . 1 . 1 23 23 ASP HB3 H 1 2.408 0.000 . 1 . . . . . 64 ASP HB3 . 51850 1
206 . 1 . 1 23 23 ASP C C 13 176.043 0.003 . 1 . . . . . 64 ASP C . 51850 1
207 . 1 . 1 23 23 ASP CA C 13 54.522 0.025 . 1 . . . . . 64 ASP CA . 51850 1
208 . 1 . 1 23 23 ASP CB C 13 40.941 0.035 . 1 . . . . . 64 ASP CB . 51850 1
209 . 1 . 1 23 23 ASP N N 15 122.470 0.013 . 1 . . . . . 64 ASP N . 51850 1
210 . 1 . 1 24 24 ALA H H 1 7.913 0.002 . 1 . . . . . 65 ALA H . 51850 1
211 . 1 . 1 24 24 ALA HA H 1 4.078 0.001 . 1 . . . . . 65 ALA HA . 51850 1
212 . 1 . 1 24 24 ALA HB1 H 1 1.117 0.001 . 1 . . . . . 65 ALA HB1 . 51850 1
213 . 1 . 1 24 24 ALA HB2 H 1 1.117 0.001 . 1 . . . . . 65 ALA HB2 . 51850 1
214 . 1 . 1 24 24 ALA HB3 H 1 1.117 0.001 . 1 . . . . . 65 ALA HB3 . 51850 1
215 . 1 . 1 24 24 ALA C C 13 177.471 0.002 . 1 . . . . . 65 ALA C . 51850 1
216 . 1 . 1 24 24 ALA CA C 13 52.631 0.023 . 1 . . . . . 65 ALA CA . 51850 1
217 . 1 . 1 24 24 ALA CB C 13 18.858 0.053 . 1 . . . . . 65 ALA CB . 51850 1
218 . 1 . 1 24 24 ALA N N 15 123.670 0.022 . 1 . . . . . 65 ALA N . 51850 1
219 . 1 . 1 25 25 TRP H H 1 7.843 0.002 . 1 . . . . . 66 TRP H . 51850 1
220 . 1 . 1 25 25 TRP HA H 1 4.428 0.001 . 1 . . . . . 66 TRP HA . 51850 1
221 . 1 . 1 25 25 TRP HB2 H 1 3.097 0.000 . 1 . . . . . 66 TRP HB2 . 51850 1
222 . 1 . 1 25 25 TRP HB3 H 1 3.097 0.000 . 1 . . . . . 66 TRP HB3 . 51850 1
223 . 1 . 1 25 25 TRP HE1 H 1 9.925 0.000 . 1 . . . . . 66 TRP HE1 . 51850 1
224 . 1 . 1 25 25 TRP C C 13 176.222 0.001 . 1 . . . . . 66 TRP C . 51850 1
225 . 1 . 1 25 25 TRP CA C 13 57.378 0.019 . 1 . . . . . 66 TRP CA . 51850 1
226 . 1 . 1 25 25 TRP CB C 13 29.280 0.039 . 1 . . . . . 66 TRP CB . 51850 1
227 . 1 . 1 25 25 TRP N N 15 120.004 0.012 . 1 . . . . . 66 TRP N . 51850 1
228 . 1 . 1 25 25 TRP NE1 N 15 129.222 0.009 . 1 . . . . . 66 TRP NE1 . 51850 1
229 . 1 . 1 26 26 GLU H H 1 7.938 0.002 . 1 . . . . . 67 GLU H . 51850 1
230 . 1 . 1 26 26 GLU HA H 1 3.935 0.003 . 1 . . . . . 67 GLU HA . 51850 1
231 . 1 . 1 26 26 GLU HB2 H 1 1.881 0.000 . 2 . . . . . 67 GLU HB2 . 51850 1
232 . 1 . 1 26 26 GLU HB3 H 1 1.618 0.000 . 2 . . . . . 67 GLU HB3 . 51850 1
233 . 1 . 1 26 26 GLU HG2 H 1 1.888 0.000 . 2 . . . . . 67 GLU HG2 . 51850 1
234 . 1 . 1 26 26 GLU HG3 H 1 1.893 0.005 . 2 . . . . . 67 GLU HG3 . 51850 1
235 . 1 . 1 26 26 GLU C C 13 175.975 0.032 . 1 . . . . . 67 GLU C . 51850 1
236 . 1 . 1 26 26 GLU CA C 13 56.554 0.032 . 1 . . . . . 67 GLU CA . 51850 1
237 . 1 . 1 26 26 GLU CB C 13 30.159 0.040 . 1 . . . . . 67 GLU CB . 51850 1
238 . 1 . 1 26 26 GLU CG C 13 35.984 0.006 . 1 . . . . . 67 GLU CG . 51850 1
239 . 1 . 1 26 26 GLU N N 15 122.138 0.017 . 1 . . . . . 67 GLU N . 51850 1
240 . 1 . 1 27 27 GLN H H 1 7.999 0.001 . 1 . . . . . 68 GLN H . 51850 1
241 . 1 . 1 27 27 GLN HA H 1 4.087 0.001 . 1 . . . . . 68 GLN HA . 51850 1
242 . 1 . 1 27 27 GLN HB2 H 1 1.770 0.001 . 2 . . . . . 68 GLN HB2 . 51850 1
243 . 1 . 1 27 27 GLN HB3 H 1 1.906 0.008 . 2 . . . . . 68 GLN HB3 . 51850 1
244 . 1 . 1 27 27 GLN HG2 H 1 2.141 0.005 . 1 . . . . . 68 GLN HG2 . 51850 1
245 . 1 . 1 27 27 GLN HG3 H 1 2.141 0.005 . 1 . . . . . 68 GLN HG3 . 51850 1
246 . 1 . 1 27 27 GLN HE21 H 1 6.659 0.002 . 1 . . . . . 68 GLN HE21 . 51850 1
247 . 1 . 1 27 27 GLN HE22 H 1 7.349 0.002 . 1 . . . . . 68 GLN HE22 . 51850 1
248 . 1 . 1 27 27 GLN C C 13 175.978 0.014 . 1 . . . . . 68 GLN C . 51850 1
249 . 1 . 1 27 27 GLN CA C 13 55.728 0.007 . 1 . . . . . 68 GLN CA . 51850 1
250 . 1 . 1 27 27 GLN CB C 13 29.315 0.094 . 1 . . . . . 68 GLN CB . 51850 1
251 . 1 . 1 27 27 GLN CG C 13 33.620 0.026 . 1 . . . . . 68 GLN CG . 51850 1
252 . 1 . 1 27 27 GLN CD C 13 180.255 0.006 . 1 . . . . . 68 GLN CD . 51850 1
253 . 1 . 1 27 27 GLN N N 15 120.816 0.019 . 1 . . . . . 68 GLN N . 51850 1
254 . 1 . 1 27 27 GLN NE2 N 15 111.900 0.057 . 1 . . . . . 68 GLN NE2 . 51850 1
255 . 1 . 1 28 28 THR H H 1 8.047 0.001 . 1 . . . . . 69 THR H . 51850 1
256 . 1 . 1 28 28 THR HA H 1 4.167 0.000 . 1 . . . . . 69 THR HA . 51850 1
257 . 1 . 1 28 28 THR HB H 1 4.009 0.003 . 1 . . . . . 69 THR HB . 51850 1
258 . 1 . 1 28 28 THR HG21 H 1 1.009 0.005 . 1 . . . . . 69 THR HG21 . 51850 1
259 . 1 . 1 28 28 THR HG22 H 1 1.009 0.005 . 1 . . . . . 69 THR HG22 . 51850 1
260 . 1 . 1 28 28 THR HG23 H 1 1.009 0.005 . 1 . . . . . 69 THR HG23 . 51850 1
261 . 1 . 1 28 28 THR C C 13 174.446 0.021 . 1 . . . . . 69 THR C . 51850 1
262 . 1 . 1 28 28 THR CA C 13 61.831 0.039 . 1 . . . . . 69 THR CA . 51850 1
263 . 1 . 1 28 28 THR CB C 13 69.731 0.075 . 1 . . . . . 69 THR CB . 51850 1
264 . 1 . 1 28 28 THR CG2 C 13 21.432 0.020 . 1 . . . . . 69 THR CG2 . 51850 1
265 . 1 . 1 28 28 THR N N 15 116.069 0.010 . 1 . . . . . 69 THR N . 51850 1
266 . 1 . 1 29 29 VAL H H 1 8.029 0.002 . 1 . . . . . 70 VAL H . 51850 1
267 . 1 . 1 29 29 VAL HA H 1 3.961 0.000 . 1 . . . . . 70 VAL HA . 51850 1
268 . 1 . 1 29 29 VAL HB H 1 1.882 0.002 . 1 . . . . . 70 VAL HB . 51850 1
269 . 1 . 1 29 29 VAL HG11 H 1 0.737 0.000 . 2 . . . . . 70 VAL HG11 . 51850 1
270 . 1 . 1 29 29 VAL HG12 H 1 0.737 0.000 . 2 . . . . . 70 VAL HG12 . 51850 1
271 . 1 . 1 29 29 VAL HG13 H 1 0.737 0.000 . 2 . . . . . 70 VAL HG13 . 51850 1
272 . 1 . 1 29 29 VAL HG21 H 1 0.751 0.002 . 2 . . . . . 70 VAL HG21 . 51850 1
273 . 1 . 1 29 29 VAL HG22 H 1 0.751 0.002 . 2 . . . . . 70 VAL HG22 . 51850 1
274 . 1 . 1 29 29 VAL HG23 H 1 0.751 0.002 . 2 . . . . . 70 VAL HG23 . 51850 1
275 . 1 . 1 29 29 VAL C C 13 176.419 0.000 . 1 . . . . . 70 VAL C . 51850 1
276 . 1 . 1 29 29 VAL CA C 13 62.277 0.047 . 1 . . . . . 70 VAL CA . 51850 1
277 . 1 . 1 29 29 VAL CB C 13 32.698 0.018 . 1 . . . . . 70 VAL CB . 51850 1
278 . 1 . 1 29 29 VAL CG1 C 13 20.314 0.015 . 2 . . . . . 70 VAL CG1 . 51850 1
279 . 1 . 1 29 29 VAL CG2 C 13 20.911 0.046 . 2 . . . . . 70 VAL CG2 . 51850 1
280 . 1 . 1 29 29 VAL N N 15 122.401 0.016 . 1 . . . . . 70 VAL N . 51850 1
281 . 1 . 1 30 30 GLY H H 1 8.241 0.001 . 1 . . . . . 71 GLY H . 51850 1
282 . 1 . 1 30 30 GLY HA2 H 1 3.800 0.000 . 1 . . . . . 71 GLY HA2 . 51850 1
283 . 1 . 1 30 30 GLY HA3 H 1 3.800 0.000 . 1 . . . . . 71 GLY HA3 . 51850 1
284 . 1 . 1 30 30 GLY C C 13 173.741 0.014 . 1 . . . . . 71 GLY C . 51850 1
285 . 1 . 1 30 30 GLY CA C 13 45.067 0.004 . 1 . . . . . 71 GLY CA . 51850 1
286 . 1 . 1 30 30 GLY N N 15 112.314 0.015 . 1 . . . . . 71 GLY N . 51850 1
287 . 1 . 1 31 31 ASP H H 1 8.133 0.001 . 1 . . . . . 72 ASP H . 51850 1
288 . 1 . 1 31 31 ASP HA H 1 4.431 0.000 . 1 . . . . . 72 ASP HA . 51850 1
289 . 1 . 1 31 31 ASP HB2 H 1 2.516 0.000 . 1 . . . . . 72 ASP HB2 . 51850 1
290 . 1 . 1 31 31 ASP HB3 H 1 2.516 0.000 . 1 . . . . . 72 ASP HB3 . 51850 1
291 . 1 . 1 31 31 ASP C C 13 176.880 0.007 . 1 . . . . . 72 ASP C . 51850 1
292 . 1 . 1 31 31 ASP CA C 13 54.280 0.007 . 1 . . . . . 72 ASP CA . 51850 1
293 . 1 . 1 31 31 ASP CB C 13 41.138 0.018 . 1 . . . . . 72 ASP CB . 51850 1
294 . 1 . 1 31 31 ASP N N 15 120.339 0.014 . 1 . . . . . 72 ASP N . 51850 1
295 . 1 . 1 32 32 GLY H H 1 8.308 0.001 . 1 . . . . . 73 GLY H . 51850 1
296 . 1 . 1 32 32 GLY HA2 H 1 3.789 0.000 . 1 . . . . . 73 GLY HA2 . 51850 1
297 . 1 . 1 32 32 GLY HA3 H 1 3.789 0.000 . 1 . . . . . 73 GLY HA3 . 51850 1
298 . 1 . 1 32 32 GLY C C 13 174.320 0.005 . 1 . . . . . 73 GLY C . 51850 1
299 . 1 . 1 32 32 GLY CA C 13 45.372 0.012 . 1 . . . . . 73 GLY CA . 51850 1
300 . 1 . 1 32 32 GLY N N 15 109.283 0.007 . 1 . . . . . 73 GLY N . 51850 1
301 . 1 . 1 33 33 VAL H H 1 7.857 0.001 . 1 . . . . . 74 VAL H . 51850 1
302 . 1 . 1 33 33 VAL HA H 1 3.943 0.000 . 1 . . . . . 74 VAL HA . 51850 1
303 . 1 . 1 33 33 VAL HB H 1 1.949 0.001 . 1 . . . . . 74 VAL HB . 51850 1
304 . 1 . 1 33 33 VAL HG11 H 1 0.742 0.005 . 2 . . . . . 74 VAL HG11 . 51850 1
305 . 1 . 1 33 33 VAL HG12 H 1 0.742 0.005 . 2 . . . . . 74 VAL HG12 . 51850 1
306 . 1 . 1 33 33 VAL HG13 H 1 0.742 0.005 . 2 . . . . . 74 VAL HG13 . 51850 1
307 . 1 . 1 33 33 VAL HG21 H 1 0.750 0.002 . 2 . . . . . 74 VAL HG21 . 51850 1
308 . 1 . 1 33 33 VAL HG22 H 1 0.750 0.002 . 2 . . . . . 74 VAL HG22 . 51850 1
309 . 1 . 1 33 33 VAL HG23 H 1 0.750 0.002 . 2 . . . . . 74 VAL HG23 . 51850 1
310 . 1 . 1 33 33 VAL C C 13 176.770 0.008 . 1 . . . . . 74 VAL C . 51850 1
311 . 1 . 1 33 33 VAL CA C 13 62.559 0.011 . 1 . . . . . 74 VAL CA . 51850 1
312 . 1 . 1 33 33 VAL CB C 13 32.410 0.029 . 1 . . . . . 74 VAL CB . 51850 1
313 . 1 . 1 33 33 VAL CG1 C 13 20.298 0.002 . 2 . . . . . 74 VAL CG1 . 51850 1
314 . 1 . 1 33 33 VAL CG2 C 13 20.940 0.017 . 2 . . . . . 74 VAL CG2 . 51850 1
315 . 1 . 1 33 33 VAL N N 15 119.106 0.015 . 1 . . . . . 74 VAL N . 51850 1
316 . 1 . 1 34 34 GLY H H 1 8.349 0.001 . 1 . . . . . 75 GLY H . 51850 1
317 . 1 . 1 34 34 GLY HA2 H 1 3.790 0.000 . 1 . . . . . 75 GLY HA2 . 51850 1
318 . 1 . 1 34 34 GLY HA3 H 1 3.790 0.000 . 1 . . . . . 75 GLY HA3 . 51850 1
319 . 1 . 1 34 34 GLY C C 13 173.686 0.000 . 1 . . . . . 75 GLY C . 51850 1
320 . 1 . 1 34 34 GLY CA C 13 45.094 0.010 . 1 . . . . . 75 GLY CA . 51850 1
321 . 1 . 1 34 34 GLY N N 15 112.059 0.011 . 1 . . . . . 75 GLY N . 51850 1
322 . 1 . 1 35 35 ASP H H 1 8.019 0.000 . 1 . . . . . 76 ASP H . 51850 1
323 . 1 . 1 35 35 ASP HA H 1 4.437 0.000 . 1 . . . . . 76 ASP HA . 51850 1
324 . 1 . 1 35 35 ASP HB2 H 1 2.458 0.000 . 2 . . . . . 76 ASP HB2 . 51850 1
325 . 1 . 1 35 35 ASP HB3 H 1 2.424 0.000 . 2 . . . . . 76 ASP HB3 . 51850 1
326 . 1 . 1 35 35 ASP C C 13 175.556 0.019 . 1 . . . . . 76 ASP C . 51850 1
327 . 1 . 1 35 35 ASP CA C 13 53.914 0.016 . 1 . . . . . 76 ASP CA . 51850 1
328 . 1 . 1 35 35 ASP CB C 13 41.162 0.015 . 1 . . . . . 76 ASP CB . 51850 1
329 . 1 . 1 35 35 ASP N N 15 120.373 0.013 . 1 . . . . . 76 ASP N . 51850 1
330 . 1 . 1 36 36 ALA H H 1 7.979 0.001 . 1 . . . . . 77 ALA H . 51850 1
331 . 1 . 1 36 36 ALA HA H 1 4.395 0.000 . 1 . . . . . 77 ALA HA . 51850 1
332 . 1 . 1 36 36 ALA HB1 H 1 1.177 0.000 . 1 . . . . . 77 ALA HB1 . 51850 1
333 . 1 . 1 36 36 ALA HB2 H 1 1.177 0.000 . 1 . . . . . 77 ALA HB2 . 51850 1
334 . 1 . 1 36 36 ALA HB3 H 1 1.177 0.000 . 1 . . . . . 77 ALA HB3 . 51850 1
335 . 1 . 1 36 36 ALA C C 13 175.311 0.000 . 1 . . . . . 77 ALA C . 51850 1
336 . 1 . 1 36 36 ALA CA C 13 50.461 0.005 . 1 . . . . . 77 ALA CA . 51850 1
337 . 1 . 1 36 36 ALA CB C 13 18.110 0.040 . 1 . . . . . 77 ALA CB . 51850 1
338 . 1 . 1 36 36 ALA N N 15 125.125 0.053 . 1 . . . . . 77 ALA N . 51850 1
339 . 1 . 1 37 37 PRO HA H 1 4.228 0.001 . 1 . . . . . 78 PRO HA . 51850 1
340 . 1 . 1 37 37 PRO HB2 H 1 2.112 0.000 . 1 . . . . . 78 PRO HB2 . 51850 1
341 . 1 . 1 37 37 PRO HB3 H 1 2.112 0.000 . 1 . . . . . 78 PRO HB3 . 51850 1
342 . 1 . 1 37 37 PRO HG2 H 1 1.792 0.000 . 2 . . . . . 78 PRO HG2 . 51850 1
343 . 1 . 1 37 37 PRO HG3 H 1 1.847 0.000 . 2 . . . . . 78 PRO HG3 . 51850 1
344 . 1 . 1 37 37 PRO HD2 H 1 3.611 0.003 . 2 . . . . . 78 PRO HD2 . 51850 1
345 . 1 . 1 37 37 PRO HD3 H 1 3.449 0.001 . 2 . . . . . 78 PRO HD3 . 51850 1
346 . 1 . 1 37 37 PRO C C 13 176.035 0.014 . 1 . . . . . 78 PRO C . 51850 1
347 . 1 . 1 37 37 PRO CA C 13 63.160 0.014 . 1 . . . . . 78 PRO CA . 51850 1
348 . 1 . 1 37 37 PRO CB C 13 31.854 0.006 . 1 . . . . . 78 PRO CB . 51850 1
349 . 1 . 1 37 37 PRO CG C 13 27.279 0.000 . 1 . . . . . 78 PRO CG . 51850 1
350 . 1 . 1 37 37 PRO CD C 13 50.368 0.056 . 1 . . . . . 78 PRO CD . 51850 1
351 . 1 . 1 38 38 ARG H H 1 7.859 0.001 . 1 . . . . . 79 ARG H . 51850 1
352 . 1 . 1 38 38 ARG HA H 1 4.000 0.000 . 1 . . . . . 79 ARG HA . 51850 1
353 . 1 . 1 38 38 ARG C C 13 180.997 0.000 . 1 . . . . . 79 ARG C . 51850 1
354 . 1 . 1 38 38 ARG CA C 13 57.155 0.019 . 1 . . . . . 79 ARG CA . 51850 1
355 . 1 . 1 38 38 ARG CB C 13 32.032 0.000 . 1 . . . . . 79 ARG CB . 51850 1
356 . 1 . 1 38 38 ARG N N 15 126.563 0.022 . 1 . . . . . 79 ARG N . 51850 1
stop_
save_