Content for NMR-STAR saveframe, "chemical_shift_1"
save_chemical_shift_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_1
_Assigned_chem_shift_list.Entry_ID 11213
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $condition_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11213 1
2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11213 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 $VNMR . . 11213 1
2 $NMRPipe . . 11213 1
3 $NMRView . . 11213 1
4 $Kujira . . 11213 1
5 $CYANA . . 11213 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 6 6 SER HA H 1 4.514 0.030 . 1 . . . . 6 SER HA . 11213 1
2 . 1 1 6 6 SER HB2 H 1 3.884 0.030 . 1 . . . . 6 SER HB2 . 11213 1
3 . 1 1 6 6 SER HB3 H 1 3.884 0.030 . 1 . . . . 6 SER HB3 . 11213 1
4 . 1 1 6 6 SER C C 13 175.047 0.300 . 1 . . . . 6 SER C . 11213 1
5 . 1 1 6 6 SER CA C 13 58.665 0.300 . 1 . . . . 6 SER CA . 11213 1
6 . 1 1 6 6 SER CB C 13 63.917 0.300 . 1 . . . . 6 SER CB . 11213 1
7 . 1 1 7 7 GLY H H 1 8.476 0.030 . 1 . . . . 7 GLY H . 11213 1
8 . 1 1 7 7 GLY HA2 H 1 3.970 0.030 . 1 . . . . 7 GLY HA2 . 11213 1
9 . 1 1 7 7 GLY HA3 H 1 3.970 0.030 . 1 . . . . 7 GLY HA3 . 11213 1
10 . 1 1 7 7 GLY C C 13 174.131 0.300 . 1 . . . . 7 GLY C . 11213 1
11 . 1 1 7 7 GLY CA C 13 45.517 0.300 . 1 . . . . 7 GLY CA . 11213 1
12 . 1 1 7 7 GLY N N 15 110.692 0.300 . 1 . . . . 7 GLY N . 11213 1
13 . 1 1 8 8 HIS H H 1 6.997 0.030 . 1 . . . . 8 HIS H . 11213 1
14 . 1 1 8 8 HIS HA H 1 4.624 0.030 . 1 . . . . 8 HIS HA . 11213 1
15 . 1 1 8 8 HIS HB2 H 1 3.139 0.030 . 2 . . . . 8 HIS HB2 . 11213 1
16 . 1 1 8 8 HIS HB3 H 1 3.038 0.030 . 2 . . . . 8 HIS HB3 . 11213 1
17 . 1 1 8 8 HIS HD2 H 1 7.002 0.030 . 1 . . . . 8 HIS HD2 . 11213 1
18 . 1 1 8 8 HIS HE1 H 1 7.897 0.030 . 1 . . . . 8 HIS HE1 . 11213 1
19 . 1 1 8 8 HIS C C 13 175.434 0.300 . 1 . . . . 8 HIS C . 11213 1
20 . 1 1 8 8 HIS CA C 13 56.171 0.300 . 1 . . . . 8 HIS CA . 11213 1
21 . 1 1 8 8 HIS CB C 13 30.600 0.300 . 1 . . . . 8 HIS CB . 11213 1
22 . 1 1 8 8 HIS CD2 C 13 119.884 0.300 . 1 . . . . 8 HIS CD2 . 11213 1
23 . 1 1 8 8 HIS CE1 C 13 137.839 0.300 . 1 . . . . 8 HIS CE1 . 11213 1
24 . 1 1 9 9 GLU H H 1 8.483 0.030 . 1 . . . . 9 GLU H . 11213 1
25 . 1 1 9 9 GLU HA H 1 4.242 0.030 . 1 . . . . 9 GLU HA . 11213 1
26 . 1 1 9 9 GLU HB2 H 1 1.996 0.030 . 2 . . . . 9 GLU HB2 . 11213 1
27 . 1 1 9 9 GLU HB3 H 1 1.908 0.030 . 2 . . . . 9 GLU HB3 . 11213 1
28 . 1 1 9 9 GLU HG2 H 1 2.205 0.030 . 1 . . . . 9 GLU HG2 . 11213 1
29 . 1 1 9 9 GLU HG3 H 1 2.205 0.030 . 1 . . . . 9 GLU HG3 . 11213 1
30 . 1 1 9 9 GLU C C 13 176.332 0.300 . 1 . . . . 9 GLU C . 11213 1
31 . 1 1 9 9 GLU CA C 13 56.734 0.300 . 1 . . . . 9 GLU CA . 11213 1
32 . 1 1 9 9 GLU CB C 13 30.055 0.300 . 1 . . . . 9 GLU CB . 11213 1
33 . 1 1 9 9 GLU CG C 13 36.154 0.300 . 1 . . . . 9 GLU CG . 11213 1
34 . 1 1 9 9 GLU N N 15 121.889 0.300 . 1 . . . . 9 GLU N . 11213 1
35 . 1 1 10 10 ARG H H 1 8.412 0.030 . 1 . . . . 10 ARG H . 11213 1
36 . 1 1 10 10 ARG HA H 1 4.353 0.030 . 1 . . . . 10 ARG HA . 11213 1
37 . 1 1 10 10 ARG HB2 H 1 1.823 0.030 . 2 . . . . 10 ARG HB2 . 11213 1
38 . 1 1 10 10 ARG HB3 H 1 1.755 0.030 . 2 . . . . 10 ARG HB3 . 11213 1
39 . 1 1 10 10 ARG HD2 H 1 3.184 0.030 . 1 . . . . 10 ARG HD2 . 11213 1
40 . 1 1 10 10 ARG HD3 H 1 3.184 0.030 . 1 . . . . 10 ARG HD3 . 11213 1
41 . 1 1 10 10 ARG HG2 H 1 1.567 0.030 . 2 . . . . 10 ARG HG2 . 11213 1
42 . 1 1 10 10 ARG HG3 H 1 1.632 0.030 . 2 . . . . 10 ARG HG3 . 11213 1
43 . 1 1 10 10 ARG C C 13 176.189 0.300 . 1 . . . . 10 ARG C . 11213 1
44 . 1 1 10 10 ARG CA C 13 56.004 0.300 . 1 . . . . 10 ARG CA . 11213 1
45 . 1 1 10 10 ARG CB C 13 30.700 0.300 . 1 . . . . 10 ARG CB . 11213 1
46 . 1 1 10 10 ARG CD C 13 43.259 0.300 . 1 . . . . 10 ARG CD . 11213 1
47 . 1 1 10 10 ARG CG C 13 27.154 0.300 . 1 . . . . 10 ARG CG . 11213 1
48 . 1 1 10 10 ARG N N 15 122.312 0.300 . 1 . . . . 10 ARG N . 11213 1
49 . 1 1 11 11 VAL H H 1 8.176 0.030 . 1 . . . . 11 VAL H . 11213 1
50 . 1 1 11 11 VAL HA H 1 4.132 0.030 . 1 . . . . 11 VAL HA . 11213 1
51 . 1 1 11 11 VAL HB H 1 2.068 0.030 . 1 . . . . 11 VAL HB . 11213 1
52 . 1 1 11 11 VAL HG11 H 1 0.921 0.030 . 1 . . . . 11 VAL HG1 . 11213 1
53 . 1 1 11 11 VAL HG12 H 1 0.921 0.030 . 1 . . . . 11 VAL HG1 . 11213 1
54 . 1 1 11 11 VAL HG13 H 1 0.921 0.030 . 1 . . . . 11 VAL HG1 . 11213 1
55 . 1 1 11 11 VAL HG21 H 1 0.921 0.030 . 1 . . . . 11 VAL HG2 . 11213 1
56 . 1 1 11 11 VAL HG22 H 1 0.921 0.030 . 1 . . . . 11 VAL HG2 . 11213 1
57 . 1 1 11 11 VAL HG23 H 1 0.921 0.030 . 1 . . . . 11 VAL HG2 . 11213 1
58 . 1 1 11 11 VAL C C 13 176.510 0.300 . 1 . . . . 11 VAL C . 11213 1
59 . 1 1 11 11 VAL CA C 13 62.238 0.300 . 1 . . . . 11 VAL CA . 11213 1
60 . 1 1 11 11 VAL CB C 13 32.851 0.300 . 1 . . . . 11 VAL CB . 11213 1
61 . 1 1 11 11 VAL CG1 C 13 21.175 0.300 . 2 . . . . 11 VAL CG1 . 11213 1
62 . 1 1 11 11 VAL CG2 C 13 20.375 0.300 . 2 . . . . 11 VAL CG2 . 11213 1
63 . 1 1 11 11 VAL N N 15 121.316 0.300 . 1 . . . . 11 VAL N . 11213 1
64 . 1 1 12 12 GLY H H 1 8.458 0.030 . 1 . . . . 12 GLY H . 11213 1
65 . 1 1 12 12 GLY HA2 H 1 3.951 0.030 . 1 . . . . 12 GLY HA2 . 11213 1
66 . 1 1 12 12 GLY HA3 H 1 3.951 0.030 . 1 . . . . 12 GLY HA3 . 11213 1
67 . 1 1 12 12 GLY C C 13 173.750 0.300 . 1 . . . . 12 GLY C . 11213 1
68 . 1 1 12 12 GLY CA C 13 45.105 0.300 . 1 . . . . 12 GLY CA . 11213 1
69 . 1 1 12 12 GLY N N 15 112.275 0.300 . 1 . . . . 12 GLY N . 11213 1
70 . 1 1 13 13 ASN H H 1 8.304 0.030 . 1 . . . . 13 ASN H . 11213 1
71 . 1 1 13 13 ASN HA H 1 4.682 0.030 . 1 . . . . 13 ASN HA . 11213 1
72 . 1 1 13 13 ASN HB2 H 1 2.745 0.030 . 2 . . . . 13 ASN HB2 . 11213 1
73 . 1 1 13 13 ASN HB3 H 1 2.801 0.030 . 2 . . . . 13 ASN HB3 . 11213 1
74 . 1 1 13 13 ASN HD21 H 1 7.592 0.030 . 2 . . . . 13 ASN HD21 . 11213 1
75 . 1 1 13 13 ASN HD22 H 1 6.915 0.030 . 2 . . . . 13 ASN HD22 . 11213 1
76 . 1 1 13 13 ASN C C 13 175.381 0.300 . 1 . . . . 13 ASN C . 11213 1
77 . 1 1 13 13 ASN CA C 13 53.297 0.300 . 1 . . . . 13 ASN CA . 11213 1
78 . 1 1 13 13 ASN CB C 13 38.845 0.300 . 1 . . . . 13 ASN CB . 11213 1
79 . 1 1 13 13 ASN N N 15 118.693 0.300 . 1 . . . . 13 ASN N . 11213 1
80 . 1 1 13 13 ASN ND2 N 15 113.086 0.300 . 1 . . . . 13 ASN ND2 . 11213 1
81 . 1 1 14 14 LEU H H 1 8.237 0.030 . 1 . . . . 14 LEU H . 11213 1
82 . 1 1 14 14 LEU HA H 1 4.306 0.030 . 1 . . . . 14 LEU HA . 11213 1
83 . 1 1 14 14 LEU HB2 H 1 1.582 0.030 . 2 . . . . 14 LEU HB2 . 11213 1
84 . 1 1 14 14 LEU HB3 H 1 1.524 0.030 . 2 . . . . 14 LEU HB3 . 11213 1
85 . 1 1 14 14 LEU HD11 H 1 0.845 0.030 . 1 . . . . 14 LEU HD1 . 11213 1
86 . 1 1 14 14 LEU HD12 H 1 0.845 0.030 . 1 . . . . 14 LEU HD1 . 11213 1
87 . 1 1 14 14 LEU HD13 H 1 0.845 0.030 . 1 . . . . 14 LEU HD1 . 11213 1
88 . 1 1 14 14 LEU HD21 H 1 0.806 0.030 . 1 . . . . 14 LEU HD2 . 11213 1
89 . 1 1 14 14 LEU HD22 H 1 0.806 0.030 . 1 . . . . 14 LEU HD2 . 11213 1
90 . 1 1 14 14 LEU HD23 H 1 0.806 0.030 . 1 . . . . 14 LEU HD2 . 11213 1
91 . 1 1 14 14 LEU HG H 1 1.578 0.030 . 1 . . . . 14 LEU HG . 11213 1
92 . 1 1 14 14 LEU C C 13 177.204 0.300 . 1 . . . . 14 LEU C . 11213 1
93 . 1 1 14 14 LEU CA C 13 55.117 0.300 . 1 . . . . 14 LEU CA . 11213 1
94 . 1 1 14 14 LEU CB C 13 42.271 0.300 . 1 . . . . 14 LEU CB . 11213 1
95 . 1 1 14 14 LEU CD1 C 13 25.038 0.300 . 2 . . . . 14 LEU CD1 . 11213 1
96 . 1 1 14 14 LEU CD2 C 13 23.335 0.300 . 2 . . . . 14 LEU CD2 . 11213 1
97 . 1 1 14 14 LEU CG C 13 26.932 0.300 . 1 . . . . 14 LEU CG . 11213 1
98 . 1 1 14 14 LEU N N 15 122.151 0.300 . 1 . . . . 14 LEU N . 11213 1
99 . 1 1 15 15 ASN H H 1 8.507 0.030 . 1 . . . . 15 ASN H . 11213 1
100 . 1 1 15 15 ASN HA H 1 4.601 0.030 . 1 . . . . 15 ASN HA . 11213 1
101 . 1 1 15 15 ASN HB2 H 1 2.743 0.030 . 1 . . . . 15 ASN HB2 . 11213 1
102 . 1 1 15 15 ASN HB3 H 1 2.743 0.030 . 1 . . . . 15 ASN HB3 . 11213 1
103 . 1 1 15 15 ASN HD21 H 1 6.894 0.030 . 2 . . . . 15 ASN HD21 . 11213 1
104 . 1 1 15 15 ASN HD22 H 1 7.551 0.030 . 2 . . . . 15 ASN HD22 . 11213 1
105 . 1 1 15 15 ASN C C 13 174.757 0.300 . 1 . . . . 15 ASN C . 11213 1
106 . 1 1 15 15 ASN CA C 13 53.735 0.300 . 1 . . . . 15 ASN CA . 11213 1
107 . 1 1 15 15 ASN CB C 13 38.932 0.300 . 1 . . . . 15 ASN CB . 11213 1
108 . 1 1 15 15 ASN N N 15 119.575 0.300 . 1 . . . . 15 ASN N . 11213 1
109 . 1 1 15 15 ASN ND2 N 15 112.349 0.300 . 1 . . . . 15 ASN ND2 . 11213 1
110 . 1 1 16 16 GLN H H 1 7.965 0.030 . 1 . . . . 16 GLN H . 11213 1
111 . 1 1 16 16 GLN HA H 1 4.645 0.030 . 1 . . . . 16 GLN HA . 11213 1
112 . 1 1 16 16 GLN HB2 H 1 2.048 0.030 . 2 . . . . 16 GLN HB2 . 11213 1
113 . 1 1 16 16 GLN HB3 H 1 1.904 0.030 . 2 . . . . 16 GLN HB3 . 11213 1
114 . 1 1 16 16 GLN HE21 H 1 6.866 0.030 . 2 . . . . 16 GLN HE21 . 11213 1
115 . 1 1 16 16 GLN HE22 H 1 7.528 0.030 . 2 . . . . 16 GLN HE22 . 11213 1
116 . 1 1 16 16 GLN HG2 H 1 2.334 0.030 . 1 . . . . 16 GLN HG2 . 11213 1
117 . 1 1 16 16 GLN HG3 H 1 2.334 0.030 . 1 . . . . 16 GLN HG3 . 11213 1
118 . 1 1 16 16 GLN C C 13 173.138 0.300 . 1 . . . . 16 GLN C . 11213 1
119 . 1 1 16 16 GLN CA C 13 53.284 0.300 . 1 . . . . 16 GLN CA . 11213 1
120 . 1 1 16 16 GLN CB C 13 29.308 0.300 . 1 . . . . 16 GLN CB . 11213 1
121 . 1 1 16 16 GLN CG C 13 33.383 0.300 . 1 . . . . 16 GLN CG . 11213 1
122 . 1 1 16 16 GLN N N 15 120.153 0.300 . 1 . . . . 16 GLN N . 11213 1
123 . 1 1 16 16 GLN NE2 N 15 112.380 0.300 . 1 . . . . 16 GLN NE2 . 11213 1
124 . 1 1 17 17 PRO HA H 1 4.525 0.030 . 1 . . . . 17 PRO HA . 11213 1
125 . 1 1 17 17 PRO HB2 H 1 2.232 0.030 . 2 . . . . 17 PRO HB2 . 11213 1
126 . 1 1 17 17 PRO HB3 H 1 1.807 0.030 . 2 . . . . 17 PRO HB3 . 11213 1
127 . 1 1 17 17 PRO HD2 H 1 3.739 0.030 . 2 . . . . 17 PRO HD2 . 11213 1
128 . 1 1 17 17 PRO HD3 H 1 3.615 0.030 . 2 . . . . 17 PRO HD3 . 11213 1
129 . 1 1 17 17 PRO HG2 H 1 1.997 0.030 . 2 . . . . 17 PRO HG2 . 11213 1
130 . 1 1 17 17 PRO HG3 H 1 1.956 0.030 . 2 . . . . 17 PRO HG3 . 11213 1
131 . 1 1 17 17 PRO C C 13 176.399 0.300 . 1 . . . . 17 PRO C . 11213 1
132 . 1 1 17 17 PRO CA C 13 62.995 0.300 . 1 . . . . 17 PRO CA . 11213 1
133 . 1 1 17 17 PRO CB C 13 32.547 0.300 . 1 . . . . 17 PRO CB . 11213 1
134 . 1 1 17 17 PRO CD C 13 50.663 0.300 . 1 . . . . 17 PRO CD . 11213 1
135 . 1 1 17 17 PRO CG C 13 27.278 0.300 . 1 . . . . 17 PRO CG . 11213 1
136 . 1 1 18 18 ILE H H 1 8.225 0.030 . 1 . . . . 18 ILE H . 11213 1
137 . 1 1 18 18 ILE HA H 1 4.383 0.030 . 1 . . . . 18 ILE HA . 11213 1
138 . 1 1 18 18 ILE HB H 1 1.787 0.030 . 1 . . . . 18 ILE HB . 11213 1
139 . 1 1 18 18 ILE HD11 H 1 0.753 0.030 . 1 . . . . 18 ILE HD1 . 11213 1
140 . 1 1 18 18 ILE HD12 H 1 0.753 0.030 . 1 . . . . 18 ILE HD1 . 11213 1
141 . 1 1 18 18 ILE HD13 H 1 0.753 0.030 . 1 . . . . 18 ILE HD1 . 11213 1
142 . 1 1 18 18 ILE HG12 H 1 1.483 0.030 . 2 . . . . 18 ILE HG12 . 11213 1
143 . 1 1 18 18 ILE HG13 H 1 1.075 0.030 . 2 . . . . 18 ILE HG13 . 11213 1
144 . 1 1 18 18 ILE HG21 H 1 0.848 0.030 . 1 . . . . 18 ILE HG2 . 11213 1
145 . 1 1 18 18 ILE HG22 H 1 0.848 0.030 . 1 . . . . 18 ILE HG2 . 11213 1
146 . 1 1 18 18 ILE HG23 H 1 0.848 0.030 . 1 . . . . 18 ILE HG2 . 11213 1
147 . 1 1 18 18 ILE C C 13 174.279 0.300 . 1 . . . . 18 ILE C . 11213 1
148 . 1 1 18 18 ILE CA C 13 60.236 0.300 . 1 . . . . 18 ILE CA . 11213 1
149 . 1 1 18 18 ILE CB C 13 40.474 0.300 . 1 . . . . 18 ILE CB . 11213 1
150 . 1 1 18 18 ILE CD1 C 13 13.680 0.300 . 1 . . . . 18 ILE CD1 . 11213 1
151 . 1 1 18 18 ILE CG1 C 13 26.900 0.300 . 1 . . . . 18 ILE CG1 . 11213 1
152 . 1 1 18 18 ILE CG2 C 13 17.624 0.300 . 1 . . . . 18 ILE CG2 . 11213 1
153 . 1 1 18 18 ILE N N 15 119.882 0.300 . 1 . . . . 18 ILE N . 11213 1
154 . 1 1 19 19 GLU H H 1 8.476 0.030 . 1 . . . . 19 GLU H . 11213 1
155 . 1 1 19 19 GLU HA H 1 5.335 0.030 . 1 . . . . 19 GLU HA . 11213 1
156 . 1 1 19 19 GLU HB2 H 1 1.892 0.030 . 2 . . . . 19 GLU HB2 . 11213 1
157 . 1 1 19 19 GLU HB3 H 1 1.833 0.030 . 2 . . . . 19 GLU HB3 . 11213 1
158 . 1 1 19 19 GLU HG2 H 1 2.143 0.030 . 2 . . . . 19 GLU HG2 . 11213 1
159 . 1 1 19 19 GLU HG3 H 1 2.079 0.030 . 2 . . . . 19 GLU HG3 . 11213 1
160 . 1 1 19 19 GLU C C 13 175.928 0.300 . 1 . . . . 19 GLU C . 11213 1
161 . 1 1 19 19 GLU CA C 13 54.822 0.300 . 1 . . . . 19 GLU CA . 11213 1
162 . 1 1 19 19 GLU CB C 13 32.566 0.300 . 1 . . . . 19 GLU CB . 11213 1
163 . 1 1 19 19 GLU CG C 13 37.151 0.300 . 1 . . . . 19 GLU CG . 11213 1
164 . 1 1 19 19 GLU N N 15 124.707 0.300 . 1 . . . . 19 GLU N . 11213 1
165 . 1 1 20 20 VAL H H 1 8.894 0.030 . 1 . . . . 20 VAL H . 11213 1
166 . 1 1 20 20 VAL HA H 1 4.952 0.030 . 1 . . . . 20 VAL HA . 11213 1
167 . 1 1 20 20 VAL HB H 1 2.134 0.030 . 1 . . . . 20 VAL HB . 11213 1
168 . 1 1 20 20 VAL HG11 H 1 1.019 0.030 . 1 . . . . 20 VAL HG1 . 11213 1
169 . 1 1 20 20 VAL HG12 H 1 1.019 0.030 . 1 . . . . 20 VAL HG1 . 11213 1
170 . 1 1 20 20 VAL HG13 H 1 1.019 0.030 . 1 . . . . 20 VAL HG1 . 11213 1
171 . 1 1 20 20 VAL HG21 H 1 0.676 0.030 . 1 . . . . 20 VAL HG2 . 11213 1
172 . 1 1 20 20 VAL HG22 H 1 0.676 0.030 . 1 . . . . 20 VAL HG2 . 11213 1
173 . 1 1 20 20 VAL HG23 H 1 0.676 0.030 . 1 . . . . 20 VAL HG2 . 11213 1
174 . 1 1 20 20 VAL C C 13 174.423 0.300 . 1 . . . . 20 VAL C . 11213 1
175 . 1 1 20 20 VAL CA C 13 58.496 0.300 . 1 . . . . 20 VAL CA . 11213 1
176 . 1 1 20 20 VAL CB C 13 35.054 0.300 . 1 . . . . 20 VAL CB . 11213 1
177 . 1 1 20 20 VAL CG1 C 13 22.586 0.300 . 2 . . . . 20 VAL CG1 . 11213 1
178 . 1 1 20 20 VAL CG2 C 13 19.196 0.300 . 2 . . . . 20 VAL CG2 . 11213 1
179 . 1 1 20 20 VAL N N 15 115.255 0.300 . 1 . . . . 20 VAL N . 11213 1
180 . 1 1 21 21 THR H H 1 8.497 0.030 . 1 . . . . 21 THR H . 11213 1
181 . 1 1 21 21 THR HA H 1 4.961 0.030 . 1 . . . . 21 THR HA . 11213 1
182 . 1 1 21 21 THR HB H 1 3.692 0.030 . 1 . . . . 21 THR HB . 11213 1
183 . 1 1 21 21 THR HG21 H 1 0.982 0.030 . 1 . . . . 21 THR HG2 . 11213 1
184 . 1 1 21 21 THR HG22 H 1 0.982 0.030 . 1 . . . . 21 THR HG2 . 11213 1
185 . 1 1 21 21 THR HG23 H 1 0.982 0.030 . 1 . . . . 21 THR HG2 . 11213 1
186 . 1 1 21 21 THR C C 13 174.492 0.300 . 1 . . . . 21 THR C . 11213 1
187 . 1 1 21 21 THR CA C 13 61.258 0.300 . 1 . . . . 21 THR CA . 11213 1
188 . 1 1 21 21 THR CB C 13 70.541 0.300 . 1 . . . . 21 THR CB . 11213 1
189 . 1 1 21 21 THR CG2 C 13 21.265 0.300 . 1 . . . . 21 THR CG2 . 11213 1
190 . 1 1 21 21 THR N N 15 116.368 0.300 . 1 . . . . 21 THR N . 11213 1
191 . 1 1 22 22 ALA H H 1 8.923 0.030 . 1 . . . . 22 ALA H . 11213 1
192 . 1 1 22 22 ALA HA H 1 4.289 0.030 . 1 . . . . 22 ALA HA . 11213 1
193 . 1 1 22 22 ALA HB1 H 1 1.377 0.030 . 1 . . . . 22 ALA HB . 11213 1
194 . 1 1 22 22 ALA HB2 H 1 1.377 0.030 . 1 . . . . 22 ALA HB . 11213 1
195 . 1 1 22 22 ALA HB3 H 1 1.377 0.030 . 1 . . . . 22 ALA HB . 11213 1
196 . 1 1 22 22 ALA C C 13 178.487 0.300 . 1 . . . . 22 ALA C . 11213 1
197 . 1 1 22 22 ALA CA C 13 52.589 0.300 . 1 . . . . 22 ALA CA . 11213 1
198 . 1 1 22 22 ALA CB C 13 20.299 0.300 . 1 . . . . 22 ALA CB . 11213 1
199 . 1 1 22 22 ALA N N 15 127.907 0.300 . 1 . . . . 22 ALA N . 11213 1
200 . 1 1 23 23 LEU H H 1 9.540 0.030 . 1 . . . . 23 LEU H . 11213 1
201 . 1 1 23 23 LEU HA H 1 3.946 0.030 . 1 . . . . 23 LEU HA . 11213 1
202 . 1 1 23 23 LEU HB2 H 1 0.911 0.030 . 2 . . . . 23 LEU HB2 . 11213 1
203 . 1 1 23 23 LEU HB3 H 1 0.520 0.030 . 2 . . . . 23 LEU HB3 . 11213 1
204 . 1 1 23 23 LEU HD11 H 1 0.612 0.030 . 1 . . . . 23 LEU HD1 . 11213 1
205 . 1 1 23 23 LEU HD12 H 1 0.612 0.030 . 1 . . . . 23 LEU HD1 . 11213 1
206 . 1 1 23 23 LEU HD13 H 1 0.612 0.030 . 1 . . . . 23 LEU HD1 . 11213 1
207 . 1 1 23 23 LEU HD21 H 1 0.631 0.030 . 1 . . . . 23 LEU HD2 . 11213 1
208 . 1 1 23 23 LEU HD22 H 1 0.631 0.030 . 1 . . . . 23 LEU HD2 . 11213 1
209 . 1 1 23 23 LEU HD23 H 1 0.631 0.030 . 1 . . . . 23 LEU HD2 . 11213 1
210 . 1 1 23 23 LEU HG H 1 1.125 0.030 . 1 . . . . 23 LEU HG . 11213 1
211 . 1 1 23 23 LEU C C 13 175.444 0.300 . 1 . . . . 23 LEU C . 11213 1
212 . 1 1 23 23 LEU CA C 13 55.716 0.300 . 1 . . . . 23 LEU CA . 11213 1
213 . 1 1 23 23 LEU CB C 13 43.466 0.300 . 1 . . . . 23 LEU CB . 11213 1
214 . 1 1 23 23 LEU CD1 C 13 25.229 0.300 . 2 . . . . 23 LEU CD1 . 11213 1
215 . 1 1 23 23 LEU CD2 C 13 22.700 0.300 . 2 . . . . 23 LEU CD2 . 11213 1
216 . 1 1 23 23 LEU CG C 13 26.695 0.300 . 1 . . . . 23 LEU CG . 11213 1
217 . 1 1 23 23 LEU N N 15 127.822 0.300 . 1 . . . . 23 LEU N . 11213 1
218 . 1 1 24 24 TYR H H 1 7.123 0.030 . 1 . . . . 24 TYR H . 11213 1
219 . 1 1 24 24 TYR HA H 1 4.916 0.030 . 1 . . . . 24 TYR HA . 11213 1
220 . 1 1 24 24 TYR HB2 H 1 3.279 0.030 . 2 . . . . 24 TYR HB2 . 11213 1
221 . 1 1 24 24 TYR HB3 H 1 2.377 0.030 . 2 . . . . 24 TYR HB3 . 11213 1
222 . 1 1 24 24 TYR HD1 H 1 6.689 0.030 . 1 . . . . 24 TYR HD1 . 11213 1
223 . 1 1 24 24 TYR HD2 H 1 6.689 0.030 . 1 . . . . 24 TYR HD2 . 11213 1
224 . 1 1 24 24 TYR HE1 H 1 6.646 0.030 . 1 . . . . 24 TYR HE1 . 11213 1
225 . 1 1 24 24 TYR HE2 H 1 6.646 0.030 . 1 . . . . 24 TYR HE2 . 11213 1
226 . 1 1 24 24 TYR C C 13 174.002 0.300 . 1 . . . . 24 TYR C . 11213 1
227 . 1 1 24 24 TYR CA C 13 53.735 0.300 . 1 . . . . 24 TYR CA . 11213 1
228 . 1 1 24 24 TYR CB C 13 42.108 0.300 . 1 . . . . 24 TYR CB . 11213 1
229 . 1 1 24 24 TYR CD1 C 13 133.202 0.300 . 1 . . . . 24 TYR CD1 . 11213 1
230 . 1 1 24 24 TYR CD2 C 13 133.202 0.300 . 1 . . . . 24 TYR CD2 . 11213 1
231 . 1 1 24 24 TYR CE1 C 13 117.559 0.300 . 1 . . . . 24 TYR CE1 . 11213 1
232 . 1 1 24 24 TYR CE2 C 13 117.559 0.300 . 1 . . . . 24 TYR CE2 . 11213 1
233 . 1 1 24 24 TYR N N 15 113.660 0.300 . 1 . . . . 24 TYR N . 11213 1
234 . 1 1 25 25 SER H H 1 8.668 0.030 . 1 . . . . 25 SER H . 11213 1
235 . 1 1 25 25 SER HA H 1 4.594 0.030 . 1 . . . . 25 SER HA . 11213 1
236 . 1 1 25 25 SER HB2 H 1 4.092 0.030 . 2 . . . . 25 SER HB2 . 11213 1
237 . 1 1 25 25 SER HB3 H 1 3.963 0.030 . 2 . . . . 25 SER HB3 . 11213 1
238 . 1 1 25 25 SER C C 13 172.786 0.300 . 1 . . . . 25 SER C . 11213 1
239 . 1 1 25 25 SER CA C 13 58.381 0.300 . 1 . . . . 25 SER CA . 11213 1
240 . 1 1 25 25 SER CB C 13 63.590 0.300 . 1 . . . . 25 SER CB . 11213 1
241 . 1 1 25 25 SER N N 15 114.721 0.300 . 1 . . . . 25 SER N . 11213 1
242 . 1 1 26 26 PHE H H 1 8.280 0.030 . 1 . . . . 26 PHE H . 11213 1
243 . 1 1 26 26 PHE HA H 1 4.706 0.030 . 1 . . . . 26 PHE HA . 11213 1
244 . 1 1 26 26 PHE HB2 H 1 2.314 0.030 . 2 . . . . 26 PHE HB2 . 11213 1
245 . 1 1 26 26 PHE HB3 H 1 1.078 0.030 . 2 . . . . 26 PHE HB3 . 11213 1
246 . 1 1 26 26 PHE HD1 H 1 7.023 0.030 . 1 . . . . 26 PHE HD1 . 11213 1
247 . 1 1 26 26 PHE HD2 H 1 7.023 0.030 . 1 . . . . 26 PHE HD2 . 11213 1
248 . 1 1 26 26 PHE HE1 H 1 7.371 0.030 . 1 . . . . 26 PHE HE1 . 11213 1
249 . 1 1 26 26 PHE HE2 H 1 7.371 0.030 . 1 . . . . 26 PHE HE2 . 11213 1
250 . 1 1 26 26 PHE HZ H 1 7.467 0.030 . 1 . . . . 26 PHE HZ . 11213 1
251 . 1 1 26 26 PHE C C 13 173.230 0.300 . 1 . . . . 26 PHE C . 11213 1
252 . 1 1 26 26 PHE CA C 13 56.861 0.300 . 1 . . . . 26 PHE CA . 11213 1
253 . 1 1 26 26 PHE CB C 13 42.140 0.300 . 1 . . . . 26 PHE CB . 11213 1
254 . 1 1 26 26 PHE CD1 C 13 132.305 0.300 . 1 . . . . 26 PHE CD1 . 11213 1
255 . 1 1 26 26 PHE CD2 C 13 132.305 0.300 . 1 . . . . 26 PHE CD2 . 11213 1
256 . 1 1 26 26 PHE CE1 C 13 130.820 0.300 . 1 . . . . 26 PHE CE1 . 11213 1
257 . 1 1 26 26 PHE CE2 C 13 130.820 0.300 . 1 . . . . 26 PHE CE2 . 11213 1
258 . 1 1 26 26 PHE CZ C 13 129.493 0.300 . 1 . . . . 26 PHE CZ . 11213 1
259 . 1 1 26 26 PHE N N 15 123.929 0.300 . 1 . . . . 26 PHE N . 11213 1
260 . 1 1 27 27 GLU H H 1 7.927 0.030 . 1 . . . . 27 GLU H . 11213 1
261 . 1 1 27 27 GLU HA H 1 4.195 0.030 . 1 . . . . 27 GLU HA . 11213 1
262 . 1 1 27 27 GLU HB2 H 1 1.816 0.030 . 2 . . . . 27 GLU HB2 . 11213 1
263 . 1 1 27 27 GLU HB3 H 1 1.635 0.030 . 2 . . . . 27 GLU HB3 . 11213 1
264 . 1 1 27 27 GLU HG2 H 1 2.035 0.030 . 1 . . . . 27 GLU HG2 . 11213 1
265 . 1 1 27 27 GLU HG3 H 1 2.035 0.030 . 1 . . . . 27 GLU HG3 . 11213 1
266 . 1 1 27 27 GLU C C 13 175.459 0.300 . 1 . . . . 27 GLU C . 11213 1
267 . 1 1 27 27 GLU CA C 13 54.191 0.300 . 1 . . . . 27 GLU CA . 11213 1
268 . 1 1 27 27 GLU CB C 13 30.097 0.300 . 1 . . . . 27 GLU CB . 11213 1
269 . 1 1 27 27 GLU CG C 13 36.100 0.300 . 1 . . . . 27 GLU CG . 11213 1
270 . 1 1 27 27 GLU N N 15 127.822 0.300 . 1 . . . . 27 GLU N . 11213 1
271 . 1 1 28 28 GLY H H 1 6.855 0.030 . 1 . . . . 28 GLY H . 11213 1
272 . 1 1 28 28 GLY HA2 H 1 3.748 0.030 . 2 . . . . 28 GLY HA2 . 11213 1
273 . 1 1 28 28 GLY HA3 H 1 3.575 0.030 . 2 . . . . 28 GLY HA3 . 11213 1
274 . 1 1 28 28 GLY C C 13 173.826 0.300 . 1 . . . . 28 GLY C . 11213 1
275 . 1 1 28 28 GLY CA C 13 46.603 0.300 . 1 . . . . 28 GLY CA . 11213 1
276 . 1 1 28 28 GLY N N 15 109.366 0.300 . 1 . . . . 28 GLY N . 11213 1
277 . 1 1 29 29 GLN H H 1 9.130 0.030 . 1 . . . . 29 GLN H . 11213 1
278 . 1 1 29 29 GLN HA H 1 4.407 0.030 . 1 . . . . 29 GLN HA . 11213 1
279 . 1 1 29 29 GLN HB2 H 1 2.281 0.030 . 2 . . . . 29 GLN HB2 . 11213 1
280 . 1 1 29 29 GLN HB3 H 1 2.005 0.030 . 2 . . . . 29 GLN HB3 . 11213 1
281 . 1 1 29 29 GLN HE21 H 1 7.469 0.030 . 2 . . . . 29 GLN HE21 . 11213 1
282 . 1 1 29 29 GLN HE22 H 1 6.851 0.030 . 2 . . . . 29 GLN HE22 . 11213 1
283 . 1 1 29 29 GLN HG2 H 1 2.393 0.030 . 1 . . . . 29 GLN HG2 . 11213 1
284 . 1 1 29 29 GLN HG3 H 1 2.393 0.030 . 1 . . . . 29 GLN HG3 . 11213 1
285 . 1 1 29 29 GLN C C 13 176.107 0.300 . 1 . . . . 29 GLN C . 11213 1
286 . 1 1 29 29 GLN CA C 13 55.780 0.300 . 1 . . . . 29 GLN CA . 11213 1
287 . 1 1 29 29 GLN CB C 13 30.996 0.300 . 1 . . . . 29 GLN CB . 11213 1
288 . 1 1 29 29 GLN CG C 13 34.052 0.300 . 1 . . . . 29 GLN CG . 11213 1
289 . 1 1 29 29 GLN N N 15 119.862 0.300 . 1 . . . . 29 GLN N . 11213 1
290 . 1 1 29 29 GLN NE2 N 15 113.028 0.300 . 1 . . . . 29 GLN NE2 . 11213 1
291 . 1 1 30 30 GLN H H 1 8.437 0.030 . 1 . . . . 30 GLN H . 11213 1
292 . 1 1 30 30 GLN HA H 1 4.772 0.030 . 1 . . . . 30 GLN HA . 11213 1
293 . 1 1 30 30 GLN HB2 H 1 2.053 0.030 . 2 . . . . 30 GLN HB2 . 11213 1
294 . 1 1 30 30 GLN HB3 H 1 2.007 0.030 . 2 . . . . 30 GLN HB3 . 11213 1
295 . 1 1 30 30 GLN HE21 H 1 6.664 0.030 . 2 . . . . 30 GLN HE21 . 11213 1
296 . 1 1 30 30 GLN HE22 H 1 7.827 0.030 . 2 . . . . 30 GLN HE22 . 11213 1
297 . 1 1 30 30 GLN HG2 H 1 2.332 0.030 . 2 . . . . 30 GLN HG2 . 11213 1
298 . 1 1 30 30 GLN HG3 H 1 2.380 0.030 . 2 . . . . 30 GLN HG3 . 11213 1
299 . 1 1 30 30 GLN C C 13 174.528 0.300 . 1 . . . . 30 GLN C . 11213 1
300 . 1 1 30 30 GLN CA C 13 53.211 0.300 . 1 . . . . 30 GLN CA . 11213 1
301 . 1 1 30 30 GLN CB C 13 28.485 0.300 . 1 . . . . 30 GLN CB . 11213 1
302 . 1 1 30 30 GLN CG C 13 33.166 0.300 . 1 . . . . 30 GLN CG . 11213 1
303 . 1 1 30 30 GLN N N 15 120.239 0.300 . 1 . . . . 30 GLN N . 11213 1
304 . 1 1 30 30 GLN NE2 N 15 113.028 0.300 . 1 . . . . 30 GLN NE2 . 11213 1
305 . 1 1 31 31 PRO HA H 1 4.386 0.030 . 1 . . . . 31 PRO HA . 11213 1
306 . 1 1 31 31 PRO HB2 H 1 2.364 0.030 . 2 . . . . 31 PRO HB2 . 11213 1
307 . 1 1 31 31 PRO HB3 H 1 1.909 0.030 . 2 . . . . 31 PRO HB3 . 11213 1
308 . 1 1 31 31 PRO HD2 H 1 3.671 0.030 . 2 . . . . 31 PRO HD2 . 11213 1
309 . 1 1 31 31 PRO HD3 H 1 3.841 0.030 . 2 . . . . 31 PRO HD3 . 11213 1
310 . 1 1 31 31 PRO HG2 H 1 2.151 0.030 . 2 . . . . 31 PRO HG2 . 11213 1
311 . 1 1 31 31 PRO HG3 H 1 2.017 0.030 . 2 . . . . 31 PRO HG3 . 11213 1
312 . 1 1 31 31 PRO C C 13 178.049 0.300 . 1 . . . . 31 PRO C . 11213 1
313 . 1 1 31 31 PRO CA C 13 64.292 0.300 . 1 . . . . 31 PRO CA . 11213 1
314 . 1 1 31 31 PRO CB C 13 31.400 0.300 . 1 . . . . 31 PRO CB . 11213 1
315 . 1 1 31 31 PRO CD C 13 50.616 0.300 . 1 . . . . 31 PRO CD . 11213 1
316 . 1 1 31 31 PRO CG C 13 27.800 0.300 . 1 . . . . 31 PRO CG . 11213 1
317 . 1 1 32 32 GLY H H 1 8.837 0.030 . 1 . . . . 32 GLY H . 11213 1
318 . 1 1 32 32 GLY HA2 H 1 4.301 0.030 . 2 . . . . 32 GLY HA2 . 11213 1
319 . 1 1 32 32 GLY HA3 H 1 4.006 0.030 . 2 . . . . 32 GLY HA3 . 11213 1
320 . 1 1 32 32 GLY C C 13 174.506 0.300 . 1 . . . . 32 GLY C . 11213 1
321 . 1 1 32 32 GLY CA C 13 45.138 0.300 . 1 . . . . 32 GLY CA . 11213 1
322 . 1 1 32 32 GLY N N 15 112.590 0.300 . 1 . . . . 32 GLY N . 11213 1
323 . 1 1 33 33 ASP H H 1 7.829 0.030 . 1 . . . . 33 ASP H . 11213 1
324 . 1 1 33 33 ASP HA H 1 5.278 0.030 . 1 . . . . 33 ASP HA . 11213 1
325 . 1 1 33 33 ASP HB2 H 1 2.939 0.030 . 2 . . . . 33 ASP HB2 . 11213 1
326 . 1 1 33 33 ASP HB3 H 1 2.841 0.030 . 2 . . . . 33 ASP HB3 . 11213 1
327 . 1 1 33 33 ASP C C 13 177.218 0.300 . 1 . . . . 33 ASP C . 11213 1
328 . 1 1 33 33 ASP CA C 13 54.502 0.300 . 1 . . . . 33 ASP CA . 11213 1
329 . 1 1 33 33 ASP CB C 13 41.603 0.300 . 1 . . . . 33 ASP CB . 11213 1
330 . 1 1 33 33 ASP N N 15 122.783 0.300 . 1 . . . . 33 ASP N . 11213 1
331 . 1 1 34 34 LEU H H 1 9.714 0.030 . 1 . . . . 34 LEU H . 11213 1
332 . 1 1 34 34 LEU HA H 1 4.458 0.030 . 1 . . . . 34 LEU HA . 11213 1
333 . 1 1 34 34 LEU HB2 H 1 1.974 0.030 . 2 . . . . 34 LEU HB2 . 11213 1
334 . 1 1 34 34 LEU HB3 H 1 1.140 0.030 . 2 . . . . 34 LEU HB3 . 11213 1
335 . 1 1 34 34 LEU HD11 H 1 0.742 0.030 . 1 . . . . 34 LEU HD1 . 11213 1
336 . 1 1 34 34 LEU HD12 H 1 0.742 0.030 . 1 . . . . 34 LEU HD1 . 11213 1
337 . 1 1 34 34 LEU HD13 H 1 0.742 0.030 . 1 . . . . 34 LEU HD1 . 11213 1
338 . 1 1 34 34 LEU HD21 H 1 0.927 0.030 . 1 . . . . 34 LEU HD2 . 11213 1
339 . 1 1 34 34 LEU HD22 H 1 0.927 0.030 . 1 . . . . 34 LEU HD2 . 11213 1
340 . 1 1 34 34 LEU HD23 H 1 0.927 0.030 . 1 . . . . 34 LEU HD2 . 11213 1
341 . 1 1 34 34 LEU HG H 1 1.699 0.030 . 1 . . . . 34 LEU HG . 11213 1
342 . 1 1 34 34 LEU C C 13 173.221 0.300 . 1 . . . . 34 LEU C . 11213 1
343 . 1 1 34 34 LEU CA C 13 54.040 0.300 . 1 . . . . 34 LEU CA . 11213 1
344 . 1 1 34 34 LEU CB C 13 44.200 0.300 . 1 . . . . 34 LEU CB . 11213 1
345 . 1 1 34 34 LEU CD1 C 13 25.855 0.300 . 2 . . . . 34 LEU CD1 . 11213 1
346 . 1 1 34 34 LEU CD2 C 13 23.554 0.300 . 2 . . . . 34 LEU CD2 . 11213 1
347 . 1 1 34 34 LEU CG C 13 27.019 0.300 . 1 . . . . 34 LEU CG . 11213 1
348 . 1 1 34 34 LEU N N 15 126.913 0.300 . 1 . . . . 34 LEU N . 11213 1
349 . 1 1 35 35 ASN H H 1 7.690 0.030 . 1 . . . . 35 ASN H . 11213 1
350 . 1 1 35 35 ASN HA H 1 4.930 0.030 . 1 . . . . 35 ASN HA . 11213 1
351 . 1 1 35 35 ASN HB2 H 1 2.662 0.030 . 1 . . . . 35 ASN HB2 . 11213 1
352 . 1 1 35 35 ASN HB3 H 1 2.662 0.030 . 1 . . . . 35 ASN HB3 . 11213 1
353 . 1 1 35 35 ASN HD21 H 1 7.151 0.030 . 2 . . . . 35 ASN HD21 . 11213 1
354 . 1 1 35 35 ASN HD22 H 1 7.365 0.030 . 2 . . . . 35 ASN HD22 . 11213 1
355 . 1 1 35 35 ASN C C 13 175.017 0.300 . 1 . . . . 35 ASN C . 11213 1
356 . 1 1 35 35 ASN CA C 13 52.410 0.300 . 1 . . . . 35 ASN CA . 11213 1
357 . 1 1 35 35 ASN CB C 13 40.905 0.300 . 1 . . . . 35 ASN CB . 11213 1
358 . 1 1 35 35 ASN N N 15 118.815 0.300 . 1 . . . . 35 ASN N . 11213 1
359 . 1 1 35 35 ASN ND2 N 15 113.130 0.300 . 1 . . . . 35 ASN ND2 . 11213 1
360 . 1 1 36 36 PHE H H 1 8.336 0.030 . 1 . . . . 36 PHE H . 11213 1
361 . 1 1 36 36 PHE HA H 1 4.799 0.030 . 1 . . . . 36 PHE HA . 11213 1
362 . 1 1 36 36 PHE HB2 H 1 3.221 0.030 . 1 . . . . 36 PHE HB2 . 11213 1
363 . 1 1 36 36 PHE HB3 H 1 3.221 0.030 . 1 . . . . 36 PHE HB3 . 11213 1
364 . 1 1 36 36 PHE HD1 H 1 6.725 0.030 . 1 . . . . 36 PHE HD1 . 11213 1
365 . 1 1 36 36 PHE HD2 H 1 6.725 0.030 . 1 . . . . 36 PHE HD2 . 11213 1
366 . 1 1 36 36 PHE HE1 H 1 7.222 0.030 . 1 . . . . 36 PHE HE1 . 11213 1
367 . 1 1 36 36 PHE HE2 H 1 7.222 0.030 . 1 . . . . 36 PHE HE2 . 11213 1
368 . 1 1 36 36 PHE HZ H 1 6.593 0.030 . 1 . . . . 36 PHE HZ . 11213 1
369 . 1 1 36 36 PHE C C 13 174.355 0.300 . 1 . . . . 36 PHE C . 11213 1
370 . 1 1 36 36 PHE CA C 13 56.217 0.300 . 1 . . . . 36 PHE CA . 11213 1
371 . 1 1 36 36 PHE CB C 13 40.407 0.300 . 1 . . . . 36 PHE CB . 11213 1
372 . 1 1 36 36 PHE CD1 C 13 132.732 0.300 . 1 . . . . 36 PHE CD1 . 11213 1
373 . 1 1 36 36 PHE CD2 C 13 132.732 0.300 . 1 . . . . 36 PHE CD2 . 11213 1
374 . 1 1 36 36 PHE CE1 C 13 131.264 0.300 . 1 . . . . 36 PHE CE1 . 11213 1
375 . 1 1 36 36 PHE CE2 C 13 131.264 0.300 . 1 . . . . 36 PHE CE2 . 11213 1
376 . 1 1 36 36 PHE CZ C 13 127.718 0.300 . 1 . . . . 36 PHE CZ . 11213 1
377 . 1 1 36 36 PHE N N 15 114.699 0.300 . 1 . . . . 36 PHE N . 11213 1
378 . 1 1 37 37 GLN H H 1 9.581 0.030 . 1 . . . . 37 GLN H . 11213 1
379 . 1 1 37 37 GLN HA H 1 4.867 0.030 . 1 . . . . 37 GLN HA . 11213 1
380 . 1 1 37 37 GLN HB2 H 1 2.096 0.030 . 2 . . . . 37 GLN HB2 . 11213 1
381 . 1 1 37 37 GLN HB3 H 1 1.930 0.030 . 2 . . . . 37 GLN HB3 . 11213 1
382 . 1 1 37 37 GLN HE21 H 1 7.608 0.030 . 2 . . . . 37 GLN HE21 . 11213 1
383 . 1 1 37 37 GLN HE22 H 1 6.885 0.030 . 2 . . . . 37 GLN HE22 . 11213 1
384 . 1 1 37 37 GLN HG2 H 1 2.381 0.030 . 1 . . . . 37 GLN HG2 . 11213 1
385 . 1 1 37 37 GLN HG3 H 1 2.381 0.030 . 1 . . . . 37 GLN HG3 . 11213 1
386 . 1 1 37 37 GLN C C 13 175.438 0.300 . 1 . . . . 37 GLN C . 11213 1
387 . 1 1 37 37 GLN CA C 13 53.181 0.300 . 1 . . . . 37 GLN CA . 11213 1
388 . 1 1 37 37 GLN CB C 13 31.809 0.300 . 1 . . . . 37 GLN CB . 11213 1
389 . 1 1 37 37 GLN CG C 13 34.265 0.300 . 1 . . . . 37 GLN CG . 11213 1
390 . 1 1 37 37 GLN N N 15 120.121 0.300 . 1 . . . . 37 GLN N . 11213 1
391 . 1 1 37 37 GLN NE2 N 15 113.356 0.300 . 1 . . . . 37 GLN NE2 . 11213 1
392 . 1 1 38 38 ALA H H 1 8.141 0.030 . 1 . . . . 38 ALA H . 11213 1
393 . 1 1 38 38 ALA HA H 1 3.430 0.030 . 1 . . . . 38 ALA HA . 11213 1
394 . 1 1 38 38 ALA HB1 H 1 1.203 0.030 . 1 . . . . 38 ALA HB . 11213 1
395 . 1 1 38 38 ALA HB2 H 1 1.203 0.030 . 1 . . . . 38 ALA HB . 11213 1
396 . 1 1 38 38 ALA HB3 H 1 1.203 0.030 . 1 . . . . 38 ALA HB . 11213 1
397 . 1 1 38 38 ALA C C 13 177.978 0.300 . 1 . . . . 38 ALA C . 11213 1
398 . 1 1 38 38 ALA CA C 13 53.953 0.300 . 1 . . . . 38 ALA CA . 11213 1
399 . 1 1 38 38 ALA CB C 13 17.915 0.300 . 1 . . . . 38 ALA CB . 11213 1
400 . 1 1 38 38 ALA N N 15 123.929 0.300 . 1 . . . . 38 ALA N . 11213 1
401 . 1 1 39 39 GLY H H 1 8.858 0.030 . 1 . . . . 39 GLY H . 11213 1
402 . 1 1 39 39 GLY HA2 H 1 4.407 0.030 . 2 . . . . 39 GLY HA2 . 11213 1
403 . 1 1 39 39 GLY HA3 H 1 3.402 0.030 . 2 . . . . 39 GLY HA3 . 11213 1
404 . 1 1 39 39 GLY C C 13 174.430 0.300 . 1 . . . . 39 GLY C . 11213 1
405 . 1 1 39 39 GLY CA C 13 44.807 0.300 . 1 . . . . 39 GLY CA . 11213 1
406 . 1 1 39 39 GLY N N 15 111.814 0.300 . 1 . . . . 39 GLY N . 11213 1
407 . 1 1 40 40 ASP H H 1 8.226 0.030 . 1 . . . . 40 ASP H . 11213 1
408 . 1 1 40 40 ASP HA H 1 4.598 0.030 . 1 . . . . 40 ASP HA . 11213 1
409 . 1 1 40 40 ASP HB2 H 1 2.863 0.030 . 2 . . . . 40 ASP HB2 . 11213 1
410 . 1 1 40 40 ASP HB3 H 1 2.351 0.030 . 2 . . . . 40 ASP HB3 . 11213 1
411 . 1 1 40 40 ASP C C 13 174.944 0.300 . 1 . . . . 40 ASP C . 11213 1
412 . 1 1 40 40 ASP CA C 13 55.713 0.300 . 1 . . . . 40 ASP CA . 11213 1
413 . 1 1 40 40 ASP CB C 13 41.624 0.300 . 1 . . . . 40 ASP CB . 11213 1
414 . 1 1 40 40 ASP N N 15 121.748 0.300 . 1 . . . . 40 ASP N . 11213 1
415 . 1 1 41 41 ARG H H 1 8.295 0.030 . 1 . . . . 41 ARG H . 11213 1
416 . 1 1 41 41 ARG HA H 1 5.059 0.030 . 1 . . . . 41 ARG HA . 11213 1
417 . 1 1 41 41 ARG HB2 H 1 1.683 0.030 . 1 . . . . 41 ARG HB2 . 11213 1
418 . 1 1 41 41 ARG HB3 H 1 1.683 0.030 . 1 . . . . 41 ARG HB3 . 11213 1
419 . 1 1 41 41 ARG HD2 H 1 3.116 0.030 . 1 . . . . 41 ARG HD2 . 11213 1
420 . 1 1 41 41 ARG HD3 H 1 3.116 0.030 . 1 . . . . 41 ARG HD3 . 11213 1
421 . 1 1 41 41 ARG HG2 H 1 1.584 0.030 . 2 . . . . 41 ARG HG2 . 11213 1
422 . 1 1 41 41 ARG HG3 H 1 1.543 0.030 . 2 . . . . 41 ARG HG3 . 11213 1
423 . 1 1 41 41 ARG C C 13 175.399 0.300 . 1 . . . . 41 ARG C . 11213 1
424 . 1 1 41 41 ARG CA C 13 54.383 0.300 . 1 . . . . 41 ARG CA . 11213 1
425 . 1 1 41 41 ARG CB C 13 30.569 0.300 . 1 . . . . 41 ARG CB . 11213 1
426 . 1 1 41 41 ARG CD C 13 43.256 0.300 . 1 . . . . 41 ARG CD . 11213 1
427 . 1 1 41 41 ARG CG C 13 27.052 0.300 . 1 . . . . 41 ARG CG . 11213 1
428 . 1 1 41 41 ARG N N 15 120.383 0.300 . 1 . . . . 41 ARG N . 11213 1
429 . 1 1 42 42 ILE H H 1 8.678 0.030 . 1 . . . . 42 ILE H . 11213 1
430 . 1 1 42 42 ILE HA H 1 4.069 0.030 . 1 . . . . 42 ILE HA . 11213 1
431 . 1 1 42 42 ILE HB H 1 1.056 0.030 . 1 . . . . 42 ILE HB . 11213 1
432 . 1 1 42 42 ILE HD11 H 1 -0.636 0.030 . 1 . . . . 42 ILE HD1 . 11213 1
433 . 1 1 42 42 ILE HD12 H 1 -0.636 0.030 . 1 . . . . 42 ILE HD1 . 11213 1
434 . 1 1 42 42 ILE HD13 H 1 -0.636 0.030 . 1 . . . . 42 ILE HD1 . 11213 1
435 . 1 1 42 42 ILE HG12 H 1 0.905 0.030 . 2 . . . . 42 ILE HG12 . 11213 1
436 . 1 1 42 42 ILE HG13 H 1 0.340 0.030 . 2 . . . . 42 ILE HG13 . 11213 1
437 . 1 1 42 42 ILE HG21 H 1 0.384 0.030 . 1 . . . . 42 ILE HG2 . 11213 1
438 . 1 1 42 42 ILE HG22 H 1 0.384 0.030 . 1 . . . . 42 ILE HG2 . 11213 1
439 . 1 1 42 42 ILE HG23 H 1 0.384 0.030 . 1 . . . . 42 ILE HG2 . 11213 1
440 . 1 1 42 42 ILE C C 13 175.519 0.300 . 1 . . . . 42 ILE C . 11213 1
441 . 1 1 42 42 ILE CA C 13 60.473 0.300 . 1 . . . . 42 ILE CA . 11213 1
442 . 1 1 42 42 ILE CB C 13 41.787 0.300 . 1 . . . . 42 ILE CB . 11213 1
443 . 1 1 42 42 ILE CD1 C 13 13.835 0.300 . 1 . . . . 42 ILE CD1 . 11213 1
444 . 1 1 42 42 ILE CG1 C 13 28.756 0.300 . 1 . . . . 42 ILE CG1 . 11213 1
445 . 1 1 42 42 ILE CG2 C 13 18.014 0.300 . 1 . . . . 42 ILE CG2 . 11213 1
446 . 1 1 42 42 ILE N N 15 126.784 0.300 . 1 . . . . 42 ILE N . 11213 1
447 . 1 1 43 43 THR H H 1 8.442 0.030 . 1 . . . . 43 THR H . 11213 1
448 . 1 1 43 43 THR HA H 1 4.684 0.030 . 1 . . . . 43 THR HA . 11213 1
449 . 1 1 43 43 THR HB H 1 4.094 0.030 . 1 . . . . 43 THR HB . 11213 1
450 . 1 1 43 43 THR HG21 H 1 1.157 0.030 . 1 . . . . 43 THR HG2 . 11213 1
451 . 1 1 43 43 THR HG22 H 1 1.157 0.030 . 1 . . . . 43 THR HG2 . 11213 1
452 . 1 1 43 43 THR HG23 H 1 1.157 0.030 . 1 . . . . 43 THR HG2 . 11213 1
453 . 1 1 43 43 THR C C 13 173.924 0.300 . 1 . . . . 43 THR C . 11213 1
454 . 1 1 43 43 THR CA C 13 62.833 0.300 . 1 . . . . 43 THR CA . 11213 1
455 . 1 1 43 43 THR CB C 13 69.496 0.300 . 1 . . . . 43 THR CB . 11213 1
456 . 1 1 43 43 THR CG2 C 13 21.500 0.300 . 1 . . . . 43 THR CG2 . 11213 1
457 . 1 1 43 43 THR N N 15 123.799 0.300 . 1 . . . . 43 THR N . 11213 1
458 . 1 1 44 44 VAL H H 1 9.454 0.030 . 1 . . . . 44 VAL H . 11213 1
459 . 1 1 44 44 VAL HA H 1 4.242 0.030 . 1 . . . . 44 VAL HA . 11213 1
460 . 1 1 44 44 VAL HB H 1 2.102 0.030 . 1 . . . . 44 VAL HB . 11213 1
461 . 1 1 44 44 VAL HG11 H 1 1.164 0.030 . 1 . . . . 44 VAL HG1 . 11213 1
462 . 1 1 44 44 VAL HG12 H 1 1.164 0.030 . 1 . . . . 44 VAL HG1 . 11213 1
463 . 1 1 44 44 VAL HG13 H 1 1.164 0.030 . 1 . . . . 44 VAL HG1 . 11213 1
464 . 1 1 44 44 VAL HG21 H 1 0.846 0.030 . 1 . . . . 44 VAL HG2 . 11213 1
465 . 1 1 44 44 VAL HG22 H 1 0.846 0.030 . 1 . . . . 44 VAL HG2 . 11213 1
466 . 1 1 44 44 VAL HG23 H 1 0.846 0.030 . 1 . . . . 44 VAL HG2 . 11213 1
467 . 1 1 44 44 VAL C C 13 175.255 0.300 . 1 . . . . 44 VAL C . 11213 1
468 . 1 1 44 44 VAL CA C 13 64.143 0.300 . 1 . . . . 44 VAL CA . 11213 1
469 . 1 1 44 44 VAL CB C 13 31.983 0.300 . 1 . . . . 44 VAL CB . 11213 1
470 . 1 1 44 44 VAL CG1 C 13 24.912 0.300 . 2 . . . . 44 VAL CG1 . 11213 1
471 . 1 1 44 44 VAL CG2 C 13 22.243 0.300 . 2 . . . . 44 VAL CG2 . 11213 1
472 . 1 1 44 44 VAL N N 15 129.768 0.300 . 1 . . . . 44 VAL N . 11213 1
473 . 1 1 45 45 ILE H H 1 9.005 0.030 . 1 . . . . 45 ILE H . 11213 1
474 . 1 1 45 45 ILE HA H 1 4.367 0.030 . 1 . . . . 45 ILE HA . 11213 1
475 . 1 1 45 45 ILE HB H 1 1.761 0.030 . 1 . . . . 45 ILE HB . 11213 1
476 . 1 1 45 45 ILE HD11 H 1 0.792 0.030 . 1 . . . . 45 ILE HD1 . 11213 1
477 . 1 1 45 45 ILE HD12 H 1 0.792 0.030 . 1 . . . . 45 ILE HD1 . 11213 1
478 . 1 1 45 45 ILE HD13 H 1 0.792 0.030 . 1 . . . . 45 ILE HD1 . 11213 1
479 . 1 1 45 45 ILE HG12 H 1 1.398 0.030 . 2 . . . . 45 ILE HG12 . 11213 1
480 . 1 1 45 45 ILE HG13 H 1 0.964 0.030 . 2 . . . . 45 ILE HG13 . 11213 1
481 . 1 1 45 45 ILE HG21 H 1 0.876 0.030 . 1 . . . . 45 ILE HG2 . 11213 1
482 . 1 1 45 45 ILE HG22 H 1 0.876 0.030 . 1 . . . . 45 ILE HG2 . 11213 1
483 . 1 1 45 45 ILE HG23 H 1 0.876 0.030 . 1 . . . . 45 ILE HG2 . 11213 1
484 . 1 1 45 45 ILE C C 13 176.414 0.300 . 1 . . . . 45 ILE C . 11213 1
485 . 1 1 45 45 ILE CA C 13 61.479 0.300 . 1 . . . . 45 ILE CA . 11213 1
486 . 1 1 45 45 ILE CB C 13 39.174 0.300 . 1 . . . . 45 ILE CB . 11213 1
487 . 1 1 45 45 ILE CD1 C 13 13.243 0.300 . 1 . . . . 45 ILE CD1 . 11213 1
488 . 1 1 45 45 ILE CG1 C 13 26.848 0.300 . 1 . . . . 45 ILE CG1 . 11213 1
489 . 1 1 45 45 ILE CG2 C 13 17.548 0.300 . 1 . . . . 45 ILE CG2 . 11213 1
490 . 1 1 45 45 ILE N N 15 124.059 0.300 . 1 . . . . 45 ILE N . 11213 1
491 . 1 1 46 46 SER H H 1 7.772 0.030 . 1 . . . . 46 SER H . 11213 1
492 . 1 1 46 46 SER HA H 1 4.649 0.030 . 1 . . . . 46 SER HA . 11213 1
493 . 1 1 46 46 SER HB2 H 1 3.808 0.030 . 1 . . . . 46 SER HB2 . 11213 1
494 . 1 1 46 46 SER HB3 H 1 3.808 0.030 . 1 . . . . 46 SER HB3 . 11213 1
495 . 1 1 46 46 SER C C 13 171.968 0.300 . 1 . . . . 46 SER C . 11213 1
496 . 1 1 46 46 SER CA C 13 57.984 0.300 . 1 . . . . 46 SER CA . 11213 1
497 . 1 1 46 46 SER CB C 13 64.754 0.300 . 1 . . . . 46 SER CB . 11213 1
498 . 1 1 46 46 SER N N 15 115.448 0.300 . 1 . . . . 46 SER N . 11213 1
499 . 1 1 47 47 LYS H H 1 8.405 0.030 . 1 . . . . 47 LYS H . 11213 1
500 . 1 1 47 47 LYS HA H 1 4.198 0.030 . 1 . . . . 47 LYS HA . 11213 1
501 . 1 1 47 47 LYS HB2 H 1 0.846 0.030 . 2 . . . . 47 LYS HB2 . 11213 1
502 . 1 1 47 47 LYS HB3 H 1 0.046 0.030 . 2 . . . . 47 LYS HB3 . 11213 1
503 . 1 1 47 47 LYS HD2 H 1 1.295 0.030 . 2 . . . . 47 LYS HD2 . 11213 1
504 . 1 1 47 47 LYS HD3 H 1 0.824 0.030 . 2 . . . . 47 LYS HD3 . 11213 1
505 . 1 1 47 47 LYS HE2 H 1 2.540 0.030 . 2 . . . . 47 LYS HE2 . 11213 1
506 . 1 1 47 47 LYS HE3 H 1 2.110 0.030 . 2 . . . . 47 LYS HE3 . 11213 1
507 . 1 1 47 47 LYS HG2 H 1 0.601 0.030 . 2 . . . . 47 LYS HG2 . 11213 1
508 . 1 1 47 47 LYS HG3 H 1 0.890 0.030 . 2 . . . . 47 LYS HG3 . 11213 1
509 . 1 1 47 47 LYS C C 13 174.603 0.300 . 1 . . . . 47 LYS C . 11213 1
510 . 1 1 47 47 LYS CA C 13 54.936 0.300 . 1 . . . . 47 LYS CA . 11213 1
511 . 1 1 47 47 LYS CB C 13 33.133 0.300 . 1 . . . . 47 LYS CB . 11213 1
512 . 1 1 47 47 LYS CD C 13 28.525 0.300 . 1 . . . . 47 LYS CD . 11213 1
513 . 1 1 47 47 LYS CE C 13 40.394 0.300 . 1 . . . . 47 LYS CE . 11213 1
514 . 1 1 47 47 LYS CG C 13 20.926 0.300 . 1 . . . . 47 LYS CG . 11213 1
515 . 1 1 47 47 LYS N N 15 120.703 0.300 . 1 . . . . 47 LYS N . 11213 1
516 . 1 1 48 48 THR H H 1 6.519 0.030 . 1 . . . . 48 THR H . 11213 1
517 . 1 1 48 48 THR HA H 1 4.579 0.030 . 1 . . . . 48 THR HA . 11213 1
518 . 1 1 48 48 THR HB H 1 4.535 0.030 . 1 . . . . 48 THR HB . 11213 1
519 . 1 1 48 48 THR HG21 H 1 1.130 0.030 . 1 . . . . 48 THR HG2 . 11213 1
520 . 1 1 48 48 THR HG22 H 1 1.130 0.030 . 1 . . . . 48 THR HG2 . 11213 1
521 . 1 1 48 48 THR HG23 H 1 1.130 0.030 . 1 . . . . 48 THR HG2 . 11213 1
522 . 1 1 48 48 THR C C 13 174.135 0.300 . 1 . . . . 48 THR C . 11213 1
523 . 1 1 48 48 THR CA C 13 59.682 0.300 . 1 . . . . 48 THR CA . 11213 1
524 . 1 1 48 48 THR CB C 13 70.320 0.300 . 1 . . . . 48 THR CB . 11213 1
525 . 1 1 48 48 THR CG2 C 13 21.590 0.300 . 1 . . . . 48 THR CG2 . 11213 1
526 . 1 1 48 48 THR N N 15 110.981 0.300 . 1 . . . . 48 THR N . 11213 1
527 . 1 1 49 49 ASP H H 1 8.329 0.030 . 1 . . . . 49 ASP H . 11213 1
528 . 1 1 49 49 ASP HA H 1 4.703 0.030 . 1 . . . . 49 ASP HA . 11213 1
529 . 1 1 49 49 ASP HB2 H 1 2.815 0.030 . 2 . . . . 49 ASP HB2 . 11213 1
530 . 1 1 49 49 ASP HB3 H 1 2.646 0.030 . 2 . . . . 49 ASP HB3 . 11213 1
531 . 1 1 49 49 ASP C C 13 176.306 0.300 . 1 . . . . 49 ASP C . 11213 1
532 . 1 1 49 49 ASP CA C 13 54.466 0.300 . 1 . . . . 49 ASP CA . 11213 1
533 . 1 1 49 49 ASP CB C 13 41.045 0.300 . 1 . . . . 49 ASP CB . 11213 1
534 . 1 1 49 49 ASP N N 15 117.011 0.300 . 1 . . . . 49 ASP N . 11213 1
535 . 1 1 50 50 SER H H 1 8.273 0.030 . 1 . . . . 50 SER H . 11213 1
536 . 1 1 50 50 SER HA H 1 4.806 0.030 . 1 . . . . 50 SER HA . 11213 1
537 . 1 1 50 50 SER HB2 H 1 3.813 0.030 . 2 . . . . 50 SER HB2 . 11213 1
538 . 1 1 50 50 SER HB3 H 1 3.896 0.030 . 2 . . . . 50 SER HB3 . 11213 1
539 . 1 1 50 50 SER C C 13 175.124 0.300 . 1 . . . . 50 SER C . 11213 1
540 . 1 1 50 50 SER CA C 13 56.945 0.300 . 1 . . . . 50 SER CA . 11213 1
541 . 1 1 50 50 SER CB C 13 64.467 0.300 . 1 . . . . 50 SER CB . 11213 1
542 . 1 1 50 50 SER N N 15 113.756 0.300 . 1 . . . . 50 SER N . 11213 1
543 . 1 1 51 51 HIS HA H 1 4.097 0.030 . 1 . . . . 51 HIS HA . 11213 1
544 . 1 1 51 51 HIS HB2 H 1 2.800 0.030 . 2 . . . . 51 HIS HB2 . 11213 1
545 . 1 1 51 51 HIS HB3 H 1 2.746 0.030 . 2 . . . . 51 HIS HB3 . 11213 1
546 . 1 1 51 51 HIS HD2 H 1 6.718 0.030 . 1 . . . . 51 HIS HD2 . 11213 1
547 . 1 1 51 51 HIS HE1 H 1 7.751 0.030 . 1 . . . . 51 HIS HE1 . 11213 1
548 . 1 1 51 51 HIS C C 13 173.548 0.300 . 1 . . . . 51 HIS C . 11213 1
549 . 1 1 51 51 HIS CA C 13 56.756 0.300 . 1 . . . . 51 HIS CA . 11213 1
550 . 1 1 51 51 HIS CB C 13 28.629 0.300 . 1 . . . . 51 HIS CB . 11213 1
551 . 1 1 51 51 HIS CD2 C 13 121.640 0.300 . 1 . . . . 51 HIS CD2 . 11213 1
552 . 1 1 51 51 HIS CE1 C 13 137.458 0.300 . 1 . . . . 51 HIS CE1 . 11213 1
553 . 1 1 52 52 PHE H H 1 7.966 0.030 . 1 . . . . 52 PHE H . 11213 1
554 . 1 1 52 52 PHE HA H 1 4.563 0.030 . 1 . . . . 52 PHE HA . 11213 1
555 . 1 1 52 52 PHE HB2 H 1 3.347 0.030 . 2 . . . . 52 PHE HB2 . 11213 1
556 . 1 1 52 52 PHE HB3 H 1 2.742 0.030 . 2 . . . . 52 PHE HB3 . 11213 1
557 . 1 1 52 52 PHE HD1 H 1 7.215 0.030 . 1 . . . . 52 PHE HD1 . 11213 1
558 . 1 1 52 52 PHE HD2 H 1 7.215 0.030 . 1 . . . . 52 PHE HD2 . 11213 1
559 . 1 1 52 52 PHE HE1 H 1 7.371 0.030 . 1 . . . . 52 PHE HE1 . 11213 1
560 . 1 1 52 52 PHE HE2 H 1 7.371 0.030 . 1 . . . . 52 PHE HE2 . 11213 1
561 . 1 1 52 52 PHE HZ H 1 7.318 0.030 . 1 . . . . 52 PHE HZ . 11213 1
562 . 1 1 52 52 PHE C C 13 175.671 0.300 . 1 . . . . 52 PHE C . 11213 1
563 . 1 1 52 52 PHE CA C 13 57.685 0.300 . 1 . . . . 52 PHE CA . 11213 1
564 . 1 1 52 52 PHE CB C 13 38.940 0.300 . 1 . . . . 52 PHE CB . 11213 1
565 . 1 1 52 52 PHE CD1 C 13 131.220 0.300 . 1 . . . . 52 PHE CD1 . 11213 1
566 . 1 1 52 52 PHE CD2 C 13 131.220 0.300 . 1 . . . . 52 PHE CD2 . 11213 1
567 . 1 1 52 52 PHE CE1 C 13 131.234 0.300 . 1 . . . . 52 PHE CE1 . 11213 1
568 . 1 1 52 52 PHE CE2 C 13 131.234 0.300 . 1 . . . . 52 PHE CE2 . 11213 1
569 . 1 1 52 52 PHE CZ C 13 129.660 0.300 . 1 . . . . 52 PHE CZ . 11213 1
570 . 1 1 52 52 PHE N N 15 116.520 0.300 . 1 . . . . 52 PHE N . 11213 1
571 . 1 1 53 53 ASP H H 1 7.080 0.030 . 1 . . . . 53 ASP H . 11213 1
572 . 1 1 53 53 ASP HA H 1 4.881 0.030 . 1 . . . . 53 ASP HA . 11213 1
573 . 1 1 53 53 ASP HB2 H 1 2.978 0.030 . 2 . . . . 53 ASP HB2 . 11213 1
574 . 1 1 53 53 ASP HB3 H 1 2.729 0.030 . 2 . . . . 53 ASP HB3 . 11213 1
575 . 1 1 53 53 ASP C C 13 174.388 0.300 . 1 . . . . 53 ASP C . 11213 1
576 . 1 1 53 53 ASP CA C 13 53.820 0.300 . 1 . . . . 53 ASP CA . 11213 1
577 . 1 1 53 53 ASP CB C 13 42.761 0.300 . 1 . . . . 53 ASP CB . 11213 1
578 . 1 1 53 53 ASP N N 15 119.304 0.300 . 1 . . . . 53 ASP N . 11213 1
579 . 1 1 54 54 TRP H H 1 8.554 0.030 . 1 . . . . 54 TRP H . 11213 1
580 . 1 1 54 54 TRP HA H 1 4.853 0.030 . 1 . . . . 54 TRP HA . 11213 1
581 . 1 1 54 54 TRP HB2 H 1 2.921 0.030 . 2 . . . . 54 TRP HB2 . 11213 1
582 . 1 1 54 54 TRP HB3 H 1 2.886 0.030 . 2 . . . . 54 TRP HB3 . 11213 1
583 . 1 1 54 54 TRP HD1 H 1 7.258 0.030 . 1 . . . . 54 TRP HD1 . 11213 1
584 . 1 1 54 54 TRP HE1 H 1 10.142 0.030 . 1 . . . . 54 TRP HE1 . 11213 1
585 . 1 1 54 54 TRP HE3 H 1 7.123 0.030 . 1 . . . . 54 TRP HE3 . 11213 1
586 . 1 1 54 54 TRP HH2 H 1 7.358 0.030 . 1 . . . . 54 TRP HH2 . 11213 1
587 . 1 1 54 54 TRP HZ2 H 1 7.439 0.030 . 1 . . . . 54 TRP HZ2 . 11213 1
588 . 1 1 54 54 TRP HZ3 H 1 7.080 0.030 . 1 . . . . 54 TRP HZ3 . 11213 1
589 . 1 1 54 54 TRP C C 13 175.955 0.300 . 1 . . . . 54 TRP C . 11213 1
590 . 1 1 54 54 TRP CA C 13 56.928 0.300 . 1 . . . . 54 TRP CA . 11213 1
591 . 1 1 54 54 TRP CB C 13 28.581 0.300 . 1 . . . . 54 TRP CB . 11213 1
592 . 1 1 54 54 TRP CD1 C 13 125.830 0.300 . 1 . . . . 54 TRP CD1 . 11213 1
593 . 1 1 54 54 TRP CE3 C 13 119.800 0.300 . 1 . . . . 54 TRP CE3 . 11213 1
594 . 1 1 54 54 TRP CH2 C 13 124.675 0.300 . 1 . . . . 54 TRP CH2 . 11213 1
595 . 1 1 54 54 TRP CZ2 C 13 114.279 0.300 . 1 . . . . 54 TRP CZ2 . 11213 1
596 . 1 1 54 54 TRP CZ3 C 13 121.536 0.300 . 1 . . . . 54 TRP CZ3 . 11213 1
597 . 1 1 54 54 TRP N N 15 119.605 0.300 . 1 . . . . 54 TRP N . 11213 1
598 . 1 1 54 54 TRP NE1 N 15 130.254 0.300 . 1 . . . . 54 TRP NE1 . 11213 1
599 . 1 1 55 55 TRP H H 1 8.199 0.030 . 1 . . . . 55 TRP H . 11213 1
600 . 1 1 55 55 TRP HA H 1 5.122 0.030 . 1 . . . . 55 TRP HA . 11213 1
601 . 1 1 55 55 TRP HB2 H 1 3.236 0.030 . 2 . . . . 55 TRP HB2 . 11213 1
602 . 1 1 55 55 TRP HB3 H 1 2.152 0.030 . 2 . . . . 55 TRP HB3 . 11213 1
603 . 1 1 55 55 TRP HD1 H 1 6.968 0.030 . 1 . . . . 55 TRP HD1 . 11213 1
604 . 1 1 55 55 TRP HE1 H 1 9.685 0.030 . 1 . . . . 55 TRP HE1 . 11213 1
605 . 1 1 55 55 TRP HE3 H 1 7.355 0.030 . 1 . . . . 55 TRP HE3 . 11213 1
606 . 1 1 55 55 TRP HH2 H 1 6.880 0.030 . 1 . . . . 55 TRP HH2 . 11213 1
607 . 1 1 55 55 TRP HZ2 H 1 6.967 0.030 . 1 . . . . 55 TRP HZ2 . 11213 1
608 . 1 1 55 55 TRP HZ3 H 1 6.844 0.030 . 1 . . . . 55 TRP HZ3 . 11213 1
609 . 1 1 55 55 TRP C C 13 172.736 0.300 . 1 . . . . 55 TRP C . 11213 1
610 . 1 1 55 55 TRP CA C 13 52.375 0.300 . 1 . . . . 55 TRP CA . 11213 1
611 . 1 1 55 55 TRP CB C 13 32.773 0.300 . 1 . . . . 55 TRP CB . 11213 1
612 . 1 1 55 55 TRP CD1 C 13 121.938 0.300 . 1 . . . . 55 TRP CD1 . 11213 1
613 . 1 1 55 55 TRP CE3 C 13 119.560 0.300 . 1 . . . . 55 TRP CE3 . 11213 1
614 . 1 1 55 55 TRP CH2 C 13 124.593 0.300 . 1 . . . . 55 TRP CH2 . 11213 1
615 . 1 1 55 55 TRP CZ2 C 13 115.101 0.300 . 1 . . . . 55 TRP CZ2 . 11213 1
616 . 1 1 55 55 TRP CZ3 C 13 120.910 0.300 . 1 . . . . 55 TRP CZ3 . 11213 1
617 . 1 1 55 55 TRP N N 15 124.901 0.300 . 1 . . . . 55 TRP N . 11213 1
618 . 1 1 55 55 TRP NE1 N 15 126.788 0.300 . 1 . . . . 55 TRP NE1 . 11213 1
619 . 1 1 56 56 GLU H H 1 8.520 0.030 . 1 . . . . 56 GLU H . 11213 1
620 . 1 1 56 56 GLU HA H 1 5.265 0.030 . 1 . . . . 56 GLU HA . 11213 1
621 . 1 1 56 56 GLU HB2 H 1 2.141 0.030 . 2 . . . . 56 GLU HB2 . 11213 1
622 . 1 1 56 56 GLU HB3 H 1 1.826 0.030 . 2 . . . . 56 GLU HB3 . 11213 1
623 . 1 1 56 56 GLU HG2 H 1 2.096 0.030 . 2 . . . . 56 GLU HG2 . 11213 1
624 . 1 1 56 56 GLU HG3 H 1 2.213 0.030 . 2 . . . . 56 GLU HG3 . 11213 1
625 . 1 1 56 56 GLU C C 13 177.059 0.300 . 1 . . . . 56 GLU C . 11213 1
626 . 1 1 56 56 GLU CA C 13 54.848 0.300 . 1 . . . . 56 GLU CA . 11213 1
627 . 1 1 56 56 GLU CB C 13 33.595 0.300 . 1 . . . . 56 GLU CB . 11213 1
628 . 1 1 56 56 GLU CG C 13 36.460 0.300 . 1 . . . . 56 GLU CG . 11213 1
629 . 1 1 56 56 GLU N N 15 118.601 0.300 . 1 . . . . 56 GLU N . 11213 1
630 . 1 1 57 57 GLY H H 1 9.769 0.030 . 1 . . . . 57 GLY H . 11213 1
631 . 1 1 57 57 GLY HA2 H 1 5.384 0.030 . 2 . . . . 57 GLY HA2 . 11213 1
632 . 1 1 57 57 GLY HA3 H 1 3.784 0.030 . 2 . . . . 57 GLY HA3 . 11213 1
633 . 1 1 57 57 GLY C C 13 169.745 0.300 . 1 . . . . 57 GLY C . 11213 1
634 . 1 1 57 57 GLY CA C 13 45.796 0.300 . 1 . . . . 57 GLY CA . 11213 1
635 . 1 1 57 57 GLY N N 15 113.701 0.300 . 1 . . . . 57 GLY N . 11213 1
636 . 1 1 58 58 LYS H H 1 9.143 0.030 . 1 . . . . 58 LYS H . 11213 1
637 . 1 1 58 58 LYS HA H 1 5.635 0.030 . 1 . . . . 58 LYS HA . 11213 1
638 . 1 1 58 58 LYS HB2 H 1 1.780 0.030 . 2 . . . . 58 LYS HB2 . 11213 1
639 . 1 1 58 58 LYS HB3 H 1 1.581 0.030 . 2 . . . . 58 LYS HB3 . 11213 1
640 . 1 1 58 58 LYS HD2 H 1 1.612 0.030 . 1 . . . . 58 LYS HD2 . 11213 1
641 . 1 1 58 58 LYS HD3 H 1 1.612 0.030 . 1 . . . . 58 LYS HD3 . 11213 1
642 . 1 1 58 58 LYS HE2 H 1 2.866 0.030 . 1 . . . . 58 LYS HE2 . 11213 1
643 . 1 1 58 58 LYS HE3 H 1 2.866 0.030 . 1 . . . . 58 LYS HE3 . 11213 1
644 . 1 1 58 58 LYS HG2 H 1 1.453 0.030 . 2 . . . . 58 LYS HG2 . 11213 1
645 . 1 1 58 58 LYS HG3 H 1 1.300 0.030 . 2 . . . . 58 LYS HG3 . 11213 1
646 . 1 1 58 58 LYS C C 13 175.181 0.300 . 1 . . . . 58 LYS C . 11213 1
647 . 1 1 58 58 LYS CA C 13 54.526 0.300 . 1 . . . . 58 LYS CA . 11213 1
648 . 1 1 58 58 LYS CB C 13 36.945 0.300 . 1 . . . . 58 LYS CB . 11213 1
649 . 1 1 58 58 LYS CD C 13 29.746 0.300 . 1 . . . . 58 LYS CD . 11213 1
650 . 1 1 58 58 LYS CE C 13 41.906 0.300 . 1 . . . . 58 LYS CE . 11213 1
651 . 1 1 58 58 LYS CG C 13 24.648 0.300 . 1 . . . . 58 LYS CG . 11213 1
652 . 1 1 58 58 LYS N N 15 117.989 0.300 . 1 . . . . 58 LYS N . 11213 1
653 . 1 1 59 59 LEU H H 1 8.837 0.030 . 1 . . . . 59 LEU H . 11213 1
654 . 1 1 59 59 LEU HA H 1 4.665 0.030 . 1 . . . . 59 LEU HA . 11213 1
655 . 1 1 59 59 LEU HB2 H 1 1.892 0.030 . 2 . . . . 59 LEU HB2 . 11213 1
656 . 1 1 59 59 LEU HB3 H 1 1.465 0.030 . 2 . . . . 59 LEU HB3 . 11213 1
657 . 1 1 59 59 LEU HD11 H 1 1.079 0.030 . 1 . . . . 59 LEU HD1 . 11213 1
658 . 1 1 59 59 LEU HD12 H 1 1.079 0.030 . 1 . . . . 59 LEU HD1 . 11213 1
659 . 1 1 59 59 LEU HD13 H 1 1.079 0.030 . 1 . . . . 59 LEU HD1 . 11213 1
660 . 1 1 59 59 LEU HD21 H 1 1.026 0.030 . 1 . . . . 59 LEU HD2 . 11213 1
661 . 1 1 59 59 LEU HD22 H 1 1.026 0.030 . 1 . . . . 59 LEU HD2 . 11213 1
662 . 1 1 59 59 LEU HD23 H 1 1.026 0.030 . 1 . . . . 59 LEU HD2 . 11213 1
663 . 1 1 59 59 LEU HG H 1 1.412 0.030 . 1 . . . . 59 LEU HG . 11213 1
664 . 1 1 59 59 LEU C C 13 175.500 0.300 . 1 . . . . 59 LEU C . 11213 1
665 . 1 1 59 59 LEU CA C 13 54.990 0.300 . 1 . . . . 59 LEU CA . 11213 1
666 . 1 1 59 59 LEU CB C 13 45.983 0.300 . 1 . . . . 59 LEU CB . 11213 1
667 . 1 1 59 59 LEU CD1 C 13 27.400 0.300 . 2 . . . . 59 LEU CD1 . 11213 1
668 . 1 1 59 59 LEU CD2 C 13 23.668 0.300 . 2 . . . . 59 LEU CD2 . 11213 1
669 . 1 1 59 59 LEU CG C 13 27.800 0.300 . 1 . . . . 59 LEU CG . 11213 1
670 . 1 1 59 59 LEU N N 15 124.807 0.300 . 1 . . . . 59 LEU N . 11213 1
671 . 1 1 60 60 ARG H H 1 9.786 0.030 . 1 . . . . 60 ARG H . 11213 1
672 . 1 1 60 60 ARG HA H 1 3.921 0.030 . 1 . . . . 60 ARG HA . 11213 1
673 . 1 1 60 60 ARG HB2 H 1 1.992 0.030 . 1 . . . . 60 ARG HB2 . 11213 1
674 . 1 1 60 60 ARG HB3 H 1 1.992 0.030 . 1 . . . . 60 ARG HB3 . 11213 1
675 . 1 1 60 60 ARG HD2 H 1 3.427 0.030 . 2 . . . . 60 ARG HD2 . 11213 1
676 . 1 1 60 60 ARG HD3 H 1 3.193 0.030 . 2 . . . . 60 ARG HD3 . 11213 1
677 . 1 1 60 60 ARG HG2 H 1 1.604 0.030 . 1 . . . . 60 ARG HG2 . 11213 1
678 . 1 1 60 60 ARG HG3 H 1 1.604 0.030 . 1 . . . . 60 ARG HG3 . 11213 1
679 . 1 1 60 60 ARG C C 13 176.121 0.300 . 1 . . . . 60 ARG C . 11213 1
680 . 1 1 60 60 ARG CA C 13 57.845 0.300 . 1 . . . . 60 ARG CA . 11213 1
681 . 1 1 60 60 ARG CB C 13 28.674 0.300 . 1 . . . . 60 ARG CB . 11213 1
682 . 1 1 60 60 ARG CD C 13 43.571 0.300 . 1 . . . . 60 ARG CD . 11213 1
683 . 1 1 60 60 ARG CG C 13 29.207 0.300 . 1 . . . . 60 ARG CG . 11213 1
684 . 1 1 60 60 ARG N N 15 127.043 0.300 . 1 . . . . 60 ARG N . 11213 1
685 . 1 1 61 61 GLY H H 1 8.760 0.030 . 1 . . . . 61 GLY H . 11213 1
686 . 1 1 61 61 GLY HA2 H 1 4.190 0.030 . 2 . . . . 61 GLY HA2 . 11213 1
687 . 1 1 61 61 GLY HA3 H 1 3.715 0.030 . 2 . . . . 61 GLY HA3 . 11213 1
688 . 1 1 61 61 GLY C C 13 173.987 0.300 . 1 . . . . 61 GLY C . 11213 1
689 . 1 1 61 61 GLY CA C 13 45.620 0.300 . 1 . . . . 61 GLY CA . 11213 1
690 . 1 1 61 61 GLY N N 15 105.263 0.300 . 1 . . . . 61 GLY N . 11213 1
691 . 1 1 62 62 GLN H H 1 8.119 0.030 . 1 . . . . 62 GLN H . 11213 1
692 . 1 1 62 62 GLN HA H 1 4.774 0.030 . 1 . . . . 62 GLN HA . 11213 1
693 . 1 1 62 62 GLN HB2 H 1 2.254 0.030 . 2 . . . . 62 GLN HB2 . 11213 1
694 . 1 1 62 62 GLN HB3 H 1 2.133 0.030 . 2 . . . . 62 GLN HB3 . 11213 1
695 . 1 1 62 62 GLN HE21 H 1 7.016 0.030 . 2 . . . . 62 GLN HE21 . 11213 1
696 . 1 1 62 62 GLN HE22 H 1 7.618 0.030 . 2 . . . . 62 GLN HE22 . 11213 1
697 . 1 1 62 62 GLN HG2 H 1 2.497 0.030 . 2 . . . . 62 GLN HG2 . 11213 1
698 . 1 1 62 62 GLN HG3 H 1 2.407 0.030 . 2 . . . . 62 GLN HG3 . 11213 1
699 . 1 1 62 62 GLN C C 13 174.750 0.300 . 1 . . . . 62 GLN C . 11213 1
700 . 1 1 62 62 GLN CA C 13 62.870 0.300 . 1 . . . . 62 GLN CA . 11213 1
701 . 1 1 62 62 GLN CB C 13 31.385 0.300 . 1 . . . . 62 GLN CB . 11213 1
702 . 1 1 62 62 GLN CG C 13 34.058 0.300 . 1 . . . . 62 GLN CG . 11213 1
703 . 1 1 62 62 GLN N N 15 121.269 0.300 . 1 . . . . 62 GLN N . 11213 1
704 . 1 1 62 62 GLN NE2 N 15 112.380 0.300 . 1 . . . . 62 GLN NE2 . 11213 1
705 . 1 1 63 63 THR H H 1 8.519 0.030 . 1 . . . . 63 THR H . 11213 1
706 . 1 1 63 63 THR HA H 1 5.626 0.030 . 1 . . . . 63 THR HA . 11213 1
707 . 1 1 63 63 THR HB H 1 4.099 0.030 . 1 . . . . 63 THR HB . 11213 1
708 . 1 1 63 63 THR HG21 H 1 1.209 0.030 . 1 . . . . 63 THR HG2 . 11213 1
709 . 1 1 63 63 THR HG22 H 1 1.209 0.030 . 1 . . . . 63 THR HG2 . 11213 1
710 . 1 1 63 63 THR HG23 H 1 1.209 0.030 . 1 . . . . 63 THR HG2 . 11213 1
711 . 1 1 63 63 THR C C 13 174.738 0.300 . 1 . . . . 63 THR C . 11213 1
712 . 1 1 63 63 THR CA C 13 60.549 0.300 . 1 . . . . 63 THR CA . 11213 1
713 . 1 1 63 63 THR CB C 13 71.140 0.300 . 1 . . . . 63 THR CB . 11213 1
714 . 1 1 63 63 THR CG2 C 13 21.393 0.300 . 1 . . . . 63 THR CG2 . 11213 1
715 . 1 1 63 63 THR N N 15 115.821 0.300 . 1 . . . . 63 THR N . 11213 1
716 . 1 1 64 64 GLY H H 1 9.068 0.030 . 1 . . . . 64 GLY H . 11213 1
717 . 1 1 64 64 GLY HA2 H 1 4.510 0.030 . 2 . . . . 64 GLY HA2 . 11213 1
718 . 1 1 64 64 GLY HA3 H 1 4.158 0.030 . 2 . . . . 64 GLY HA3 . 11213 1
719 . 1 1 64 64 GLY C C 13 172.049 0.300 . 1 . . . . 64 GLY C . 11213 1
720 . 1 1 64 64 GLY CA C 13 46.209 0.300 . 1 . . . . 64 GLY CA . 11213 1
721 . 1 1 64 64 GLY N N 15 111.872 0.300 . 1 . . . . 64 GLY N . 11213 1
722 . 1 1 65 65 ILE H H 1 8.633 0.030 . 1 . . . . 65 ILE H . 11213 1
723 . 1 1 65 65 ILE HA H 1 6.085 0.030 . 1 . . . . 65 ILE HA . 11213 1
724 . 1 1 65 65 ILE HB H 1 2.104 0.030 . 1 . . . . 65 ILE HB . 11213 1
725 . 1 1 65 65 ILE HD11 H 1 0.658 0.030 . 1 . . . . 65 ILE HD1 . 11213 1
726 . 1 1 65 65 ILE HD12 H 1 0.658 0.030 . 1 . . . . 65 ILE HD1 . 11213 1
727 . 1 1 65 65 ILE HD13 H 1 0.658 0.030 . 1 . . . . 65 ILE HD1 . 11213 1
728 . 1 1 65 65 ILE HG12 H 1 1.898 0.030 . 2 . . . . 65 ILE HG12 . 11213 1
729 . 1 1 65 65 ILE HG13 H 1 1.236 0.030 . 2 . . . . 65 ILE HG13 . 11213 1
730 . 1 1 65 65 ILE HG21 H 1 0.983 0.030 . 1 . . . . 65 ILE HG2 . 11213 1
731 . 1 1 65 65 ILE HG22 H 1 0.983 0.030 . 1 . . . . 65 ILE HG2 . 11213 1
732 . 1 1 65 65 ILE HG23 H 1 0.983 0.030 . 1 . . . . 65 ILE HG2 . 11213 1
733 . 1 1 65 65 ILE C C 13 176.375 0.300 . 1 . . . . 65 ILE C . 11213 1
734 . 1 1 65 65 ILE CA C 13 60.104 0.300 . 1 . . . . 65 ILE CA . 11213 1
735 . 1 1 65 65 ILE CB C 13 42.231 0.300 . 1 . . . . 65 ILE CB . 11213 1
736 . 1 1 65 65 ILE CD1 C 13 14.439 0.300 . 1 . . . . 65 ILE CD1 . 11213 1
737 . 1 1 65 65 ILE CG1 C 13 25.511 0.300 . 1 . . . . 65 ILE CG1 . 11213 1
738 . 1 1 65 65 ILE CG2 C 13 17.691 0.300 . 1 . . . . 65 ILE CG2 . 11213 1
739 . 1 1 65 65 ILE N N 15 113.285 0.300 . 1 . . . . 65 ILE N . 11213 1
740 . 1 1 66 66 PHE H H 1 8.693 0.030 . 1 . . . . 66 PHE H . 11213 1
741 . 1 1 66 66 PHE HA H 1 4.691 0.030 . 1 . . . . 66 PHE HA . 11213 1
742 . 1 1 66 66 PHE HB2 H 1 3.246 0.030 . 2 . . . . 66 PHE HB2 . 11213 1
743 . 1 1 66 66 PHE HB3 H 1 2.442 0.030 . 2 . . . . 66 PHE HB3 . 11213 1
744 . 1 1 66 66 PHE HD1 H 1 6.899 0.030 . 1 . . . . 66 PHE HD1 . 11213 1
745 . 1 1 66 66 PHE HD2 H 1 6.899 0.030 . 1 . . . . 66 PHE HD2 . 11213 1
746 . 1 1 66 66 PHE HE1 H 1 6.874 0.030 . 1 . . . . 66 PHE HE1 . 11213 1
747 . 1 1 66 66 PHE HE2 H 1 6.874 0.030 . 1 . . . . 66 PHE HE2 . 11213 1
748 . 1 1 66 66 PHE HZ H 1 7.119 0.030 . 1 . . . . 66 PHE HZ . 11213 1
749 . 1 1 66 66 PHE C C 13 170.076 0.300 . 1 . . . . 66 PHE C . 11213 1
750 . 1 1 66 66 PHE CA C 13 54.970 0.300 . 1 . . . . 66 PHE CA . 11213 1
751 . 1 1 66 66 PHE CB C 13 39.601 0.300 . 1 . . . . 66 PHE CB . 11213 1
752 . 1 1 66 66 PHE CD1 C 13 133.476 0.300 . 1 . . . . 66 PHE CD1 . 11213 1
753 . 1 1 66 66 PHE CD2 C 13 133.476 0.300 . 1 . . . . 66 PHE CD2 . 11213 1
754 . 1 1 66 66 PHE CE1 C 13 129.306 0.300 . 1 . . . . 66 PHE CE1 . 11213 1
755 . 1 1 66 66 PHE CE2 C 13 129.306 0.300 . 1 . . . . 66 PHE CE2 . 11213 1
756 . 1 1 66 66 PHE CZ C 13 127.779 0.300 . 1 . . . . 66 PHE CZ . 11213 1
757 . 1 1 66 66 PHE N N 15 115.846 0.300 . 1 . . . . 66 PHE N . 11213 1
758 . 1 1 67 67 PRO HA H 1 3.091 0.030 . 1 . . . . 67 PRO HA . 11213 1
759 . 1 1 67 67 PRO HB2 H 1 1.447 0.030 . 2 . . . . 67 PRO HB2 . 11213 1
760 . 1 1 67 67 PRO HB3 H 1 0.910 0.030 . 2 . . . . 67 PRO HB3 . 11213 1
761 . 1 1 67 67 PRO HD2 H 1 1.717 0.030 . 2 . . . . 67 PRO HD2 . 11213 1
762 . 1 1 67 67 PRO HD3 H 1 1.435 0.030 . 2 . . . . 67 PRO HD3 . 11213 1
763 . 1 1 67 67 PRO HG2 H 1 0.664 0.030 . 2 . . . . 67 PRO HG2 . 11213 1
764 . 1 1 67 67 PRO HG3 H 1 0.173 0.030 . 2 . . . . 67 PRO HG3 . 11213 1
765 . 1 1 67 67 PRO C C 13 177.633 0.300 . 1 . . . . 67 PRO C . 11213 1
766 . 1 1 67 67 PRO CA C 13 61.335 0.300 . 1 . . . . 67 PRO CA . 11213 1
767 . 1 1 67 67 PRO CB C 13 30.105 0.300 . 1 . . . . 67 PRO CB . 11213 1
768 . 1 1 67 67 PRO CD C 13 48.805 0.300 . 1 . . . . 67 PRO CD . 11213 1
769 . 1 1 67 67 PRO CG C 13 26.738 0.300 . 1 . . . . 67 PRO CG . 11213 1
770 . 1 1 68 68 ALA H H 1 7.904 0.030 . 1 . . . . 68 ALA H . 11213 1
771 . 1 1 68 68 ALA HA H 1 3.146 0.030 . 1 . . . . 68 ALA HA . 11213 1
772 . 1 1 68 68 ALA HB1 H 1 -0.497 0.030 . 1 . . . . 68 ALA HB . 11213 1
773 . 1 1 68 68 ALA HB2 H 1 -0.497 0.030 . 1 . . . . 68 ALA HB . 11213 1
774 . 1 1 68 68 ALA HB3 H 1 -0.497 0.030 . 1 . . . . 68 ALA HB . 11213 1
775 . 1 1 68 68 ALA C C 13 177.816 0.300 . 1 . . . . 68 ALA C . 11213 1
776 . 1 1 68 68 ALA CA C 13 54.361 0.300 . 1 . . . . 68 ALA CA . 11213 1
777 . 1 1 68 68 ALA CB C 13 15.653 0.300 . 1 . . . . 68 ALA CB . 11213 1
778 . 1 1 68 68 ALA N N 15 127.822 0.300 . 1 . . . . 68 ALA N . 11213 1
779 . 1 1 69 69 ASN H H 1 8.205 0.030 . 1 . . . . 69 ASN H . 11213 1
780 . 1 1 69 69 ASN HA H 1 4.495 0.030 . 1 . . . . 69 ASN HA . 11213 1
781 . 1 1 69 69 ASN HB2 H 1 2.873 0.030 . 2 . . . . 69 ASN HB2 . 11213 1
782 . 1 1 69 69 ASN HB3 H 1 2.559 0.030 . 2 . . . . 69 ASN HB3 . 11213 1
783 . 1 1 69 69 ASN HD21 H 1 7.439 0.030 . 2 . . . . 69 ASN HD21 . 11213 1
784 . 1 1 69 69 ASN HD22 H 1 6.580 0.030 . 2 . . . . 69 ASN HD22 . 11213 1
785 . 1 1 69 69 ASN C C 13 175.596 0.300 . 1 . . . . 69 ASN C . 11213 1
786 . 1 1 69 69 ASN CA C 13 53.820 0.300 . 1 . . . . 69 ASN CA . 11213 1
787 . 1 1 69 69 ASN CB C 13 35.872 0.300 . 1 . . . . 69 ASN CB . 11213 1
788 . 1 1 69 69 ASN N N 15 113.016 0.300 . 1 . . . . 69 ASN N . 11213 1
789 . 1 1 69 69 ASN ND2 N 15 111.392 0.300 . 1 . . . . 69 ASN ND2 . 11213 1
790 . 1 1 70 70 TYR H H 1 8.003 0.030 . 1 . . . . 70 TYR H . 11213 1
791 . 1 1 70 70 TYR HA H 1 4.675 0.030 . 1 . . . . 70 TYR HA . 11213 1
792 . 1 1 70 70 TYR HB2 H 1 3.569 0.030 . 2 . . . . 70 TYR HB2 . 11213 1
793 . 1 1 70 70 TYR HB3 H 1 3.419 0.030 . 2 . . . . 70 TYR HB3 . 11213 1
794 . 1 1 70 70 TYR HD1 H 1 7.089 0.030 . 1 . . . . 70 TYR HD1 . 11213 1
795 . 1 1 70 70 TYR HD2 H 1 7.089 0.030 . 1 . . . . 70 TYR HD2 . 11213 1
796 . 1 1 70 70 TYR HE1 H 1 6.946 0.030 . 1 . . . . 70 TYR HE1 . 11213 1
797 . 1 1 70 70 TYR HE2 H 1 6.946 0.030 . 1 . . . . 70 TYR HE2 . 11213 1
798 . 1 1 70 70 TYR C C 13 175.507 0.300 . 1 . . . . 70 TYR C . 11213 1
799 . 1 1 70 70 TYR CA C 13 58.628 0.300 . 1 . . . . 70 TYR CA . 11213 1
800 . 1 1 70 70 TYR CB C 13 38.234 0.300 . 1 . . . . 70 TYR CB . 11213 1
801 . 1 1 70 70 TYR CD1 C 13 131.695 0.300 . 1 . . . . 70 TYR CD1 . 11213 1
802 . 1 1 70 70 TYR CD2 C 13 131.695 0.300 . 1 . . . . 70 TYR CD2 . 11213 1
803 . 1 1 70 70 TYR CE1 C 13 118.145 0.300 . 1 . . . . 70 TYR CE1 . 11213 1
804 . 1 1 70 70 TYR CE2 C 13 118.145 0.300 . 1 . . . . 70 TYR CE2 . 11213 1
805 . 1 1 70 70 TYR N N 15 119.330 0.300 . 1 . . . . 70 TYR N . 11213 1
806 . 1 1 71 71 VAL H H 1 7.526 0.030 . 1 . . . . 71 VAL H . 11213 1
807 . 1 1 71 71 VAL HA H 1 5.252 0.030 . 1 . . . . 71 VAL HA . 11213 1
808 . 1 1 71 71 VAL HB H 1 1.828 0.030 . 1 . . . . 71 VAL HB . 11213 1
809 . 1 1 71 71 VAL HG11 H 1 0.357 0.030 . 1 . . . . 71 VAL HG1 . 11213 1
810 . 1 1 71 71 VAL HG12 H 1 0.357 0.030 . 1 . . . . 71 VAL HG1 . 11213 1
811 . 1 1 71 71 VAL HG13 H 1 0.357 0.030 . 1 . . . . 71 VAL HG1 . 11213 1
812 . 1 1 71 71 VAL HG21 H 1 0.976 0.030 . 1 . . . . 71 VAL HG2 . 11213 1
813 . 1 1 71 71 VAL HG22 H 1 0.976 0.030 . 1 . . . . 71 VAL HG2 . 11213 1
814 . 1 1 71 71 VAL HG23 H 1 0.976 0.030 . 1 . . . . 71 VAL HG2 . 11213 1
815 . 1 1 71 71 VAL C C 13 173.546 0.300 . 1 . . . . 71 VAL C . 11213 1
816 . 1 1 71 71 VAL CA C 13 58.409 0.300 . 1 . . . . 71 VAL CA . 11213 1
817 . 1 1 71 71 VAL CB C 13 35.379 0.300 . 1 . . . . 71 VAL CB . 11213 1
818 . 1 1 71 71 VAL CG1 C 13 21.139 0.300 . 2 . . . . 71 VAL CG1 . 11213 1
819 . 1 1 71 71 VAL CG2 C 13 18.200 0.300 . 2 . . . . 71 VAL CG2 . 11213 1
820 . 1 1 71 71 VAL N N 15 109.944 0.300 . 1 . . . . 71 VAL N . 11213 1
821 . 1 1 72 72 THR H H 1 8.639 0.030 . 1 . . . . 72 THR H . 11213 1
822 . 1 1 72 72 THR HA H 1 4.836 0.030 . 1 . . . . 72 THR HA . 11213 1
823 . 1 1 72 72 THR HB H 1 3.952 0.030 . 1 . . . . 72 THR HB . 11213 1
824 . 1 1 72 72 THR HG21 H 1 1.138 0.030 . 1 . . . . 72 THR HG2 . 11213 1
825 . 1 1 72 72 THR HG22 H 1 1.138 0.030 . 1 . . . . 72 THR HG2 . 11213 1
826 . 1 1 72 72 THR HG23 H 1 1.138 0.030 . 1 . . . . 72 THR HG2 . 11213 1
827 . 1 1 72 72 THR C C 13 173.092 0.300 . 1 . . . . 72 THR C . 11213 1
828 . 1 1 72 72 THR CA C 13 59.014 0.300 . 1 . . . . 72 THR CA . 11213 1
829 . 1 1 72 72 THR CB C 13 70.672 0.300 . 1 . . . . 72 THR CB . 11213 1
830 . 1 1 72 72 THR CG2 C 13 19.956 0.300 . 1 . . . . 72 THR CG2 . 11213 1
831 . 1 1 72 72 THR N N 15 112.528 0.300 . 1 . . . . 72 THR N . 11213 1
832 . 1 1 73 73 MET H H 1 8.719 0.030 . 1 . . . . 73 MET H . 11213 1
833 . 1 1 73 73 MET HA H 1 4.684 0.030 . 1 . . . . 73 MET HA . 11213 1
834 . 1 1 73 73 MET HB2 H 1 2.282 0.030 . 2 . . . . 73 MET HB2 . 11213 1
835 . 1 1 73 73 MET HB3 H 1 2.096 0.030 . 2 . . . . 73 MET HB3 . 11213 1
836 . 1 1 73 73 MET HE1 H 1 2.109 0.030 . 1 . . . . 73 MET HE . 11213 1
837 . 1 1 73 73 MET HE2 H 1 2.109 0.030 . 1 . . . . 73 MET HE . 11213 1
838 . 1 1 73 73 MET HE3 H 1 2.109 0.030 . 1 . . . . 73 MET HE . 11213 1
839 . 1 1 73 73 MET HG2 H 1 2.772 0.030 . 2 . . . . 73 MET HG2 . 11213 1
840 . 1 1 73 73 MET HG3 H 1 2.661 0.030 . 2 . . . . 73 MET HG3 . 11213 1
841 . 1 1 73 73 MET C C 13 176.246 0.300 . 1 . . . . 73 MET C . 11213 1
842 . 1 1 73 73 MET CA C 13 55.823 0.300 . 1 . . . . 73 MET CA . 11213 1
843 . 1 1 73 73 MET CB C 13 33.050 0.300 . 1 . . . . 73 MET CB . 11213 1
844 . 1 1 73 73 MET CE C 13 16.984 0.300 . 1 . . . . 73 MET CE . 11213 1
845 . 1 1 73 73 MET CG C 13 32.562 0.300 . 1 . . . . 73 MET CG . 11213 1
846 . 1 1 73 73 MET N N 15 124.339 0.300 . 1 . . . . 73 MET N . 11213 1
847 . 1 1 74 74 ASN H H 1 8.633 0.030 . 1 . . . . 74 ASN H . 11213 1
848 . 1 1 74 74 ASN HA H 1 4.807 0.030 . 1 . . . . 74 ASN HA . 11213 1
849 . 1 1 74 74 ASN HB2 H 1 2.863 0.030 . 2 . . . . 74 ASN HB2 . 11213 1
850 . 1 1 74 74 ASN HB3 H 1 2.754 0.030 . 2 . . . . 74 ASN HB3 . 11213 1
851 . 1 1 74 74 ASN HD21 H 1 6.744 0.030 . 2 . . . . 74 ASN HD21 . 11213 1
852 . 1 1 74 74 ASN HD22 H 1 7.598 0.030 . 2 . . . . 74 ASN HD22 . 11213 1
853 . 1 1 74 74 ASN C C 13 174.997 0.300 . 1 . . . . 74 ASN C . 11213 1
854 . 1 1 74 74 ASN CA C 13 53.232 0.300 . 1 . . . . 74 ASN CA . 11213 1
855 . 1 1 74 74 ASN CB C 13 38.816 0.300 . 1 . . . . 74 ASN CB . 11213 1
856 . 1 1 74 74 ASN N N 15 120.943 0.300 . 1 . . . . 74 ASN N . 11213 1
857 . 1 1 74 74 ASN ND2 N 15 111.976 0.300 . 1 . . . . 74 ASN ND2 . 11213 1
858 . 1 1 75 75 SER H H 1 8.455 0.030 . 1 . . . . 75 SER H . 11213 1
859 . 1 1 75 75 SER HA H 1 4.497 0.030 . 1 . . . . 75 SER HA . 11213 1
860 . 1 1 75 75 SER HB2 H 1 3.884 0.030 . 1 . . . . 75 SER HB2 . 11213 1
861 . 1 1 75 75 SER HB3 H 1 3.884 0.030 . 1 . . . . 75 SER HB3 . 11213 1
862 . 1 1 75 75 SER C C 13 174.478 0.300 . 1 . . . . 75 SER C . 11213 1
863 . 1 1 75 75 SER CA C 13 58.257 0.300 . 1 . . . . 75 SER CA . 11213 1
864 . 1 1 75 75 SER CB C 13 64.046 0.300 . 1 . . . . 75 SER CB . 11213 1
865 . 1 1 75 75 SER N N 15 116.945 0.300 . 1 . . . . 75 SER N . 11213 1
866 . 1 1 76 76 GLY H H 1 8.285 0.030 . 1 . . . . 76 GLY H . 11213 1
867 . 1 1 76 76 GLY HA2 H 1 4.143 0.030 . 2 . . . . 76 GLY HA2 . 11213 1
868 . 1 1 76 76 GLY HA3 H 1 4.105 0.030 . 2 . . . . 76 GLY HA3 . 11213 1
869 . 1 1 76 76 GLY C C 13 171.748 0.300 . 1 . . . . 76 GLY C . 11213 1
870 . 1 1 76 76 GLY CA C 13 44.668 0.300 . 1 . . . . 76 GLY CA . 11213 1
871 . 1 1 76 76 GLY N N 15 110.692 0.300 . 1 . . . . 76 GLY N . 11213 1
872 . 1 1 77 77 PRO HA H 1 4.473 0.030 . 1 . . . . 77 PRO HA . 11213 1
873 . 1 1 77 77 PRO HB2 H 1 2.278 0.030 . 2 . . . . 77 PRO HB2 . 11213 1
874 . 1 1 77 77 PRO HB3 H 1 1.966 0.030 . 2 . . . . 77 PRO HB3 . 11213 1
875 . 1 1 77 77 PRO HD2 H 1 3.602 0.030 . 1 . . . . 77 PRO HD2 . 11213 1
876 . 1 1 77 77 PRO HD3 H 1 3.602 0.030 . 1 . . . . 77 PRO HD3 . 11213 1
877 . 1 1 77 77 PRO HG2 H 1 2.024 0.030 . 1 . . . . 77 PRO HG2 . 11213 1
878 . 1 1 77 77 PRO HG3 H 1 2.024 0.030 . 1 . . . . 77 PRO HG3 . 11213 1
879 . 1 1 77 77 PRO C C 13 177.348 0.300 . 1 . . . . 77 PRO C . 11213 1
880 . 1 1 77 77 PRO CA C 13 63.160 0.300 . 1 . . . . 77 PRO CA . 11213 1
881 . 1 1 77 77 PRO CB C 13 32.128 0.300 . 1 . . . . 77 PRO CB . 11213 1
882 . 1 1 77 77 PRO CD C 13 49.719 0.300 . 1 . . . . 77 PRO CD . 11213 1
883 . 1 1 77 77 PRO CG C 13 26.867 0.300 . 1 . . . . 77 PRO CG . 11213 1
884 . 1 1 78 78 SER H H 1 8.525 0.030 . 1 . . . . 78 SER H . 11213 1
885 . 1 1 78 78 SER HA H 1 4.476 0.030 . 1 . . . . 78 SER HA . 11213 1
886 . 1 1 78 78 SER HB2 H 1 3.890 0.030 . 1 . . . . 78 SER HB2 . 11213 1
887 . 1 1 78 78 SER HB3 H 1 3.890 0.030 . 1 . . . . 78 SER HB3 . 11213 1
888 . 1 1 78 78 SER C C 13 174.644 0.300 . 1 . . . . 78 SER C . 11213 1
889 . 1 1 78 78 SER CA C 13 58.514 0.300 . 1 . . . . 78 SER CA . 11213 1
890 . 1 1 78 78 SER CB C 13 63.815 0.300 . 1 . . . . 78 SER CB . 11213 1
891 . 1 1 78 78 SER N N 15 116.425 0.300 . 1 . . . . 78 SER N . 11213 1
892 . 1 1 79 79 SER H H 1 8.341 0.030 . 1 . . . . 79 SER H . 11213 1
893 . 1 1 79 79 SER HA H 1 4.514 0.030 . 1 . . . . 79 SER HA . 11213 1
894 . 1 1 79 79 SER HB2 H 1 3.912 0.030 . 1 . . . . 79 SER HB2 . 11213 1
895 . 1 1 79 79 SER HB3 H 1 3.912 0.030 . 1 . . . . 79 SER HB3 . 11213 1
896 . 1 1 79 79 SER C C 13 173.928 0.300 . 1 . . . . 79 SER C . 11213 1
897 . 1 1 79 79 SER CA C 13 58.352 0.300 . 1 . . . . 79 SER CA . 11213 1
898 . 1 1 79 79 SER CB C 13 64.053 0.300 . 1 . . . . 79 SER CB . 11213 1
899 . 1 1 79 79 SER N N 15 117.855 0.300 . 1 . . . . 79 SER N . 11213 1
900 . 1 1 80 80 GLY H H 1 8.045 0.030 . 1 . . . . 80 GLY H . 11213 1
901 . 1 1 80 80 GLY HA2 H 1 3.798 0.030 . 1 . . . . 80 GLY HA2 . 11213 1
902 . 1 1 80 80 GLY HA3 H 1 3.798 0.030 . 1 . . . . 80 GLY HA3 . 11213 1
903 . 1 1 80 80 GLY C C 13 178.997 0.300 . 1 . . . . 80 GLY C . 11213 1
904 . 1 1 80 80 GLY CA C 13 46.252 0.300 . 1 . . . . 80 GLY CA . 11213 1
905 . 1 1 80 80 GLY N N 15 116.864 0.300 . 1 . . . . 80 GLY N . 11213 1
stop_
save_