Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 17199
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 17199 1
2 '3D HNCACB' . . . 17199 1
3 '3D CBCA(CO)NH' . . . 17199 1
4 '3D HNCO' . . . 17199 1
5 '3D HNCACO' . . . 17199 1
6 '3D C(CO)NH' . . . 17199 1
7 '3D H(CCO)NH' . . . 17199 1
8 '3D HCCH-TOCSY' . . . 17199 1
9 '3D 1H-15N NOESY' . . . 17199 1
10 '3D 1H-13C NOESY' . . . 17199 1
11 '3D HNHA' . . . 17199 1
13 '3D CCH-COSY' . . . 17199 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 2 2 VAL HA H 1 4.257 0.004 . 1 . . . . 2 V HA . 17199 1
2 . 1 1 2 2 VAL HB H 1 2.119 0.002 . 1 . . . . 2 V HB . 17199 1
3 . 1 1 2 2 VAL HG11 H 1 0.969 0.003 . 2 . . . . 2 V HG1 . 17199 1
4 . 1 1 2 2 VAL HG12 H 1 0.969 0.003 . 2 . . . . 2 V HG1 . 17199 1
5 . 1 1 2 2 VAL HG13 H 1 0.969 0.003 . 2 . . . . 2 V HG1 . 17199 1
6 . 1 1 2 2 VAL HG21 H 1 0.970 0.004 . 2 . . . . 2 V HG2 . 17199 1
7 . 1 1 2 2 VAL HG22 H 1 0.970 0.004 . 2 . . . . 2 V HG2 . 17199 1
8 . 1 1 2 2 VAL HG23 H 1 0.970 0.004 . 2 . . . . 2 V HG2 . 17199 1
9 . 1 1 2 2 VAL C C 13 175.964 0.018 . 1 . . . . 2 V C . 17199 1
10 . 1 1 2 2 VAL CA C 13 62.318 0.037 . 1 . . . . 2 V CA . 17199 1
11 . 1 1 2 2 VAL CB C 13 32.925 0.053 . 1 . . . . 2 V CB . 17199 1
12 . 1 1 2 2 VAL CG1 C 13 20.985 0.101 . 2 . . . . 2 V CG1 . 17199 1
13 . 1 1 2 2 VAL CG2 C 13 20.455 0.062 . 2 . . . . 2 V CG2 . 17199 1
14 . 1 1 3 3 SER H H 1 8.495 0.002 . 1 . . . . 3 S H . 17199 1
15 . 1 1 3 3 SER HA H 1 4.527 0.006 . 1 . . . . 3 S HA . 17199 1
16 . 1 1 3 3 SER HB2 H 1 3.838 0.001 . 2 . . . . 3 S HB2 . 17199 1
17 . 1 1 3 3 SER C C 13 174.155 0.012 . 1 . . . . 3 S C . 17199 1
18 . 1 1 3 3 SER CA C 13 58.310 0.178 . 1 . . . . 3 S CA . 17199 1
19 . 1 1 3 3 SER CB C 13 63.915 0.018 . 1 . . . . 3 S CB . 17199 1
20 . 1 1 3 3 SER N N 15 120.215 0.017 . 1 . . . . 3 S N . 17199 1
21 . 1 1 4 4 ILE H H 1 8.275 0.006 . 1 . . . . 4 I H . 17199 1
22 . 1 1 4 4 ILE HA H 1 4.236 0.004 . 1 . . . . 4 I HA . 17199 1
23 . 1 1 4 4 ILE HB H 1 1.918 0.003 . 1 . . . . 4 I HB . 17199 1
24 . 1 1 4 4 ILE HD11 H 1 0.878 0.005 . 1 . . . . 4 I HD1 . 17199 1
25 . 1 1 4 4 ILE HD12 H 1 0.878 0.005 . 1 . . . . 4 I HD1 . 17199 1
26 . 1 1 4 4 ILE HD13 H 1 0.878 0.005 . 1 . . . . 4 I HD1 . 17199 1
27 . 1 1 4 4 ILE HG12 H 1 1.458 0.034 . 2 . . . . 4 I HG12 . 17199 1
28 . 1 1 4 4 ILE HG13 H 1 1.191 0.002 . 2 . . . . 4 I HG13 . 17199 1
29 . 1 1 4 4 ILE HG21 H 1 0.934 0.004 . 1 . . . . 4 I HG2 . 17199 1
30 . 1 1 4 4 ILE HG22 H 1 0.934 0.004 . 1 . . . . 4 I HG2 . 17199 1
31 . 1 1 4 4 ILE HG23 H 1 0.934 0.004 . 1 . . . . 4 I HG2 . 17199 1
32 . 1 1 4 4 ILE C C 13 175.226 0.000 . 1 . . . . 4 I C . 17199 1
33 . 1 1 4 4 ILE CA C 13 61.306 0.032 . 1 . . . . 4 I CA . 17199 1
34 . 1 1 4 4 ILE CB C 13 38.763 0.030 . 1 . . . . 4 I CB . 17199 1
35 . 1 1 4 4 ILE CD1 C 13 13.002 0.069 . 1 . . . . 4 I CD1 . 17199 1
36 . 1 1 4 4 ILE CG1 C 13 27.130 0.051 . 1 . . . . 4 I CG1 . 17199 1
37 . 1 1 4 4 ILE CG2 C 13 17.578 0.027 . 1 . . . . 4 I CG2 . 17199 1
38 . 1 1 4 4 ILE N N 15 123.584 0.020 . 1 . . . . 4 I N . 17199 1
39 . 1 1 5 5 LEU H H 1 7.875 0.001 . 1 . . . . 5 L H . 17199 1
40 . 1 1 5 5 LEU HA H 1 4.206 0.016 . 1 . . . . 5 L HA . 17199 1
41 . 1 1 5 5 LEU HB2 H 1 1.603 0.098 . 2 . . . . 5 L HB2 . 17199 1
42 . 1 1 5 5 LEU HD11 H 1 0.924 0.005 . 2 . . . . 5 L HD1 . 17199 1
43 . 1 1 5 5 LEU HD12 H 1 0.924 0.005 . 2 . . . . 5 L HD1 . 17199 1
44 . 1 1 5 5 LEU HD13 H 1 0.924 0.005 . 2 . . . . 5 L HD1 . 17199 1
45 . 1 1 5 5 LEU HD21 H 1 0.869 0.013 . 2 . . . . 5 L HD2 . 17199 1
46 . 1 1 5 5 LEU HD22 H 1 0.869 0.013 . 2 . . . . 5 L HD2 . 17199 1
47 . 1 1 5 5 LEU HD23 H 1 0.869 0.013 . 2 . . . . 5 L HD2 . 17199 1
48 . 1 1 5 5 LEU HG H 1 1.639 0.030 . 1 . . . . 5 L HG . 17199 1
49 . 1 1 5 5 LEU C C 13 182.306 0.000 . 1 . . . . 5 L C . 17199 1
50 . 1 1 5 5 LEU CA C 13 56.823 0.035 . 1 . . . . 5 L CA . 17199 1
51 . 1 1 5 5 LEU CB C 13 43.452 0.033 . 1 . . . . 5 L CB . 17199 1
52 . 1 1 5 5 LEU CD1 C 13 25.049 0.030 . 2 . . . . 5 L CD1 . 17199 1
53 . 1 1 5 5 LEU CD2 C 13 23.552 0.052 . 2 . . . . 5 L CD2 . 17199 1
54 . 1 1 5 5 LEU CG C 13 27.119 0.059 . 1 . . . . 5 L CG . 17199 1
55 . 1 1 5 5 LEU N N 15 131.566 0.010 . 1 . . . . 5 L N . 17199 1
56 . 1 1 7 7 SER HA H 1 4.592 0.002 . 1 . . . . 7 S HA . 17199 1
57 . 1 1 7 7 SER HB2 H 1 3.909 0.003 . 2 . . . . 7 S HB2 . 17199 1
58 . 1 1 7 7 SER C C 13 174.302 0.000 . 1 . . . . 7 S C . 17199 1
59 . 1 1 7 7 SER CA C 13 58.365 0.049 . 1 . . . . 7 S CA . 17199 1
60 . 1 1 7 7 SER CB C 13 63.936 0.018 . 1 . . . . 7 S CB . 17199 1
61 . 1 1 8 8 SER H H 1 8.641 0.002 . 1 . . . . 8 S H . 17199 1
62 . 1 1 8 8 SER HA H 1 4.511 0.024 . 1 . . . . 8 S HA . 17199 1
63 . 1 1 8 8 SER HB2 H 1 3.908 0.005 . 2 . . . . 8 S HB2 . 17199 1
64 . 1 1 8 8 SER C C 13 174.438 0.115 . 1 . . . . 8 S C . 17199 1
65 . 1 1 8 8 SER CA C 13 58.402 0.091 . 1 . . . . 8 S CA . 17199 1
66 . 1 1 8 8 SER CB C 13 63.923 0.038 . 1 . . . . 8 S CB . 17199 1
67 . 1 1 8 8 SER N N 15 118.634 0.026 . 1 . . . . 8 S N . 17199 1
68 . 1 1 9 9 VAL H H 1 8.241 0.003 . 1 . . . . 9 V H . 17199 1
69 . 1 1 9 9 VAL HA H 1 4.093 0.004 . 1 . . . . 9 V HA . 17199 1
70 . 1 1 9 9 VAL HB H 1 2.008 0.004 . 1 . . . . 9 V HB . 17199 1
71 . 1 1 9 9 VAL HG11 H 1 0.903 0.019 . 2 . . . . 9 V HG1 . 17199 1
72 . 1 1 9 9 VAL HG12 H 1 0.903 0.019 . 2 . . . . 9 V HG1 . 17199 1
73 . 1 1 9 9 VAL HG13 H 1 0.903 0.019 . 2 . . . . 9 V HG1 . 17199 1
74 . 1 1 9 9 VAL HG21 H 1 0.848 0.010 . 2 . . . . 9 V HG2 . 17199 1
75 . 1 1 9 9 VAL HG22 H 1 0.848 0.010 . 2 . . . . 9 V HG2 . 17199 1
76 . 1 1 9 9 VAL HG23 H 1 0.848 0.010 . 2 . . . . 9 V HG2 . 17199 1
77 . 1 1 9 9 VAL C C 13 175.674 0.001 . 1 . . . . 9 V C . 17199 1
78 . 1 1 9 9 VAL CA C 13 62.503 0.020 . 1 . . . . 9 V CA . 17199 1
79 . 1 1 9 9 VAL CB C 13 32.741 0.092 . 1 . . . . 9 V CB . 17199 1
80 . 1 1 9 9 VAL CG1 C 13 20.633 0.129 . 2 . . . . 9 V CG1 . 17199 1
81 . 1 1 9 9 VAL CG2 C 13 21.006 0.077 . 2 . . . . 9 V CG2 . 17199 1
82 . 1 1 9 9 VAL N N 15 121.548 0.034 . 1 . . . . 9 V N . 17199 1
83 . 1 1 10 10 ASN H H 1 8.495 0.003 . 1 . . . . 10 N H . 17199 1
84 . 1 1 10 10 ASN HA H 1 4.702 0.004 . 1 . . . . 10 N HA . 17199 1
85 . 1 1 10 10 ASN HB2 H 1 2.844 0.022 . 2 . . . . 10 N HB2 . 17199 1
86 . 1 1 10 10 ASN HB3 H 1 2.810 0.002 . 2 . . . . 10 N HB3 . 17199 1
87 . 1 1 10 10 ASN C C 13 175.617 0.000 . 1 . . . . 10 N C . 17199 1
88 . 1 1 10 10 ASN CA C 13 53.099 0.023 . 1 . . . . 10 N CA . 17199 1
89 . 1 1 10 10 ASN CB C 13 38.884 0.030 . 1 . . . . 10 N CB . 17199 1
90 . 1 1 10 10 ASN N N 15 122.176 0.018 . 1 . . . . 10 N N . 17199 1
91 . 1 1 11 11 HIS HA H 1 4.664 0.009 . 1 . . . . 11 H HA . 17199 1
92 . 1 1 11 11 HIS HB2 H 1 3.197 0.080 . 2 . . . . 11 H HB2 . 17199 1
93 . 1 1 11 11 HIS HB3 H 1 3.100 0.067 . 2 . . . . 11 H HB3 . 17199 1
94 . 1 1 11 11 HIS HD2 H 1 7.136 0.000 . 1 . . . . 11 H HD2 . 17199 1
95 . 1 1 11 11 HIS C C 13 175.627 0.000 . 1 . . . . 11 H C . 17199 1
96 . 1 1 11 11 HIS CA C 13 56.831 0.036 . 1 . . . . 11 H CA . 17199 1
97 . 1 1 11 11 HIS CB C 13 29.548 0.073 . 1 . . . . 11 H CB . 17199 1
98 . 1 1 12 12 ARG H H 1 8.209 0.004 . 1 . . . . 12 R H . 17199 1
99 . 1 1 12 12 ARG HA H 1 4.201 0.007 . 1 . . . . 12 R HA . 17199 1
100 . 1 1 12 12 ARG HB2 H 1 1.909 0.012 . 2 . . . . 12 R HB2 . 17199 1
101 . 1 1 12 12 ARG HD2 H 1 3.254 0.031 . 2 . . . . 12 R HD2 . 17199 1
102 . 1 1 12 12 ARG HG2 H 1 1.635 0.025 . 2 . . . . 12 R HG2 . 17199 1
103 . 1 1 12 12 ARG C C 13 178.337 0.005 . 1 . . . . 12 R C . 17199 1
104 . 1 1 12 12 ARG CA C 13 59.331 0.033 . 1 . . . . 12 R CA . 17199 1
105 . 1 1 12 12 ARG CB C 13 30.121 0.093 . 1 . . . . 12 R CB . 17199 1
106 . 1 1 12 12 ARG CD C 13 43.438 0.135 . 1 . . . . 12 R CD . 17199 1
107 . 1 1 12 12 ARG CG C 13 27.067 0.098 . 1 . . . . 12 R CG . 17199 1
108 . 1 1 12 12 ARG N N 15 121.109 0.012 . 1 . . . . 12 R N . 17199 1
109 . 1 1 13 13 GLU H H 1 8.587 0.012 . 1 . . . . 13 E H . 17199 1
110 . 1 1 13 13 GLU HA H 1 4.113 0.006 . 1 . . . . 13 E HA . 17199 1
111 . 1 1 13 13 GLU HB2 H 1 2.119 0.009 . 2 . . . . 13 E HB2 . 17199 1
112 . 1 1 13 13 GLU HG2 H 1 2.360 0.007 . 2 . . . . 13 E HG2 . 17199 1
113 . 1 1 13 13 GLU C C 13 179.474 0.018 . 1 . . . . 13 E C . 17199 1
114 . 1 1 13 13 GLU CA C 13 59.650 0.106 . 1 . . . . 13 E CA . 17199 1
115 . 1 1 13 13 GLU CB C 13 29.254 0.074 . 1 . . . . 13 E CB . 17199 1
116 . 1 1 13 13 GLU CG C 13 36.967 0.104 . 1 . . . . 13 E CG . 17199 1
117 . 1 1 13 13 GLU N N 15 119.284 0.018 . 1 . . . . 13 E N . 17199 1
118 . 1 1 14 14 VAL H H 1 8.049 0.007 . 1 . . . . 14 V H . 17199 1
119 . 1 1 14 14 VAL HA H 1 3.867 0.010 . 1 . . . . 14 V HA . 17199 1
120 . 1 1 14 14 VAL HB H 1 2.102 0.049 . 1 . . . . 14 V HB . 17199 1
121 . 1 1 14 14 VAL HG11 H 1 1.008 0.015 . 2 . . . . 14 V HG1 . 17199 1
122 . 1 1 14 14 VAL HG12 H 1 1.008 0.015 . 2 . . . . 14 V HG1 . 17199 1
123 . 1 1 14 14 VAL HG13 H 1 1.008 0.015 . 2 . . . . 14 V HG1 . 17199 1
124 . 1 1 14 14 VAL HG21 H 1 0.997 0.010 . 2 . . . . 14 V HG2 . 17199 1
125 . 1 1 14 14 VAL HG22 H 1 0.997 0.010 . 2 . . . . 14 V HG2 . 17199 1
126 . 1 1 14 14 VAL HG23 H 1 0.997 0.010 . 2 . . . . 14 V HG2 . 17199 1
127 . 1 1 14 14 VAL C C 13 177.203 0.000 . 1 . . . . 14 V C . 17199 1
128 . 1 1 14 14 VAL CA C 13 65.622 0.067 . 1 . . . . 14 V CA . 17199 1
129 . 1 1 14 14 VAL CB C 13 31.695 0.092 . 1 . . . . 14 V CB . 17199 1
130 . 1 1 14 14 VAL CG1 C 13 22.873 0.057 . 2 . . . . 14 V CG1 . 17199 1
131 . 1 1 14 14 VAL CG2 C 13 21.640 0.060 . 2 . . . . 14 V CG2 . 17199 1
132 . 1 1 14 14 VAL N N 15 120.503 0.021 . 1 . . . . 14 V N . 17199 1
133 . 1 1 15 15 ASP H H 1 8.290 0.060 . 1 . . . . 15 D H . 17199 1
134 . 1 1 15 15 ASP HA H 1 4.445 0.030 . 1 . . . . 15 D HA . 17199 1
135 . 1 1 15 15 ASP HB2 H 1 2.771 0.077 . 2 . . . . 15 D HB2 . 17199 1
136 . 1 1 15 15 ASP HB3 H 1 2.637 0.007 . 2 . . . . 15 D HB3 . 17199 1
137 . 1 1 15 15 ASP C C 13 178.178 0.017 . 1 . . . . 15 D C . 17199 1
138 . 1 1 15 15 ASP CA C 13 58.186 0.024 . 1 . . . . 15 D CA . 17199 1
139 . 1 1 15 15 ASP CB C 13 39.871 0.116 . 1 . . . . 15 D CB . 17199 1
140 . 1 1 15 15 ASP N N 15 120.974 0.036 . 1 . . . . 15 D N . 17199 1
141 . 1 1 16 16 GLU H H 1 8.087 0.003 . 1 . . . . 16 E H . 17199 1
142 . 1 1 16 16 GLU HA H 1 4.103 0.037 . 1 . . . . 16 E HA . 17199 1
143 . 1 1 16 16 GLU HB2 H 1 2.122 0.003 . 2 . . . . 16 E HB2 . 17199 1
144 . 1 1 16 16 GLU HG2 H 1 2.454 0.003 . 2 . . . . 16 E HG2 . 17199 1
145 . 1 1 16 16 GLU C C 13 178.633 0.049 . 1 . . . . 16 E C . 17199 1
146 . 1 1 16 16 GLU CA C 13 59.559 0.051 . 1 . . . . 16 E CA . 17199 1
147 . 1 1 16 16 GLU CB C 13 29.553 0.005 . 1 . . . . 16 E CB . 17199 1
148 . 1 1 16 16 GLU CG C 13 36.645 0.000 . 1 . . . . 16 E CG . 17199 1
149 . 1 1 16 16 GLU N N 15 119.666 0.015 . 1 . . . . 16 E N . 17199 1
150 . 1 1 17 17 ALA H H 1 7.724 0.004 . 1 . . . . 17 A H . 17199 1
151 . 1 1 17 17 ALA HA H 1 4.227 0.008 . 1 . . . . 17 A HA . 17199 1
152 . 1 1 17 17 ALA HB1 H 1 1.516 0.008 . 1 . . . . 17 A HB . 17199 1
153 . 1 1 17 17 ALA HB2 H 1 1.516 0.008 . 1 . . . . 17 A HB . 17199 1
154 . 1 1 17 17 ALA HB3 H 1 1.516 0.008 . 1 . . . . 17 A HB . 17199 1
155 . 1 1 17 17 ALA C C 13 180.388 0.003 . 1 . . . . 17 A C . 17199 1
156 . 1 1 17 17 ALA CA C 13 55.411 0.042 . 1 . . . . 17 A CA . 17199 1
157 . 1 1 17 17 ALA CB C 13 18.072 0.035 . 1 . . . . 17 A CB . 17199 1
158 . 1 1 17 17 ALA N N 15 122.086 0.009 . 1 . . . . 17 A N . 17199 1
159 . 1 1 18 18 ILE H H 1 8.403 0.012 . 1 . . . . 18 I H . 17199 1
160 . 1 1 18 18 ILE HA H 1 3.588 0.056 . 1 . . . . 18 I HA . 17199 1
161 . 1 1 18 18 ILE HB H 1 2.110 0.004 . 1 . . . . 18 I HB . 17199 1
162 . 1 1 18 18 ILE HD11 H 1 0.979 0.008 . 1 . . . . 18 I HD1 . 17199 1
163 . 1 1 18 18 ILE HD12 H 1 0.979 0.008 . 1 . . . . 18 I HD1 . 17199 1
164 . 1 1 18 18 ILE HD13 H 1 0.979 0.008 . 1 . . . . 18 I HD1 . 17199 1
165 . 1 1 18 18 ILE HG12 H 1 0.913 0.007 . 2 . . . . 18 I HG12 . 17199 1
166 . 1 1 18 18 ILE HG21 H 1 0.977 0.004 . 1 . . . . 18 I HG2 . 17199 1
167 . 1 1 18 18 ILE HG22 H 1 0.977 0.004 . 1 . . . . 18 I HG2 . 17199 1
168 . 1 1 18 18 ILE HG23 H 1 0.977 0.004 . 1 . . . . 18 I HG2 . 17199 1
169 . 1 1 18 18 ILE C C 13 177.226 0.018 . 1 . . . . 18 I C . 17199 1
170 . 1 1 18 18 ILE CA C 13 66.643 0.016 . 1 . . . . 18 I CA . 17199 1
171 . 1 1 18 18 ILE CB C 13 38.780 0.035 . 1 . . . . 18 I CB . 17199 1
172 . 1 1 18 18 ILE CD1 C 13 14.440 0.035 . 1 . . . . 18 I CD1 . 17199 1
173 . 1 1 18 18 ILE CG1 C 13 31.206 0.049 . 1 . . . . 18 I CG1 . 17199 1
174 . 1 1 18 18 ILE CG2 C 13 17.568 0.026 . 1 . . . . 18 I CG2 . 17199 1
175 . 1 1 18 18 ILE N N 15 117.325 0.012 . 1 . . . . 18 I N . 17199 1
176 . 1 1 19 19 ASP H H 1 8.925 0.007 . 1 . . . . 19 D H . 17199 1
177 . 1 1 19 19 ASP HA H 1 4.332 0.010 . 1 . . . . 19 D HA . 17199 1
178 . 1 1 19 19 ASP HB2 H 1 2.766 0.081 . 2 . . . . 19 D HB2 . 17199 1
179 . 1 1 19 19 ASP HB3 H 1 2.637 0.004 . 2 . . . . 19 D HB3 . 17199 1
180 . 1 1 19 19 ASP C C 13 179.418 0.016 . 1 . . . . 19 D C . 17199 1
181 . 1 1 19 19 ASP CA C 13 58.131 0.023 . 1 . . . . 19 D CA . 17199 1
182 . 1 1 19 19 ASP CB C 13 39.551 0.058 . 1 . . . . 19 D CB . 17199 1
183 . 1 1 19 19 ASP N N 15 120.529 0.020 . 1 . . . . 19 D N . 17199 1
184 . 1 1 20 20 ASN H H 1 8.428 0.008 . 1 . . . . 20 N H . 17199 1
185 . 1 1 20 20 ASN HA H 1 4.498 0.067 . 1 . . . . 20 N HA . 17199 1
186 . 1 1 20 20 ASN HB2 H 1 3.118 0.005 . 2 . . . . 20 N HB2 . 17199 1
187 . 1 1 20 20 ASN HB3 H 1 2.782 0.010 . 2 . . . . 20 N HB3 . 17199 1
188 . 1 1 20 20 ASN C C 13 178.046 0.016 . 1 . . . . 20 N C . 17199 1
189 . 1 1 20 20 ASN CA C 13 56.283 0.038 . 1 . . . . 20 N CA . 17199 1
190 . 1 1 20 20 ASN CB C 13 38.358 0.035 . 1 . . . . 20 N CB . 17199 1
191 . 1 1 20 20 ASN N N 15 118.997 0.009 . 1 . . . . 20 N N . 17199 1
192 . 1 1 21 21 ILE H H 1 8.135 0.007 . 1 . . . . 21 I H . 17199 1
193 . 1 1 21 21 ILE HA H 1 3.488 0.009 . 1 . . . . 21 I HA . 17199 1
194 . 1 1 21 21 ILE HB H 1 1.802 0.008 . 1 . . . . 21 I HB . 17199 1
195 . 1 1 21 21 ILE HD11 H 1 0.770 0.008 . 1 . . . . 21 I HD1 . 17199 1
196 . 1 1 21 21 ILE HD12 H 1 0.770 0.008 . 1 . . . . 21 I HD1 . 17199 1
197 . 1 1 21 21 ILE HD13 H 1 0.770 0.008 . 1 . . . . 21 I HD1 . 17199 1
198 . 1 1 21 21 ILE HG12 H 1 0.796 0.065 . 2 . . . . 21 I HG12 . 17199 1
199 . 1 1 21 21 ILE HG21 H 1 -0.022 0.004 . 1 . . . . 21 I HG2 . 17199 1
200 . 1 1 21 21 ILE HG22 H 1 -0.022 0.004 . 1 . . . . 21 I HG2 . 17199 1
201 . 1 1 21 21 ILE HG23 H 1 -0.022 0.004 . 1 . . . . 21 I HG2 . 17199 1
202 . 1 1 21 21 ILE C C 13 179.663 0.005 . 1 . . . . 21 I C . 17199 1
203 . 1 1 21 21 ILE CA C 13 65.935 0.028 . 1 . . . . 21 I CA . 17199 1
204 . 1 1 21 21 ILE CB C 13 37.769 0.031 . 1 . . . . 21 I CB . 17199 1
205 . 1 1 21 21 ILE CD1 C 13 14.142 0.027 . 1 . . . . 21 I CD1 . 17199 1
206 . 1 1 21 21 ILE CG1 C 13 30.124 0.019 . 1 . . . . 21 I CG1 . 17199 1
207 . 1 1 21 21 ILE CG2 C 13 17.336 0.020 . 1 . . . . 21 I CG2 . 17199 1
208 . 1 1 21 21 ILE N N 15 122.683 0.013 . 1 . . . . 21 I N . 17199 1
209 . 1 1 22 22 LEU H H 1 8.937 0.003 . 1 . . . . 22 L H . 17199 1
210 . 1 1 22 22 LEU HA H 1 3.654 0.007 . 1 . . . . 22 L HA . 17199 1
211 . 1 1 22 22 LEU HB2 H 1 1.887 0.116 . 2 . . . . 22 L HB2 . 17199 1
212 . 1 1 22 22 LEU HB3 H 1 1.737 0.072 . 2 . . . . 22 L HB3 . 17199 1
213 . 1 1 22 22 LEU HD11 H 1 0.910 0.007 . 2 . . . . 22 L HD1 . 17199 1
214 . 1 1 22 22 LEU HD12 H 1 0.910 0.007 . 2 . . . . 22 L HD1 . 17199 1
215 . 1 1 22 22 LEU HD13 H 1 0.910 0.007 . 2 . . . . 22 L HD1 . 17199 1
216 . 1 1 22 22 LEU HD21 H 1 0.551 0.004 . 2 . . . . 22 L HD2 . 17199 1
217 . 1 1 22 22 LEU HD22 H 1 0.551 0.004 . 2 . . . . 22 L HD2 . 17199 1
218 . 1 1 22 22 LEU HD23 H 1 0.551 0.004 . 2 . . . . 22 L HD2 . 17199 1
219 . 1 1 22 22 LEU HG H 1 2.135 0.004 . 1 . . . . 22 L HG . 17199 1
220 . 1 1 22 22 LEU C C 13 179.244 0.024 . 1 . . . . 22 L C . 17199 1
221 . 1 1 22 22 LEU CA C 13 58.531 0.016 . 1 . . . . 22 L CA . 17199 1
222 . 1 1 22 22 LEU CB C 13 39.477 0.029 . 1 . . . . 22 L CB . 17199 1
223 . 1 1 22 22 LEU CD1 C 13 26.667 0.049 . 2 . . . . 22 L CD1 . 17199 1
224 . 1 1 22 22 LEU CD2 C 13 22.949 0.035 . 2 . . . . 22 L CD2 . 17199 1
225 . 1 1 22 22 LEU CG C 13 25.486 0.099 . 1 . . . . 22 L CG . 17199 1
226 . 1 1 22 22 LEU N N 15 123.051 0.012 . 1 . . . . 22 L N . 17199 1
227 . 1 1 23 23 ARG H H 1 7.885 0.008 . 1 . . . . 23 R H . 17199 1
228 . 1 1 23 23 ARG HA H 1 4.201 0.005 . 1 . . . . 23 R HA . 17199 1
229 . 1 1 23 23 ARG HB2 H 1 1.995 0.022 . 2 . . . . 23 R HB2 . 17199 1
230 . 1 1 23 23 ARG HB3 H 1 1.963 0.006 . 2 . . . . 23 R HB3 . 17199 1
231 . 1 1 23 23 ARG HD2 H 1 3.279 0.035 . 2 . . . . 23 R HD2 . 17199 1
232 . 1 1 23 23 ARG HG2 H 1 1.800 0.072 . 2 . . . . 23 R HG2 . 17199 1
233 . 1 1 23 23 ARG C C 13 179.462 0.030 . 1 . . . . 23 R C . 17199 1
234 . 1 1 23 23 ARG CA C 13 59.249 0.030 . 1 . . . . 23 R CA . 17199 1
235 . 1 1 23 23 ARG CB C 13 30.428 0.068 . 1 . . . . 23 R CB . 17199 1
236 . 1 1 23 23 ARG CD C 13 43.385 0.058 . 1 . . . . 23 R CD . 17199 1
237 . 1 1 23 23 ARG CG C 13 27.822 0.066 . 1 . . . . 23 R CG . 17199 1
238 . 1 1 23 23 ARG N N 15 117.229 0.022 . 1 . . . . 23 R N . 17199 1
239 . 1 1 24 24 TYR H H 1 8.345 0.005 . 1 . . . . 24 Y H . 17199 1
240 . 1 1 24 24 TYR HA H 1 4.361 0.010 . 1 . . . . 24 Y HA . 17199 1
241 . 1 1 24 24 TYR HB2 H 1 3.325 0.004 . 2 . . . . 24 Y HB2 . 17199 1
242 . 1 1 24 24 TYR HB3 H 1 2.916 0.026 . 2 . . . . 24 Y HB3 . 17199 1
243 . 1 1 24 24 TYR C C 13 176.656 0.018 . 1 . . . . 24 Y C . 17199 1
244 . 1 1 24 24 TYR CA C 13 60.607 0.094 . 1 . . . . 24 Y CA . 17199 1
245 . 1 1 24 24 TYR CB C 13 39.486 0.039 . 1 . . . . 24 Y CB . 17199 1
246 . 1 1 24 24 TYR N N 15 119.468 0.021 . 1 . . . . 24 Y N . 17199 1
247 . 1 1 25 25 THR H H 1 7.875 0.004 . 1 . . . . 25 T H . 17199 1
248 . 1 1 25 25 THR HA H 1 4.064 0.004 . 1 . . . . 25 T HA . 17199 1
249 . 1 1 25 25 THR HB H 1 4.179 0.006 . 1 . . . . 25 T HB . 17199 1
250 . 1 1 25 25 THR HG21 H 1 1.177 0.004 . 1 . . . . 25 T HG2 . 17199 1
251 . 1 1 25 25 THR HG22 H 1 1.177 0.004 . 1 . . . . 25 T HG2 . 17199 1
252 . 1 1 25 25 THR HG23 H 1 1.177 0.004 . 1 . . . . 25 T HG2 . 17199 1
253 . 1 1 25 25 THR C C 13 174.264 0.020 . 1 . . . . 25 T C . 17199 1
254 . 1 1 25 25 THR CA C 13 61.458 0.029 . 1 . . . . 25 T CA . 17199 1
255 . 1 1 25 25 THR CB C 13 70.803 0.017 . 1 . . . . 25 T CB . 17199 1
256 . 1 1 25 25 THR CG2 C 13 22.658 0.042 . 1 . . . . 25 T CG2 . 17199 1
257 . 1 1 25 25 THR N N 15 103.039 0.019 . 1 . . . . 25 T N . 17199 1
258 . 1 1 26 26 ASN H H 1 7.793 0.003 . 1 . . . . 26 N H . 17199 1
259 . 1 1 26 26 ASN HA H 1 4.460 0.037 . 1 . . . . 26 N HA . 17199 1
260 . 1 1 26 26 ASN HB2 H 1 3.166 0.004 . 2 . . . . 26 N HB2 . 17199 1
261 . 1 1 26 26 ASN HB3 H 1 2.616 0.005 . 2 . . . . 26 N HB3 . 17199 1
262 . 1 1 26 26 ASN C C 13 174.080 0.040 . 1 . . . . 26 N C . 17199 1
263 . 1 1 26 26 ASN CA C 13 54.293 0.068 . 1 . . . . 26 N CA . 17199 1
264 . 1 1 26 26 ASN CB C 13 37.710 0.035 . 1 . . . . 26 N CB . 17199 1
265 . 1 1 26 26 ASN N N 15 121.980 0.007 . 1 . . . . 26 N N . 17199 1
266 . 1 1 27 27 SER H H 1 8.123 0.006 . 1 . . . . 27 S H . 17199 1
267 . 1 1 27 27 SER HA H 1 5.191 0.004 . 1 . . . . 27 S HA . 17199 1
268 . 1 1 27 27 SER HB2 H 1 3.759 0.098 . 2 . . . . 27 S HB2 . 17199 1
269 . 1 1 27 27 SER HB3 H 1 3.582 0.008 . 2 . . . . 27 S HB3 . 17199 1
270 . 1 1 27 27 SER C C 13 173.325 0.026 . 1 . . . . 27 S C . 17199 1
271 . 1 1 27 27 SER CA C 13 57.573 0.054 . 1 . . . . 27 S CA . 17199 1
272 . 1 1 27 27 SER CB C 13 66.658 0.021 . 1 . . . . 27 S CB . 17199 1
273 . 1 1 27 27 SER N N 15 112.137 0.013 . 1 . . . . 27 S N . 17199 1
274 . 1 1 28 28 THR H H 1 8.376 0.007 . 1 . . . . 28 T H . 17199 1
275 . 1 1 28 28 THR HA H 1 4.692 0.008 . 1 . . . . 28 T HA . 17199 1
276 . 1 1 28 28 THR HB H 1 4.810 0.009 . 1 . . . . 28 T HB . 17199 1
277 . 1 1 28 28 THR HG21 H 1 1.277 0.005 . 1 . . . . 28 T HG2 . 17199 1
278 . 1 1 28 28 THR HG22 H 1 1.277 0.005 . 1 . . . . 28 T HG2 . 17199 1
279 . 1 1 28 28 THR HG23 H 1 1.277 0.005 . 1 . . . . 28 T HG2 . 17199 1
280 . 1 1 28 28 THR C C 13 176.240 0.017 . 1 . . . . 28 T C . 17199 1
281 . 1 1 28 28 THR CA C 13 59.669 0.034 . 1 . . . . 28 T CA . 17199 1
282 . 1 1 28 28 THR CB C 13 71.959 0.057 . 1 . . . . 28 T CB . 17199 1
283 . 1 1 28 28 THR CG2 C 13 21.671 0.047 . 1 . . . . 28 T CG2 . 17199 1
284 . 1 1 28 28 THR N N 15 109.858 0.014 . 1 . . . . 28 T N . 17199 1
285 . 1 1 29 29 GLU H H 1 9.520 0.006 . 1 . . . . 29 E H . 17199 1
286 . 1 1 29 29 GLU HA H 1 3.856 0.006 . 1 . . . . 29 E HA . 17199 1
287 . 1 1 29 29 GLU HB2 H 1 2.069 0.110 . 2 . . . . 29 E HB2 . 17199 1
288 . 1 1 29 29 GLU HB3 H 1 1.924 0.073 . 2 . . . . 29 E HB3 . 17199 1
289 . 1 1 29 29 GLU HG2 H 1 2.366 0.088 . 2 . . . . 29 E HG2 . 17199 1
290 . 1 1 29 29 GLU HG3 H 1 2.232 0.075 . 2 . . . . 29 E HG3 . 17199 1
291 . 1 1 29 29 GLU C C 13 178.059 0.001 . 1 . . . . 29 E C . 17199 1
292 . 1 1 29 29 GLU CA C 13 60.884 0.066 . 1 . . . . 29 E CA . 17199 1
293 . 1 1 29 29 GLU CB C 13 29.888 0.053 . 1 . . . . 29 E CB . 17199 1
294 . 1 1 29 29 GLU CG C 13 37.663 0.058 . 1 . . . . 29 E CG . 17199 1
295 . 1 1 29 29 GLU N N 15 120.741 0.011 . 1 . . . . 29 E N . 17199 1
296 . 1 1 30 30 GLN H H 1 8.718 0.005 . 1 . . . . 30 Q H . 17199 1
297 . 1 1 30 30 GLN HA H 1 3.911 0.007 . 1 . . . . 30 Q HA . 17199 1
298 . 1 1 30 30 GLN HB2 H 1 2.123 0.103 . 2 . . . . 30 Q HB2 . 17199 1
299 . 1 1 30 30 GLN HB3 H 1 2.011 0.071 . 2 . . . . 30 Q HB3 . 17199 1
300 . 1 1 30 30 GLN HG2 H 1 2.510 0.031 . 2 . . . . 30 Q HG2 . 17199 1
301 . 1 1 30 30 GLN HG3 H 1 2.421 0.005 . 2 . . . . 30 Q HG3 . 17199 1
302 . 1 1 30 30 GLN C C 13 178.669 0.027 . 1 . . . . 30 Q C . 17199 1
303 . 1 1 30 30 GLN CA C 13 59.922 0.050 . 1 . . . . 30 Q CA . 17199 1
304 . 1 1 30 30 GLN CB C 13 28.012 0.045 . 1 . . . . 30 Q CB . 17199 1
305 . 1 1 30 30 GLN CG C 13 34.024 0.033 . 1 . . . . 30 Q CG . 17199 1
306 . 1 1 30 30 GLN N N 15 117.618 0.019 . 1 . . . . 30 Q N . 17199 1
307 . 1 1 31 31 GLN H H 1 7.804 0.002 . 1 . . . . 31 Q H . 17199 1
308 . 1 1 31 31 GLN HA H 1 4.122 0.005 . 1 . . . . 31 Q HA . 17199 1
309 . 1 1 31 31 GLN HB2 H 1 2.452 0.009 . 2 . . . . 31 Q HB2 . 17199 1
310 . 1 1 31 31 GLN HB3 H 1 1.868 0.064 . 2 . . . . 31 Q HB3 . 17199 1
311 . 1 1 31 31 GLN HG2 H 1 2.508 0.015 . 2 . . . . 31 Q HG2 . 17199 1
312 . 1 1 31 31 GLN C C 13 180.009 0.006 . 1 . . . . 31 Q C . 17199 1
313 . 1 1 31 31 GLN CA C 13 58.673 0.045 . 1 . . . . 31 Q CA . 17199 1
314 . 1 1 31 31 GLN CB C 13 28.644 0.047 . 1 . . . . 31 Q CB . 17199 1
315 . 1 1 31 31 GLN CG C 13 34.553 0.053 . 1 . . . . 31 Q CG . 17199 1
316 . 1 1 31 31 GLN N N 15 119.005 0.010 . 1 . . . . 31 Q N . 17199 1
317 . 1 1 32 32 PHE H H 1 8.794 0.004 . 1 . . . . 32 F H . 17199 1
318 . 1 1 32 32 PHE HA H 1 4.796 0.006 . 1 . . . . 32 F HA . 17199 1
319 . 1 1 32 32 PHE HB2 H 1 3.213 0.014 . 2 . . . . 32 F HB2 . 17199 1
320 . 1 1 32 32 PHE HD1 H 1 7.231 0.000 . 3 . . . . 32 F HD1 . 17199 1
321 . 1 1 32 32 PHE HE1 H 1 7.125 0.000 . 3 . . . . 32 F HE1 . 17199 1
322 . 1 1 32 32 PHE C C 13 177.095 0.001 . 1 . . . . 32 F C . 17199 1
323 . 1 1 32 32 PHE CA C 13 57.507 0.067 . 1 . . . . 32 F CA . 17199 1
324 . 1 1 32 32 PHE CB C 13 38.018 0.043 . 1 . . . . 32 F CB . 17199 1
325 . 1 1 32 32 PHE N N 15 121.716 0.014 . 1 . . . . 32 F N . 17199 1
326 . 1 1 33 33 LEU H H 1 8.879 0.003 . 1 . . . . 33 L H . 17199 1
327 . 1 1 33 33 LEU HA H 1 3.772 0.004 . 1 . . . . 33 L HA . 17199 1
328 . 1 1 33 33 LEU HB2 H 1 2.073 0.005 . 2 . . . . 33 L HB2 . 17199 1
329 . 1 1 33 33 LEU HB3 H 1 1.319 0.006 . 2 . . . . 33 L HB3 . 17199 1
330 . 1 1 33 33 LEU HD11 H 1 0.922 0.006 . 2 . . . . 33 L HD1 . 17199 1
331 . 1 1 33 33 LEU HD12 H 1 0.922 0.006 . 2 . . . . 33 L HD1 . 17199 1
332 . 1 1 33 33 LEU HD13 H 1 0.922 0.006 . 2 . . . . 33 L HD1 . 17199 1
333 . 1 1 33 33 LEU HD21 H 1 0.837 0.026 . 2 . . . . 33 L HD2 . 17199 1
334 . 1 1 33 33 LEU HD22 H 1 0.837 0.026 . 2 . . . . 33 L HD2 . 17199 1
335 . 1 1 33 33 LEU HD23 H 1 0.837 0.026 . 2 . . . . 33 L HD2 . 17199 1
336 . 1 1 33 33 LEU HG H 1 1.579 0.059 . 1 . . . . 33 L HG . 17199 1
337 . 1 1 33 33 LEU C C 13 177.729 0.051 . 1 . . . . 33 L C . 17199 1
338 . 1 1 33 33 LEU CA C 13 58.776 0.020 . 1 . . . . 33 L CA . 17199 1
339 . 1 1 33 33 LEU CB C 13 40.932 0.079 . 1 . . . . 33 L CB . 17199 1
340 . 1 1 33 33 LEU CD1 C 13 26.657 0.087 . 2 . . . . 33 L CD1 . 17199 1
341 . 1 1 33 33 LEU CD2 C 13 23.556 0.030 . 2 . . . . 33 L CD2 . 17199 1
342 . 1 1 33 33 LEU CG C 13 27.031 0.108 . 1 . . . . 33 L CG . 17199 1
343 . 1 1 33 33 LEU N N 15 121.859 0.007 . 1 . . . . 33 L N . 17199 1
344 . 1 1 34 34 GLU H H 1 8.262 0.003 . 1 . . . . 34 E H . 17199 1
345 . 1 1 34 34 GLU HA H 1 4.058 0.008 . 1 . . . . 34 E HA . 17199 1
346 . 1 1 34 34 GLU HB2 H 1 2.127 0.005 . 2 . . . . 34 E HB2 . 17199 1
347 . 1 1 34 34 GLU HG2 H 1 2.445 0.085 . 2 . . . . 34 E HG2 . 17199 1
348 . 1 1 34 34 GLU HG3 H 1 2.381 0.095 . 2 . . . . 34 E HG3 . 17199 1
349 . 1 1 34 34 GLU C C 13 179.827 0.013 . 1 . . . . 34 E C . 17199 1
350 . 1 1 34 34 GLU CA C 13 59.756 0.056 . 1 . . . . 34 E CA . 17199 1
351 . 1 1 34 34 GLU CB C 13 29.255 0.054 . 1 . . . . 34 E CB . 17199 1
352 . 1 1 34 34 GLU CG C 13 36.508 0.075 . 1 . . . . 34 E CG . 17199 1
353 . 1 1 34 34 GLU N N 15 118.790 0.023 . 1 . . . . 34 E N . 17199 1
354 . 1 1 35 35 ALA H H 1 8.091 0.008 . 1 . . . . 35 A H . 17199 1
355 . 1 1 35 35 ALA HA H 1 4.219 0.063 . 1 . . . . 35 A HA . 17199 1
356 . 1 1 35 35 ALA HB1 H 1 1.656 0.012 . 1 . . . . 35 A HB . 17199 1
357 . 1 1 35 35 ALA HB2 H 1 1.656 0.012 . 1 . . . . 35 A HB . 17199 1
358 . 1 1 35 35 ALA HB3 H 1 1.656 0.012 . 1 . . . . 35 A HB . 17199 1
359 . 1 1 35 35 ALA C C 13 180.385 0.029 . 1 . . . . 35 A C . 17199 1
360 . 1 1 35 35 ALA CA C 13 55.385 0.033 . 1 . . . . 35 A CA . 17199 1
361 . 1 1 35 35 ALA CB C 13 18.180 0.022 . 1 . . . . 35 A CB . 17199 1
362 . 1 1 35 35 ALA N N 15 121.941 0.014 . 1 . . . . 35 A N . 17199 1
363 . 1 1 36 36 MET H H 1 8.642 0.007 . 1 . . . . 36 M H . 17199 1
364 . 1 1 36 36 MET HA H 1 4.067 0.008 . 1 . . . . 36 M HA . 17199 1
365 . 1 1 36 36 MET HB2 H 1 2.366 0.007 . 2 . . . . 36 M HB2 . 17199 1
366 . 1 1 36 36 MET HB3 H 1 1.565 0.007 . 2 . . . . 36 M HB3 . 17199 1
367 . 1 1 36 36 MET HG2 H 1 2.107 0.006 . 2 . . . . 36 M HG2 . 17199 1
368 . 1 1 36 36 MET HG3 H 1 1.581 0.009 . 2 . . . . 36 M HG3 . 17199 1
369 . 1 1 36 36 MET C C 13 178.995 0.009 . 1 . . . . 36 M C . 17199 1
370 . 1 1 36 36 MET CA C 13 57.873 0.045 . 1 . . . . 36 M CA . 17199 1
371 . 1 1 36 36 MET CB C 13 33.323 0.027 . 1 . . . . 36 M CB . 17199 1
372 . 1 1 36 36 MET CG C 13 34.917 0.046 . 1 . . . . 36 M CG . 17199 1
373 . 1 1 36 36 MET N N 15 118.387 0.014 . 1 . . . . 36 M N . 17199 1
374 . 1 1 37 37 GLU H H 1 9.017 0.004 . 1 . . . . 37 E H . 17199 1
375 . 1 1 37 37 GLU HA H 1 4.257 0.008 . 1 . . . . 37 E HA . 17199 1
376 . 1 1 37 37 GLU HB2 H 1 2.064 0.006 . 2 . . . . 37 E HB2 . 17199 1
377 . 1 1 37 37 GLU HG2 H 1 2.367 0.104 . 2 . . . . 37 E HG2 . 17199 1
378 . 1 1 37 37 GLU HG3 H 1 2.260 0.114 . 2 . . . . 37 E HG3 . 17199 1
379 . 1 1 37 37 GLU C C 13 180.158 0.017 . 1 . . . . 37 E C . 17199 1
380 . 1 1 37 37 GLU CA C 13 59.453 0.025 . 1 . . . . 37 E CA . 17199 1
381 . 1 1 37 37 GLU CB C 13 29.091 0.033 . 1 . . . . 37 E CB . 17199 1
382 . 1 1 37 37 GLU CG C 13 36.304 0.059 . 1 . . . . 37 E CG . 17199 1
383 . 1 1 37 37 GLU N N 15 120.092 0.009 . 1 . . . . 37 E N . 17199 1
384 . 1 1 38 38 SER H H 1 8.144 0.010 . 1 . . . . 38 S H . 17199 1
385 . 1 1 38 38 SER HA H 1 4.504 0.004 . 1 . . . . 38 S HA . 17199 1
386 . 1 1 38 38 SER HB2 H 1 4.106 0.015 . 2 . . . . 38 S HB2 . 17199 1
387 . 1 1 38 38 SER HB3 H 1 4.090 0.000 . 2 . . . . 38 S HB3 . 17199 1
388 . 1 1 38 38 SER C C 13 175.694 0.030 . 1 . . . . 38 S C . 17199 1
389 . 1 1 38 38 SER CA C 13 60.476 0.081 . 1 . . . . 38 S CA . 17199 1
390 . 1 1 38 38 SER CB C 13 63.615 0.032 . 1 . . . . 38 S CB . 17199 1
391 . 1 1 38 38 SER N N 15 113.361 0.025 . 1 . . . . 38 S N . 17199 1
392 . 1 1 39 39 THR H H 1 7.505 0.003 . 1 . . . . 39 T H . 17199 1
393 . 1 1 39 39 THR HA H 1 4.719 0.006 . 1 . . . . 39 T HA . 17199 1
394 . 1 1 39 39 THR HB H 1 4.630 0.007 . 1 . . . . 39 T HB . 17199 1
395 . 1 1 39 39 THR HG21 H 1 1.212 0.066 . 1 . . . . 39 T HG2 . 17199 1
396 . 1 1 39 39 THR HG22 H 1 1.212 0.066 . 1 . . . . 39 T HG2 . 17199 1
397 . 1 1 39 39 THR HG23 H 1 1.212 0.066 . 1 . . . . 39 T HG2 . 17199 1
398 . 1 1 39 39 THR C C 13 176.231 0.008 . 1 . . . . 39 T C . 17199 1
399 . 1 1 39 39 THR CA C 13 61.224 0.019 . 1 . . . . 39 T CA . 17199 1
400 . 1 1 39 39 THR CB C 13 70.237 0.038 . 1 . . . . 39 T CB . 17199 1
401 . 1 1 39 39 THR CG2 C 13 21.744 0.067 . 1 . . . . 39 T CG2 . 17199 1
402 . 1 1 39 39 THR N N 15 109.675 0.011 . 1 . . . . 39 T N . 17199 1
403 . 1 1 40 40 GLY H H 1 7.840 0.003 . 1 . . . . 40 G H . 17199 1
404 . 1 1 40 40 GLY HA2 H 1 4.054 0.065 . 2 . . . . 40 G HA2 . 17199 1
405 . 1 1 40 40 GLY HA3 H 1 3.943 0.004 . 2 . . . . 40 G HA3 . 17199 1
406 . 1 1 40 40 GLY C C 13 175.812 0.017 . 1 . . . . 40 G C . 17199 1
407 . 1 1 40 40 GLY CA C 13 46.571 0.040 . 1 . . . . 40 G CA . 17199 1
408 . 1 1 40 40 GLY N N 15 110.848 0.012 . 1 . . . . 40 G N . 17199 1
409 . 1 1 41 41 GLY H H 1 8.986 0.002 . 1 . . . . 41 G H . 17199 1
410 . 1 1 41 41 GLY HA2 H 1 4.018 0.005 . 2 . . . . 41 G HA2 . 17199 1
411 . 1 1 41 41 GLY HA3 H 1 3.337 0.006 . 2 . . . . 41 G HA3 . 17199 1
412 . 1 1 41 41 GLY C C 13 173.237 0.013 . 1 . . . . 41 G C . 17199 1
413 . 1 1 41 41 GLY CA C 13 45.856 0.029 . 1 . . . . 41 G CA . 17199 1
414 . 1 1 41 41 GLY N N 15 106.475 0.011 . 1 . . . . 41 G N . 17199 1
415 . 1 1 42 42 ARG H H 1 7.004 0.008 . 1 . . . . 42 R H . 17199 1
416 . 1 1 42 42 ARG HA H 1 4.654 0.006 . 1 . . . . 42 R HA . 17199 1
417 . 1 1 42 42 ARG HB2 H 1 2.041 0.063 . 2 . . . . 42 R HB2 . 17199 1
418 . 1 1 42 42 ARG HB3 H 1 1.908 0.035 . 2 . . . . 42 R HB3 . 17199 1
419 . 1 1 42 42 ARG HD2 H 1 3.319 0.010 . 2 . . . . 42 R HD2 . 17199 1
420 . 1 1 42 42 ARG HG2 H 1 1.784 0.022 . 2 . . . . 42 R HG2 . 17199 1
421 . 1 1 42 42 ARG C C 13 176.485 0.006 . 1 . . . . 42 R C . 17199 1
422 . 1 1 42 42 ARG CA C 13 54.926 0.034 . 1 . . . . 42 R CA . 17199 1
423 . 1 1 42 42 ARG CB C 13 29.762 0.053 . 1 . . . . 42 R CB . 17199 1
424 . 1 1 42 42 ARG CD C 13 43.585 0.065 . 1 . . . . 42 R CD . 17199 1
425 . 1 1 42 42 ARG CG C 13 26.835 0.033 . 1 . . . . 42 R CG . 17199 1
426 . 1 1 42 42 ARG N N 15 119.130 0.007 . 1 . . . . 42 R N . 17199 1
427 . 1 1 43 43 VAL H H 1 8.671 0.005 . 1 . . . . 43 V H . 17199 1
428 . 1 1 43 43 VAL HA H 1 3.971 0.005 . 1 . . . . 43 V HA . 17199 1
429 . 1 1 43 43 VAL HB H 1 2.187 0.005 . 1 . . . . 43 V HB . 17199 1
430 . 1 1 43 43 VAL HG11 H 1 1.246 0.003 . 2 . . . . 43 V HG1 . 17199 1
431 . 1 1 43 43 VAL HG12 H 1 1.246 0.003 . 2 . . . . 43 V HG1 . 17199 1
432 . 1 1 43 43 VAL HG13 H 1 1.246 0.003 . 2 . . . . 43 V HG1 . 17199 1
433 . 1 1 43 43 VAL HG21 H 1 1.054 0.007 . 2 . . . . 43 V HG2 . 17199 1
434 . 1 1 43 43 VAL HG22 H 1 1.054 0.007 . 2 . . . . 43 V HG2 . 17199 1
435 . 1 1 43 43 VAL HG23 H 1 1.054 0.007 . 2 . . . . 43 V HG2 . 17199 1
436 . 1 1 43 43 VAL C C 13 176.764 0.064 . 1 . . . . 43 V C . 17199 1
437 . 1 1 43 43 VAL CA C 13 66.772 0.017 . 1 . . . . 43 V CA . 17199 1
438 . 1 1 43 43 VAL CB C 13 32.372 0.053 . 1 . . . . 43 V CB . 17199 1
439 . 1 1 43 43 VAL CG1 C 13 23.217 0.025 . 2 . . . . 43 V CG1 . 17199 1
440 . 1 1 43 43 VAL CG2 C 13 21.727 0.052 . 2 . . . . 43 V CG2 . 17199 1
441 . 1 1 43 43 VAL N N 15 128.035 0.021 . 1 . . . . 43 V N . 17199 1
442 . 1 1 44 44 ARG H H 1 9.250 0.004 . 1 . . . . 44 R H . 17199 1
443 . 1 1 44 44 ARG HA H 1 3.985 0.039 . 1 . . . . 44 R HA . 17199 1
444 . 1 1 44 44 ARG HB2 H 1 1.944 0.011 . 2 . . . . 44 R HB2 . 17199 1
445 . 1 1 44 44 ARG HB3 H 1 1.862 0.009 . 2 . . . . 44 R HB3 . 17199 1
446 . 1 1 44 44 ARG HG2 H 1 1.627 0.007 . 2 . . . . 44 R HG2 . 17199 1
447 . 1 1 44 44 ARG C C 13 179.085 0.009 . 1 . . . . 44 R C . 17199 1
448 . 1 1 44 44 ARG CA C 13 60.403 0.046 . 1 . . . . 44 R CA . 17199 1
449 . 1 1 44 44 ARG CB C 13 29.671 0.075 . 1 . . . . 44 R CB . 17199 1
450 . 1 1 44 44 ARG CD C 13 43.529 0.095 . 1 . . . . 44 R CD . 17199 1
451 . 1 1 44 44 ARG CG C 13 28.192 0.030 . 1 . . . . 44 R CG . 17199 1
452 . 1 1 44 44 ARG N N 15 118.400 0.022 . 1 . . . . 44 R N . 17199 1
453 . 1 1 45 45 ILE H H 1 7.074 0.006 . 1 . . . . 45 I H . 17199 1
454 . 1 1 45 45 ILE HA H 1 3.942 0.006 . 1 . . . . 45 I HA . 17199 1
455 . 1 1 45 45 ILE HB H 1 2.074 0.007 . 1 . . . . 45 I HB . 17199 1
456 . 1 1 45 45 ILE HD11 H 1 0.901 0.007 . 1 . . . . 45 I HD1 . 17199 1
457 . 1 1 45 45 ILE HD12 H 1 0.901 0.007 . 1 . . . . 45 I HD1 . 17199 1
458 . 1 1 45 45 ILE HD13 H 1 0.901 0.007 . 1 . . . . 45 I HD1 . 17199 1
459 . 1 1 45 45 ILE HG12 H 1 1.545 0.104 . 2 . . . . 45 I HG12 . 17199 1
460 . 1 1 45 45 ILE HG13 H 1 1.383 0.069 . 2 . . . . 45 I HG13 . 17199 1
461 . 1 1 45 45 ILE HG21 H 1 1.096 0.005 . 1 . . . . 45 I HG2 . 17199 1
462 . 1 1 45 45 ILE HG22 H 1 1.096 0.005 . 1 . . . . 45 I HG2 . 17199 1
463 . 1 1 45 45 ILE HG23 H 1 1.096 0.005 . 1 . . . . 45 I HG2 . 17199 1
464 . 1 1 45 45 ILE C C 13 178.204 0.004 . 1 . . . . 45 I C . 17199 1
465 . 1 1 45 45 ILE CA C 13 62.827 0.027 . 1 . . . . 45 I CA . 17199 1
466 . 1 1 45 45 ILE CB C 13 36.942 0.058 . 1 . . . . 45 I CB . 17199 1
467 . 1 1 45 45 ILE CD1 C 13 10.996 0.030 . 1 . . . . 45 I CD1 . 17199 1
468 . 1 1 45 45 ILE CG1 C 13 27.965 0.046 . 1 . . . . 45 I CG1 . 17199 1
469 . 1 1 45 45 ILE CG2 C 13 17.968 0.019 . 1 . . . . 45 I CG2 . 17199 1
470 . 1 1 45 45 ILE N N 15 118.315 0.018 . 1 . . . . 45 I N . 17199 1
471 . 1 1 46 46 ALA H H 1 8.345 0.006 . 1 . . . . 46 A H . 17199 1
472 . 1 1 46 46 ALA HA H 1 3.919 0.006 . 1 . . . . 46 A HA . 17199 1
473 . 1 1 46 46 ALA HB1 H 1 1.480 0.006 . 1 . . . . 46 A HB . 17199 1
474 . 1 1 46 46 ALA HB2 H 1 1.480 0.006 . 1 . . . . 46 A HB . 17199 1
475 . 1 1 46 46 ALA HB3 H 1 1.480 0.006 . 1 . . . . 46 A HB . 17199 1
476 . 1 1 46 46 ALA C C 13 179.249 0.007 . 1 . . . . 46 A C . 17199 1
477 . 1 1 46 46 ALA CA C 13 55.944 0.023 . 1 . . . . 46 A CA . 17199 1
478 . 1 1 46 46 ALA CB C 13 18.096 0.020 . 1 . . . . 46 A CB . 17199 1
479 . 1 1 46 46 ALA N N 15 124.413 0.015 . 1 . . . . 46 A N . 17199 1
480 . 1 1 47 47 ILE H H 1 8.679 0.002 . 1 . . . . 47 I H . 17199 1
481 . 1 1 47 47 ILE HA H 1 3.427 0.005 . 1 . . . . 47 I HA . 17199 1
482 . 1 1 47 47 ILE HB H 1 1.882 0.007 . 1 . . . . 47 I HB . 17199 1
483 . 1 1 47 47 ILE HD11 H 1 0.812 0.006 . 1 . . . . 47 I HD1 . 17199 1
484 . 1 1 47 47 ILE HD12 H 1 0.812 0.006 . 1 . . . . 47 I HD1 . 17199 1
485 . 1 1 47 47 ILE HD13 H 1 0.812 0.006 . 1 . . . . 47 I HD1 . 17199 1
486 . 1 1 47 47 ILE HG12 H 1 1.988 0.008 . 2 . . . . 47 I HG12 . 17199 1
487 . 1 1 47 47 ILE HG13 H 1 0.684 0.005 . 2 . . . . 47 I HG13 . 17199 1
488 . 1 1 47 47 ILE HG21 H 1 0.900 0.007 . 1 . . . . 47 I HG2 . 17199 1
489 . 1 1 47 47 ILE HG22 H 1 0.900 0.007 . 1 . . . . 47 I HG2 . 17199 1
490 . 1 1 47 47 ILE HG23 H 1 0.900 0.007 . 1 . . . . 47 I HG2 . 17199 1
491 . 1 1 47 47 ILE C C 13 177.131 0.010 . 1 . . . . 47 I C . 17199 1
492 . 1 1 47 47 ILE CA C 13 66.463 0.011 . 1 . . . . 47 I CA . 17199 1
493 . 1 1 47 47 ILE CB C 13 38.182 0.118 . 1 . . . . 47 I CB . 17199 1
494 . 1 1 47 47 ILE CD1 C 13 14.732 0.051 . 1 . . . . 47 I CD1 . 17199 1
495 . 1 1 47 47 ILE CG1 C 13 29.865 0.034 . 1 . . . . 47 I CG1 . 17199 1
496 . 1 1 47 47 ILE CG2 C 13 17.241 0.053 . 1 . . . . 47 I CG2 . 17199 1
497 . 1 1 47 47 ILE N N 15 116.893 0.012 . 1 . . . . 47 I N . 17199 1
498 . 1 1 48 48 ALA H H 1 7.368 0.005 . 1 . . . . 48 A H . 17199 1
499 . 1 1 48 48 ALA HA H 1 4.091 0.004 . 1 . . . . 48 A HA . 17199 1
500 . 1 1 48 48 ALA HB1 H 1 1.586 0.004 . 1 . . . . 48 A HB . 17199 1
501 . 1 1 48 48 ALA HB2 H 1 1.586 0.004 . 1 . . . . 48 A HB . 17199 1
502 . 1 1 48 48 ALA HB3 H 1 1.586 0.004 . 1 . . . . 48 A HB . 17199 1
503 . 1 1 48 48 ALA C C 13 180.832 0.002 . 1 . . . . 48 A C . 17199 1
504 . 1 1 48 48 ALA CA C 13 55.507 0.052 . 1 . . . . 48 A CA . 17199 1
505 . 1 1 48 48 ALA CB C 13 17.800 0.027 . 1 . . . . 48 A CB . 17199 1
506 . 1 1 48 48 ALA N N 15 120.655 0.012 . 1 . . . . 48 A N . 17199 1
507 . 1 1 49 49 LYS H H 1 8.166 0.005 . 1 . . . . 49 K H . 17199 1
508 . 1 1 49 49 LYS HA H 1 4.097 0.005 . 1 . . . . 49 K HA . 17199 1
509 . 1 1 49 49 LYS HB2 H 1 2.040 0.005 . 2 . . . . 49 K HB2 . 17199 1
510 . 1 1 49 49 LYS HD2 H 1 1.628 0.004 . 2 . . . . 49 K HD2 . 17199 1
511 . 1 1 49 49 LYS HE2 H 1 2.979 0.005 . 2 . . . . 49 K HE2 . 17199 1
512 . 1 1 49 49 LYS HG2 H 1 1.573 0.048 . 2 . . . . 49 K HG2 . 17199 1
513 . 1 1 49 49 LYS HG3 H 1 1.477 0.006 . 2 . . . . 49 K HG3 . 17199 1
514 . 1 1 49 49 LYS C C 13 180.163 0.013 . 1 . . . . 49 K C . 17199 1
515 . 1 1 49 49 LYS CA C 13 59.515 0.028 . 1 . . . . 49 K CA . 17199 1
516 . 1 1 49 49 LYS CB C 13 32.237 0.075 . 1 . . . . 49 K CB . 17199 1
517 . 1 1 49 49 LYS CD C 13 29.548 0.043 . 1 . . . . 49 K CD . 17199 1
518 . 1 1 49 49 LYS CE C 13 42.008 0.060 . 1 . . . . 49 K CE . 17199 1
519 . 1 1 49 49 LYS CG C 13 25.202 0.033 . 1 . . . . 49 K CG . 17199 1
520 . 1 1 49 49 LYS N N 15 119.542 0.022 . 1 . . . . 49 K N . 17199 1
521 . 1 1 50 50 LEU H H 1 8.202 0.003 . 1 . . . . 50 L H . 17199 1
522 . 1 1 50 50 LEU HA H 1 4.088 0.006 . 1 . . . . 50 L HA . 17199 1
523 . 1 1 50 50 LEU HB2 H 1 2.067 0.004 . 2 . . . . 50 L HB2 . 17199 1
524 . 1 1 50 50 LEU HB3 H 1 1.405 0.008 . 2 . . . . 50 L HB3 . 17199 1
525 . 1 1 50 50 LEU HD11 H 1 0.666 0.004 . 2 . . . . 50 L HD1 . 17199 1
526 . 1 1 50 50 LEU HD12 H 1 0.666 0.004 . 2 . . . . 50 L HD1 . 17199 1
527 . 1 1 50 50 LEU HD13 H 1 0.666 0.004 . 2 . . . . 50 L HD1 . 17199 1
528 . 1 1 50 50 LEU HD21 H 1 0.829 0.005 . 2 . . . . 50 L HD2 . 17199 1
529 . 1 1 50 50 LEU HD22 H 1 0.829 0.005 . 2 . . . . 50 L HD2 . 17199 1
530 . 1 1 50 50 LEU HD23 H 1 0.829 0.005 . 2 . . . . 50 L HD2 . 17199 1
531 . 1 1 50 50 LEU HG H 1 1.894 0.007 . 1 . . . . 50 L HG . 17199 1
532 . 1 1 50 50 LEU C C 13 180.192 0.008 . 1 . . . . 50 L C . 17199 1
533 . 1 1 50 50 LEU CA C 13 57.725 0.032 . 1 . . . . 50 L CA . 17199 1
534 . 1 1 50 50 LEU CB C 13 41.429 0.059 . 1 . . . . 50 L CB . 17199 1
535 . 1 1 50 50 LEU CD1 C 13 25.408 0.040 . 2 . . . . 50 L CD1 . 17199 1
536 . 1 1 50 50 LEU CD2 C 13 21.656 0.034 . 2 . . . . 50 L CD2 . 17199 1
537 . 1 1 50 50 LEU CG C 13 25.989 0.144 . 1 . . . . 50 L CG . 17199 1
538 . 1 1 50 50 LEU N N 15 120.619 0.012 . 1 . . . . 50 L N . 17199 1
539 . 1 1 51 51 LEU H H 1 8.319 0.003 . 1 . . . . 51 L H . 17199 1
540 . 1 1 51 51 LEU HA H 1 4.162 0.008 . 1 . . . . 51 L HA . 17199 1
541 . 1 1 51 51 LEU HB2 H 1 1.855 0.007 . 2 . . . . 51 L HB2 . 17199 1
542 . 1 1 51 51 LEU HB3 H 1 1.555 0.008 . 2 . . . . 51 L HB3 . 17199 1
543 . 1 1 51 51 LEU HD11 H 1 0.838 0.005 . 2 . . . . 51 L HD1 . 17199 1
544 . 1 1 51 51 LEU HD12 H 1 0.838 0.005 . 2 . . . . 51 L HD1 . 17199 1
545 . 1 1 51 51 LEU HD13 H 1 0.838 0.005 . 2 . . . . 51 L HD1 . 17199 1
546 . 1 1 51 51 LEU HD21 H 1 0.715 0.009 . 2 . . . . 51 L HD2 . 17199 1
547 . 1 1 51 51 LEU HD22 H 1 0.715 0.009 . 2 . . . . 51 L HD2 . 17199 1
548 . 1 1 51 51 LEU HD23 H 1 0.715 0.009 . 2 . . . . 51 L HD2 . 17199 1
549 . 1 1 51 51 LEU HG H 1 1.724 0.007 . 1 . . . . 51 L HG . 17199 1
550 . 1 1 51 51 LEU C C 13 178.990 0.011 . 1 . . . . 51 L C . 17199 1
551 . 1 1 51 51 LEU CA C 13 56.759 0.085 . 1 . . . . 51 L CA . 17199 1
552 . 1 1 51 51 LEU CB C 13 42.027 0.052 . 1 . . . . 51 L CB . 17199 1
553 . 1 1 51 51 LEU CD1 C 13 25.942 0.042 . 2 . . . . 51 L CD1 . 17199 1
554 . 1 1 51 51 LEU CD2 C 13 23.118 0.046 . 2 . . . . 51 L CD2 . 17199 1
555 . 1 1 51 51 LEU CG C 13 26.687 0.069 . 1 . . . . 51 L CG . 17199 1
556 . 1 1 51 51 LEU N N 15 118.592 0.026 . 1 . . . . 51 L N . 17199 1
557 . 1 1 52 52 SER H H 1 7.849 0.003 . 1 . . . . 52 S H . 17199 1
558 . 1 1 52 52 SER HA H 1 4.365 0.005 . 1 . . . . 52 S HA . 17199 1
559 . 1 1 52 52 SER HB2 H 1 4.057 0.010 . 2 . . . . 52 S HB2 . 17199 1
560 . 1 1 52 52 SER C C 13 175.108 0.021 . 1 . . . . 52 S C . 17199 1
561 . 1 1 52 52 SER CA C 13 60.153 0.070 . 1 . . . . 52 S CA . 17199 1
562 . 1 1 52 52 SER CB C 13 63.391 0.045 . 1 . . . . 52 S CB . 17199 1
563 . 1 1 52 52 SER N N 15 114.795 0.012 . 1 . . . . 52 S N . 17199 1
564 . 1 1 53 53 LYS H H 1 7.480 0.007 . 1 . . . . 53 K H . 17199 1
565 . 1 1 53 53 LYS HA H 1 4.335 0.042 . 1 . . . . 53 K HA . 17199 1
566 . 1 1 53 53 LYS HB2 H 1 1.955 0.025 . 2 . . . . 53 K HB2 . 17199 1
567 . 1 1 53 53 LYS HB3 H 1 1.919 0.003 . 2 . . . . 53 K HB3 . 17199 1
568 . 1 1 53 53 LYS HD2 H 1 1.734 0.005 . 2 . . . . 53 K HD2 . 17199 1
569 . 1 1 53 53 LYS HE2 H 1 3.051 0.007 . 2 . . . . 53 K HE2 . 17199 1
570 . 1 1 53 53 LYS HG2 H 1 1.547 0.007 . 2 . . . . 53 K HG2 . 17199 1
571 . 1 1 53 53 LYS C C 13 176.925 0.015 . 1 . . . . 53 K C . 17199 1
572 . 1 1 53 53 LYS CA C 13 56.810 0.038 . 1 . . . . 53 K CA . 17199 1
573 . 1 1 53 53 LYS CB C 13 32.511 0.054 . 1 . . . . 53 K CB . 17199 1
574 . 1 1 53 53 LYS CD C 13 29.031 0.036 . 1 . . . . 53 K CD . 17199 1
575 . 1 1 53 53 LYS CE C 13 42.227 0.098 . 1 . . . . 53 K CE . 17199 1
576 . 1 1 53 53 LYS CG C 13 24.476 0.029 . 1 . . . . 53 K CG . 17199 1
577 . 1 1 53 53 LYS N N 15 120.343 0.010 . 1 . . . . 53 K N . 17199 1
578 . 1 1 54 54 GLN H H 1 7.996 0.004 . 1 . . . . 54 Q H . 17199 1
579 . 1 1 54 54 GLN HA H 1 4.446 0.005 . 1 . . . . 54 Q HA . 17199 1
580 . 1 1 54 54 GLN HB2 H 1 2.183 0.050 . 2 . . . . 54 Q HB2 . 17199 1
581 . 1 1 54 54 GLN HB3 H 1 2.080 0.009 . 2 . . . . 54 Q HB3 . 17199 1
582 . 1 1 54 54 GLN HG2 H 1 2.440 0.011 . 2 . . . . 54 Q HG2 . 17199 1
583 . 1 1 54 54 GLN C C 13 176.548 0.016 . 1 . . . . 54 Q C . 17199 1
584 . 1 1 54 54 GLN CA C 13 56.160 0.023 . 1 . . . . 54 Q CA . 17199 1
585 . 1 1 54 54 GLN CB C 13 29.334 0.066 . 1 . . . . 54 Q CB . 17199 1
586 . 1 1 54 54 GLN CG C 13 33.949 0.052 . 1 . . . . 54 Q CG . 17199 1
587 . 1 1 54 54 GLN N N 15 119.456 0.034 . 1 . . . . 54 Q N . 17199 1
588 . 1 1 55 55 THR H H 1 8.174 0.002 . 1 . . . . 55 T H . 17199 1
589 . 1 1 55 55 THR HA H 1 4.430 0.017 . 1 . . . . 55 T HA . 17199 1
590 . 1 1 55 55 THR HB H 1 4.321 0.010 . 1 . . . . 55 T HB . 17199 1
591 . 1 1 55 55 THR HG21 H 1 1.240 0.008 . 1 . . . . 55 T HG2 . 17199 1
592 . 1 1 55 55 THR HG22 H 1 1.240 0.008 . 1 . . . . 55 T HG2 . 17199 1
593 . 1 1 55 55 THR HG23 H 1 1.240 0.008 . 1 . . . . 55 T HG2 . 17199 1
594 . 1 1 55 55 THR C C 13 174.952 0.032 . 1 . . . . 55 T C . 17199 1
595 . 1 1 55 55 THR CA C 13 61.943 0.033 . 1 . . . . 55 T CA . 17199 1
596 . 1 1 55 55 THR CB C 13 69.835 0.048 . 1 . . . . 55 T CB . 17199 1
597 . 1 1 55 55 THR CG2 C 13 21.581 0.079 . 1 . . . . 55 T CG2 . 17199 1
598 . 1 1 55 55 THR N N 15 114.183 0.013 . 1 . . . . 55 T N . 17199 1
599 . 1 1 56 56 SER H H 1 8.366 0.006 . 1 . . . . 56 S H . 17199 1
600 . 1 1 56 56 SER HA H 1 4.516 0.007 . 1 . . . . 56 S HA . 17199 1
601 . 1 1 56 56 SER HB2 H 1 3.932 0.008 . 2 . . . . 56 S HB2 . 17199 1
602 . 1 1 56 56 SER C C 13 175.211 0.034 . 1 . . . . 56 S C . 17199 1
603 . 1 1 56 56 SER CA C 13 58.684 0.045 . 1 . . . . 56 S CA . 17199 1
604 . 1 1 56 56 SER CB C 13 63.939 0.043 . 1 . . . . 56 S CB . 17199 1
605 . 1 1 56 56 SER N N 15 117.870 0.013 . 1 . . . . 56 S N . 17199 1
606 . 1 1 57 57 GLY H H 1 8.479 0.003 . 1 . . . . 57 G H . 17199 1
607 . 1 1 57 57 GLY HA2 H 1 4.027 0.009 . 2 . . . . 57 G HA2 . 17199 1
608 . 1 1 57 57 GLY C C 13 174.892 0.000 . 1 . . . . 57 G C . 17199 1
609 . 1 1 57 57 GLY CA C 13 45.453 0.000 . 1 . . . . 57 G CA . 17199 1
610 . 1 1 57 57 GLY N N 15 110.758 0.018 . 1 . . . . 57 G N . 17199 1
611 . 1 1 62 62 SER HA H 1 4.477 0.005 . 1 . . . . 62 S HA . 17199 1
612 . 1 1 62 62 SER HB2 H 1 3.897 0.001 . 2 . . . . 62 S HB2 . 17199 1
613 . 1 1 62 62 SER C C 13 174.841 0.036 . 1 . . . . 62 S C . 17199 1
614 . 1 1 62 62 SER CA C 13 58.451 0.048 . 1 . . . . 62 S CA . 17199 1
615 . 1 1 62 62 SER CB C 13 64.081 0.057 . 1 . . . . 62 S CB . 17199 1
616 . 1 1 63 63 LYS H H 1 8.432 0.002 . 1 . . . . 63 K H . 17199 1
617 . 1 1 63 63 LYS HA H 1 4.362 0.005 . 1 . . . . 63 K HA . 17199 1
618 . 1 1 63 63 LYS HB2 H 1 1.862 0.040 . 2 . . . . 63 K HB2 . 17199 1
619 . 1 1 63 63 LYS HB3 H 1 1.777 0.011 . 2 . . . . 63 K HB3 . 17199 1
620 . 1 1 63 63 LYS HD2 H 1 1.690 0.006 . 2 . . . . 63 K HD2 . 17199 1
621 . 1 1 63 63 LYS HE2 H 1 3.008 0.002 . 2 . . . . 63 K HE2 . 17199 1
622 . 1 1 63 63 LYS HG2 H 1 1.442 0.009 . 2 . . . . 63 K HG2 . 17199 1
623 . 1 1 63 63 LYS C C 13 176.736 0.000 . 1 . . . . 63 K C . 17199 1
624 . 1 1 63 63 LYS CA C 13 56.463 0.045 . 1 . . . . 63 K CA . 17199 1
625 . 1 1 63 63 LYS CB C 13 32.888 0.096 . 1 . . . . 63 K CB . 17199 1
626 . 1 1 63 63 LYS CD C 13 29.078 0.037 . 1 . . . . 63 K CD . 17199 1
627 . 1 1 63 63 LYS CE C 13 42.215 0.011 . 1 . . . . 63 K CE . 17199 1
628 . 1 1 63 63 LYS CG C 13 24.770 0.027 . 1 . . . . 63 K CG . 17199 1
629 . 1 1 63 63 LYS N N 15 123.124 0.030 . 1 . . . . 63 K N . 17199 1
630 . 1 1 64 64 LEU H H 1 8.257 0.007 . 1 . . . . 64 L H . 17199 1
631 . 1 1 64 64 LEU HA H 1 4.349 0.043 . 1 . . . . 64 L HA . 17199 1
632 . 1 1 64 64 LEU HB2 H 1 1.638 0.019 . 2 . . . . 64 L HB2 . 17199 1
633 . 1 1 64 64 LEU HD11 H 1 0.933 0.010 . 2 . . . . 64 L HD1 . 17199 1
634 . 1 1 64 64 LEU HD12 H 1 0.933 0.010 . 2 . . . . 64 L HD1 . 17199 1
635 . 1 1 64 64 LEU HD13 H 1 0.933 0.010 . 2 . . . . 64 L HD1 . 17199 1
636 . 1 1 64 64 LEU HD21 H 1 0.878 0.007 . 2 . . . . 64 L HD2 . 17199 1
637 . 1 1 64 64 LEU HD22 H 1 0.878 0.007 . 2 . . . . 64 L HD2 . 17199 1
638 . 1 1 64 64 LEU HD23 H 1 0.878 0.007 . 2 . . . . 64 L HD2 . 17199 1
639 . 1 1 64 64 LEU HG H 1 1.630 0.027 . 1 . . . . 64 L HG . 17199 1
640 . 1 1 64 64 LEU C C 13 177.915 0.028 . 1 . . . . 64 L C . 17199 1
641 . 1 1 64 64 LEU CA C 13 55.369 0.033 . 1 . . . . 64 L CA . 17199 1
642 . 1 1 64 64 LEU CB C 13 42.271 0.034 . 1 . . . . 64 L CB . 17199 1
643 . 1 1 64 64 LEU CD1 C 13 24.925 0.070 . 2 . . . . 64 L CD1 . 17199 1
644 . 1 1 64 64 LEU CD2 C 13 23.420 0.068 . 2 . . . . 64 L CD2 . 17199 1
645 . 1 1 64 64 LEU CG C 13 27.038 0.041 . 1 . . . . 64 L CG . 17199 1
646 . 1 1 64 64 LEU N N 15 122.630 0.012 . 1 . . . . 64 L N . 17199 1
647 . 1 1 65 65 GLY H H 1 8.415 0.003 . 1 . . . . 65 G H . 17199 1
648 . 1 1 65 65 GLY HA2 H 1 3.991 0.007 . 2 . . . . 65 G HA2 . 17199 1
649 . 1 1 65 65 GLY C C 13 174.800 0.000 . 1 . . . . 65 G C . 17199 1
650 . 1 1 65 65 GLY CA C 13 45.340 0.000 . 1 . . . . 65 G CA . 17199 1
651 . 1 1 65 65 GLY N N 15 109.734 0.005 . 1 . . . . 65 G N . 17199 1
652 . 1 1 71 71 ARG HA H 1 4.349 0.006 . 1 . . . . 71 R HA . 17199 1
653 . 1 1 71 71 ARG HB2 H 1 1.900 0.012 . 2 . . . . 71 R HB2 . 17199 1
654 . 1 1 71 71 ARG HB3 H 1 1.803 0.003 . 2 . . . . 71 R HB3 . 17199 1
655 . 1 1 71 71 ARG HD2 H 1 3.205 0.016 . 2 . . . . 71 R HD2 . 17199 1
656 . 1 1 71 71 ARG HG2 H 1 1.616 0.092 . 2 . . . . 71 R HG2 . 17199 1
657 . 1 1 71 71 ARG C C 13 176.577 0.000 . 1 . . . . 71 R C . 17199 1
658 . 1 1 71 71 ARG CA C 13 56.394 0.074 . 1 . . . . 71 R CA . 17199 1
659 . 1 1 71 71 ARG CB C 13 30.748 0.073 . 1 . . . . 71 R CB . 17199 1
660 . 1 1 71 71 ARG CD C 13 43.301 0.042 . 1 . . . . 71 R CD . 17199 1
661 . 1 1 71 71 ARG CG C 13 27.184 0.061 . 1 . . . . 71 R CG . 17199 1
662 . 1 1 72 72 LYS H H 1 8.362 0.002 . 1 . . . . 72 K H . 17199 1
663 . 1 1 72 72 LYS HA H 1 4.300 0.010 . 1 . . . . 72 K HA . 17199 1
664 . 1 1 72 72 LYS HB2 H 1 1.793 0.007 . 2 . . . . 72 K HB2 . 17199 1
665 . 1 1 72 72 LYS HE2 H 1 2.986 0.000 . 2 . . . . 72 K HE2 . 17199 1
666 . 1 1 72 72 LYS HG2 H 1 1.440 0.005 . 2 . . . . 72 K HG2 . 17199 1
667 . 1 1 72 72 LYS C C 13 176.297 0.000 . 1 . . . . 72 K C . 17199 1
668 . 1 1 72 72 LYS CA C 13 56.730 0.060 . 1 . . . . 72 K CA . 17199 1
669 . 1 1 72 72 LYS CB C 13 32.995 0.022 . 1 . . . . 72 K CB . 17199 1
670 . 1 1 72 72 LYS CE C 13 41.458 0.000 . 1 . . . . 72 K CE . 17199 1
671 . 1 1 72 72 LYS CG C 13 24.758 0.062 . 1 . . . . 72 K CG . 17199 1
672 . 1 1 72 72 LYS N N 15 122.375 0.017 . 1 . . . . 72 K N . 17199 1
673 . 1 1 73 73 ASP H H 1 8.323 0.002 . 1 . . . . 73 D H . 17199 1
674 . 1 1 73 73 ASP HA H 1 4.576 0.007 . 1 . . . . 73 D HA . 17199 1
675 . 1 1 73 73 ASP HB2 H 1 2.672 0.019 . 2 . . . . 73 D HB2 . 17199 1
676 . 1 1 73 73 ASP HB3 H 1 2.637 0.011 . 2 . . . . 73 D HB3 . 17199 1
677 . 1 1 73 73 ASP C C 13 176.148 0.000 . 1 . . . . 73 D C . 17199 1
678 . 1 1 73 73 ASP CA C 13 54.429 0.033 . 1 . . . . 73 D CA . 17199 1
679 . 1 1 73 73 ASP CB C 13 41.226 0.028 . 1 . . . . 73 D CB . 17199 1
680 . 1 1 73 73 ASP N N 15 120.732 0.042 . 1 . . . . 73 D N . 17199 1
681 . 1 1 74 74 LEU H H 1 7.998 0.009 . 1 . . . . 74 L H . 17199 1
682 . 1 1 74 74 LEU HA H 1 4.213 0.008 . 1 . . . . 74 L HA . 17199 1
683 . 1 1 74 74 LEU HB2 H 1 1.464 0.053 . 2 . . . . 74 L HB2 . 17199 1
684 . 1 1 74 74 LEU HB3 H 1 1.361 0.042 . 2 . . . . 74 L HB3 . 17199 1
685 . 1 1 74 74 LEU HD11 H 1 0.793 0.008 . 2 . . . . 74 L HD1 . 17199 1
686 . 1 1 74 74 LEU HD12 H 1 0.793 0.008 . 2 . . . . 74 L HD1 . 17199 1
687 . 1 1 74 74 LEU HD13 H 1 0.793 0.008 . 2 . . . . 74 L HD1 . 17199 1
688 . 1 1 74 74 LEU HD21 H 1 0.749 0.006 . 2 . . . . 74 L HD2 . 17199 1
689 . 1 1 74 74 LEU HD22 H 1 0.749 0.006 . 2 . . . . 74 L HD2 . 17199 1
690 . 1 1 74 74 LEU HD23 H 1 0.749 0.006 . 2 . . . . 74 L HD2 . 17199 1
691 . 1 1 74 74 LEU HG H 1 1.510 0.015 . 1 . . . . 74 L HG . 17199 1
692 . 1 1 74 74 LEU C C 13 177.171 0.034 . 1 . . . . 74 L C . 17199 1
693 . 1 1 74 74 LEU CA C 13 55.320 0.093 . 1 . . . . 74 L CA . 17199 1
694 . 1 1 74 74 LEU CB C 13 42.051 0.035 . 1 . . . . 74 L CB . 17199 1
695 . 1 1 74 74 LEU CD1 C 13 24.895 0.145 . 2 . . . . 74 L CD1 . 17199 1
696 . 1 1 74 74 LEU CD2 C 13 23.772 0.062 . 2 . . . . 74 L CD2 . 17199 1
697 . 1 1 74 74 LEU CG C 13 26.922 0.081 . 1 . . . . 74 L CG . 17199 1
698 . 1 1 74 74 LEU N N 15 122.479 0.019 . 1 . . . . 74 L N . 17199 1
699 . 1 1 75 75 SER H H 1 8.289 0.004 . 1 . . . . 75 S H . 17199 1
700 . 1 1 75 75 SER HA H 1 4.362 0.004 . 1 . . . . 75 S HA . 17199 1
701 . 1 1 75 75 SER HB2 H 1 3.850 0.007 . 2 . . . . 75 S HB2 . 17199 1
702 . 1 1 75 75 SER C C 13 174.837 0.032 . 1 . . . . 75 S C . 17199 1
703 . 1 1 75 75 SER CA C 13 58.608 0.058 . 1 . . . . 75 S CA . 17199 1
704 . 1 1 75 75 SER CB C 13 63.588 0.017 . 1 . . . . 75 S CB . 17199 1
705 . 1 1 75 75 SER N N 15 117.171 0.029 . 1 . . . . 75 S N . 17199 1
706 . 1 1 76 76 VAL H H 1 7.893 0.003 . 1 . . . . 76 V H . 17199 1
707 . 1 1 76 76 VAL HA H 1 3.937 0.006 . 1 . . . . 76 V HA . 17199 1
708 . 1 1 76 76 VAL HB H 1 1.940 0.037 . 1 . . . . 76 V HB . 17199 1
709 . 1 1 76 76 VAL HG11 H 1 0.779 0.008 . 2 . . . . 76 V HG1 . 17199 1
710 . 1 1 76 76 VAL HG12 H 1 0.779 0.008 . 2 . . . . 76 V HG1 . 17199 1
711 . 1 1 76 76 VAL HG13 H 1 0.779 0.008 . 2 . . . . 76 V HG1 . 17199 1
712 . 1 1 76 76 VAL HG21 H 1 0.789 0.012 . 2 . . . . 76 V HG2 . 17199 1
713 . 1 1 76 76 VAL HG22 H 1 0.789 0.012 . 2 . . . . 76 V HG2 . 17199 1
714 . 1 1 76 76 VAL HG23 H 1 0.789 0.012 . 2 . . . . 76 V HG2 . 17199 1
715 . 1 1 76 76 VAL C C 13 176.132 0.011 . 1 . . . . 76 V C . 17199 1
716 . 1 1 76 76 VAL CA C 13 62.545 0.010 . 1 . . . . 76 V CA . 17199 1
717 . 1 1 76 76 VAL CB C 13 32.237 0.071 . 1 . . . . 76 V CB . 17199 1
718 . 1 1 76 76 VAL CG1 C 13 21.032 0.048 . 2 . . . . 76 V CG1 . 17199 1
719 . 1 1 76 76 VAL CG2 C 13 20.545 0.047 . 2 . . . . 76 V CG2 . 17199 1
720 . 1 1 76 76 VAL N N 15 121.108 0.013 . 1 . . . . 76 V N . 17199 1
721 . 1 1 77 77 LYS H H 1 8.043 0.005 . 1 . . . . 77 K H . 17199 1
722 . 1 1 77 77 LYS HA H 1 4.170 0.004 . 1 . . . . 77 K HA . 17199 1
723 . 1 1 77 77 LYS HB2 H 1 1.740 0.011 . 2 . . . . 77 K HB2 . 17199 1
724 . 1 1 77 77 LYS HG2 H 1 1.394 0.022 . 2 . . . . 77 K HG2 . 17199 1
725 . 1 1 77 77 LYS C C 13 177.062 0.000 . 1 . . . . 77 K C . 17199 1
726 . 1 1 77 77 LYS CA C 13 57.138 0.030 . 1 . . . . 77 K CA . 17199 1
727 . 1 1 77 77 LYS CB C 13 32.968 0.026 . 1 . . . . 77 K CB . 17199 1
728 . 1 1 77 77 LYS CD C 13 29.023 0.012 . 1 . . . . 77 K CD . 17199 1
729 . 1 1 77 77 LYS CG C 13 24.898 0.040 . 1 . . . . 77 K CG . 17199 1
730 . 1 1 77 77 LYS N N 15 122.824 0.018 . 1 . . . . 77 K N . 17199 1
731 . 1 1 78 78 GLY H H 1 8.333 0.007 . 1 . . . . 78 G H . 17199 1
732 . 1 1 78 78 GLY HA2 H 1 3.964 0.083 . 2 . . . . 78 G HA2 . 17199 1
733 . 1 1 78 78 GLY HA3 H 1 3.824 0.006 . 2 . . . . 78 G HA3 . 17199 1
734 . 1 1 78 78 GLY C C 13 174.598 0.000 . 1 . . . . 78 G C . 17199 1
735 . 1 1 78 78 GLY CA C 13 45.729 0.030 . 1 . . . . 78 G CA . 17199 1
736 . 1 1 78 78 GLY N N 15 108.832 0.018 . 1 . . . . 78 G N . 17199 1
737 . 1 1 79 79 MET H H 1 8.065 0.005 . 1 . . . . 79 M H . 17199 1
738 . 1 1 79 79 MET HA H 1 4.325 0.054 . 1 . . . . 79 M HA . 17199 1
739 . 1 1 79 79 MET HB2 H 1 1.985 0.031 . 2 . . . . 79 M HB2 . 17199 1
740 . 1 1 79 79 MET HG2 H 1 2.503 0.019 . 2 . . . . 79 M HG2 . 17199 1
741 . 1 1 79 79 MET HG3 H 1 2.468 0.011 . 2 . . . . 79 M HG3 . 17199 1
742 . 1 1 79 79 MET C C 13 176.761 0.000 . 1 . . . . 79 M C . 17199 1
743 . 1 1 79 79 MET CA C 13 56.713 0.059 . 1 . . . . 79 M CA . 17199 1
744 . 1 1 79 79 MET CB C 13 32.702 0.089 . 1 . . . . 79 M CB . 17199 1
745 . 1 1 79 79 MET CG C 13 32.221 0.084 . 1 . . . . 79 M CG . 17199 1
746 . 1 1 79 79 MET N N 15 119.081 0.014 . 1 . . . . 79 M N . 17199 1
747 . 1 1 80 80 LEU H H 1 7.970 0.004 . 1 . . . . 80 L H . 17199 1
748 . 1 1 80 80 LEU HA H 1 4.190 0.005 . 1 . . . . 80 L HA . 17199 1
749 . 1 1 80 80 LEU HB2 H 1 1.318 0.007 . 2 . . . . 80 L HB2 . 17199 1
750 . 1 1 80 80 LEU HD11 H 1 0.752 0.001 . 2 . . . . 80 L HD1 . 17199 1
751 . 1 1 80 80 LEU HD12 H 1 0.752 0.001 . 2 . . . . 80 L HD1 . 17199 1
752 . 1 1 80 80 LEU HD13 H 1 0.752 0.001 . 2 . . . . 80 L HD1 . 17199 1
753 . 1 1 80 80 LEU HG H 1 1.509 0.005 . 1 . . . . 80 L HG . 17199 1
754 . 1 1 80 80 LEU C C 13 177.150 0.013 . 1 . . . . 80 L C . 17199 1
755 . 1 1 80 80 LEU CA C 13 55.955 0.084 . 1 . . . . 80 L CA . 17199 1
756 . 1 1 80 80 LEU CB C 13 42.051 0.029 . 1 . . . . 80 L CB . 17199 1
757 . 1 1 80 80 LEU CD1 C 13 23.729 0.000 . 2 . . . . 80 L CD1 . 17199 1
758 . 1 1 80 80 LEU CG C 13 25.279 0.000 . 1 . . . . 80 L CG . 17199 1
759 . 1 1 80 80 LEU N N 15 120.081 0.081 . 1 . . . . 80 L N . 17199 1
760 . 1 1 81 81 TYR H H 1 7.893 0.004 . 1 . . . . 81 Y H . 17199 1
761 . 1 1 81 81 TYR HA H 1 4.549 0.009 . 1 . . . . 81 Y HA . 17199 1
762 . 1 1 81 81 TYR HB2 H 1 3.121 0.101 . 2 . . . . 81 Y HB2 . 17199 1
763 . 1 1 81 81 TYR HB3 H 1 2.878 0.007 . 2 . . . . 81 Y HB3 . 17199 1
764 . 1 1 81 81 TYR C C 13 176.339 0.000 . 1 . . . . 81 Y C . 17199 1
765 . 1 1 81 81 TYR CA C 13 57.865 0.036 . 1 . . . . 81 Y CA . 17199 1
766 . 1 1 81 81 TYR CB C 13 38.508 0.047 . 1 . . . . 81 Y CB . 17199 1
767 . 1 1 81 81 TYR N N 15 116.958 0.027 . 1 . . . . 81 Y N . 17199 1
768 . 1 1 82 82 ASP H H 1 8.176 0.013 . 1 . . . . 82 D H . 17199 1
769 . 1 1 82 82 ASP HA H 1 4.697 0.005 . 1 . . . . 82 D HA . 17199 1
770 . 1 1 82 82 ASP HB2 H 1 2.796 0.039 . 2 . . . . 82 D HB2 . 17199 1
771 . 1 1 82 82 ASP HB3 H 1 2.717 0.003 . 2 . . . . 82 D HB3 . 17199 1
772 . 1 1 82 82 ASP C C 13 177.523 0.000 . 1 . . . . 82 D C . 17199 1
773 . 1 1 82 82 ASP CA C 13 55.791 0.039 . 1 . . . . 82 D CA . 17199 1
774 . 1 1 82 82 ASP CB C 13 41.570 0.052 . 1 . . . . 82 D CB . 17199 1
775 . 1 1 82 82 ASP N N 15 119.746 0.013 . 1 . . . . 82 D N . 17199 1
776 . 1 1 83 83 SER H H 1 8.188 0.013 . 1 . . . . 83 S H . 17199 1
777 . 1 1 83 83 SER HA H 1 4.474 0.007 . 1 . . . . 83 S HA . 17199 1
778 . 1 1 83 83 SER HB2 H 1 3.926 0.013 . 2 . . . . 83 S HB2 . 17199 1
779 . 1 1 83 83 SER C C 13 174.486 0.000 . 1 . . . . 83 S C . 17199 1
780 . 1 1 83 83 SER CA C 13 60.021 0.141 . 1 . . . . 83 S CA . 17199 1
781 . 1 1 83 83 SER CB C 13 63.876 0.069 . 1 . . . . 83 S CB . 17199 1
782 . 1 1 83 83 SER N N 15 115.423 0.022 . 1 . . . . 83 S N . 17199 1
783 . 1 1 84 84 ASP H H 1 8.293 0.010 . 1 . . . . 84 D H . 17199 1
784 . 1 1 84 84 ASP HA H 1 4.923 0.005 . 1 . . . . 84 D HA . 17199 1
785 . 1 1 84 84 ASP HB2 H 1 2.886 0.005 . 2 . . . . 84 D HB2 . 17199 1
786 . 1 1 84 84 ASP HB3 H 1 2.742 0.003 . 2 . . . . 84 D HB3 . 17199 1
787 . 1 1 84 84 ASP C C 13 176.702 0.000 . 1 . . . . 84 D C . 17199 1
788 . 1 1 84 84 ASP CA C 13 54.444 0.069 . 1 . . . . 84 D CA . 17199 1
789 . 1 1 84 84 ASP CB C 13 41.688 0.050 . 1 . . . . 84 D CB . 17199 1
790 . 1 1 84 84 ASP N N 15 121.488 0.022 . 1 . . . . 84 D N . 17199 1
791 . 1 1 85 85 SER H H 1 8.197 0.008 . 1 . . . . 85 S H . 17199 1
792 . 1 1 85 85 SER HA H 1 4.149 0.010 . 1 . . . . 85 S HA . 17199 1
793 . 1 1 85 85 SER HB2 H 1 4.171 0.012 . 2 . . . . 85 S HB2 . 17199 1
794 . 1 1 85 85 SER C C 13 175.573 0.000 . 1 . . . . 85 S C . 17199 1
795 . 1 1 85 85 SER CA C 13 61.747 0.064 . 1 . . . . 85 S CA . 17199 1
796 . 1 1 85 85 SER CB C 13 63.831 0.021 . 1 . . . . 85 S CB . 17199 1
797 . 1 1 85 85 SER N N 15 116.889 0.019 . 1 . . . . 85 S N . 17199 1
798 . 1 1 86 86 GLN H H 1 8.627 0.004 . 1 . . . . 86 Q H . 17199 1
799 . 1 1 86 86 GLN HA H 1 4.154 0.007 . 1 . . . . 86 Q HA . 17199 1
800 . 1 1 86 86 GLN HB2 H 1 2.151 0.006 . 2 . . . . 86 Q HB2 . 17199 1
801 . 1 1 86 86 GLN HG2 H 1 2.424 0.005 . 2 . . . . 86 Q HG2 . 17199 1
802 . 1 1 86 86 GLN C C 13 177.707 0.026 . 1 . . . . 86 Q C . 17199 1
803 . 1 1 86 86 GLN CA C 13 58.373 0.044 . 1 . . . . 86 Q CA . 17199 1
804 . 1 1 86 86 GLN CB C 13 28.475 0.067 . 1 . . . . 86 Q CB . 17199 1
805 . 1 1 86 86 GLN CG C 13 34.108 0.037 . 1 . . . . 86 Q CG . 17199 1
806 . 1 1 86 86 GLN N N 15 121.031 0.016 . 1 . . . . 86 Q N . 17199 1
807 . 1 1 87 87 GLN H H 1 8.208 0.009 . 1 . . . . 87 Q H . 17199 1
808 . 1 1 87 87 GLN HA H 1 4.111 0.101 . 1 . . . . 87 Q HA . 17199 1
809 . 1 1 87 87 GLN HB2 H 1 2.137 0.006 . 2 . . . . 87 Q HB2 . 17199 1
810 . 1 1 87 87 GLN C C 13 179.670 0.008 . 1 . . . . 87 Q C . 17199 1
811 . 1 1 87 87 GLN CA C 13 59.486 0.032 . 1 . . . . 87 Q CA . 17199 1
812 . 1 1 87 87 GLN CB C 13 28.722 0.018 . 1 . . . . 87 Q CB . 17199 1
813 . 1 1 87 87 GLN CG C 13 34.725 0.023 . 1 . . . . 87 Q CG . 17199 1
814 . 1 1 87 87 GLN N N 15 118.473 0.013 . 1 . . . . 87 Q N . 17199 1
815 . 1 1 88 88 ILE H H 1 8.169 0.003 . 1 . . . . 88 I H . 17199 1
816 . 1 1 88 88 ILE HA H 1 3.518 0.005 . 1 . . . . 88 I HA . 17199 1
817 . 1 1 88 88 ILE HB H 1 1.894 0.005 . 1 . . . . 88 I HB . 17199 1
818 . 1 1 88 88 ILE HD11 H 1 0.852 0.008 . 1 . . . . 88 I HD1 . 17199 1
819 . 1 1 88 88 ILE HD12 H 1 0.852 0.008 . 1 . . . . 88 I HD1 . 17199 1
820 . 1 1 88 88 ILE HD13 H 1 0.852 0.008 . 1 . . . . 88 I HD1 . 17199 1
821 . 1 1 88 88 ILE HG12 H 1 1.003 0.006 . 2 . . . . 88 I HG12 . 17199 1
822 . 1 1 88 88 ILE HG21 H 1 0.727 0.005 . 1 . . . . 88 I HG2 . 17199 1
823 . 1 1 88 88 ILE HG22 H 1 0.727 0.005 . 1 . . . . 88 I HG2 . 17199 1
824 . 1 1 88 88 ILE HG23 H 1 0.727 0.005 . 1 . . . . 88 I HG2 . 17199 1
825 . 1 1 88 88 ILE C C 13 176.697 0.000 . 1 . . . . 88 I C . 17199 1
826 . 1 1 88 88 ILE CA C 13 65.712 0.025 . 1 . . . . 88 I CA . 17199 1
827 . 1 1 88 88 ILE CB C 13 37.268 0.054 . 1 . . . . 88 I CB . 17199 1
828 . 1 1 88 88 ILE CD1 C 13 13.318 0.094 . 1 . . . . 88 I CD1 . 17199 1
829 . 1 1 88 88 ILE CG1 C 13 30.037 0.037 . 1 . . . . 88 I CG1 . 17199 1
830 . 1 1 88 88 ILE CG2 C 13 17.174 0.022 . 1 . . . . 88 I CG2 . 17199 1
831 . 1 1 88 88 ILE N N 15 119.834 0.023 . 1 . . . . 88 I N . 17199 1
832 . 1 1 89 89 LEU H H 1 8.260 0.005 . 1 . . . . 89 L H . 17199 1
833 . 1 1 89 89 LEU HA H 1 3.718 0.007 . 1 . . . . 89 L HA . 17199 1
834 . 1 1 89 89 LEU HB2 H 1 1.880 0.005 . 2 . . . . 89 L HB2 . 17199 1
835 . 1 1 89 89 LEU HB3 H 1 1.359 0.007 . 2 . . . . 89 L HB3 . 17199 1
836 . 1 1 89 89 LEU HD11 H 1 0.835 0.004 . 2 . . . . 89 L HD1 . 17199 1
837 . 1 1 89 89 LEU HD12 H 1 0.835 0.004 . 2 . . . . 89 L HD1 . 17199 1
838 . 1 1 89 89 LEU HD13 H 1 0.835 0.004 . 2 . . . . 89 L HD1 . 17199 1
839 . 1 1 89 89 LEU HD21 H 1 0.750 0.010 . 2 . . . . 89 L HD2 . 17199 1
840 . 1 1 89 89 LEU HD22 H 1 0.750 0.010 . 2 . . . . 89 L HD2 . 17199 1
841 . 1 1 89 89 LEU HD23 H 1 0.750 0.010 . 2 . . . . 89 L HD2 . 17199 1
842 . 1 1 89 89 LEU HG H 1 1.356 0.011 . 1 . . . . 89 L HG . 17199 1
843 . 1 1 89 89 LEU C C 13 177.814 0.012 . 1 . . . . 89 L C . 17199 1
844 . 1 1 89 89 LEU CA C 13 58.613 0.021 . 1 . . . . 89 L CA . 17199 1
845 . 1 1 89 89 LEU CB C 13 41.902 0.043 . 1 . . . . 89 L CB . 17199 1
846 . 1 1 89 89 LEU CD1 C 13 25.920 0.049 . 2 . . . . 89 L CD1 . 17199 1
847 . 1 1 89 89 LEU CD2 C 13 23.435 0.047 . 2 . . . . 89 L CD2 . 17199 1
848 . 1 1 89 89 LEU CG C 13 27.143 0.045 . 1 . . . . 89 L CG . 17199 1
849 . 1 1 89 89 LEU N N 15 120.868 0.029 . 1 . . . . 89 L N . 17199 1
850 . 1 1 90 90 ASN H H 1 8.415 0.003 . 1 . . . . 90 N H . 17199 1
851 . 1 1 90 90 ASN HA H 1 4.313 0.006 . 1 . . . . 90 N HA . 17199 1
852 . 1 1 90 90 ASN HB2 H 1 2.832 0.004 . 2 . . . . 90 N HB2 . 17199 1
853 . 1 1 90 90 ASN C C 13 178.182 0.035 . 1 . . . . 90 N C . 17199 1
854 . 1 1 90 90 ASN CA C 13 56.157 0.051 . 1 . . . . 90 N CA . 17199 1
855 . 1 1 90 90 ASN CB C 13 37.839 0.041 . 1 . . . . 90 N CB . 17199 1
856 . 1 1 90 90 ASN N N 15 115.515 0.016 . 1 . . . . 90 N N . 17199 1
857 . 1 1 91 91 ARG H H 1 7.935 0.005 . 1 . . . . 91 R H . 17199 1
858 . 1 1 91 91 ARG HA H 1 4.231 0.007 . 1 . . . . 91 R HA . 17199 1
859 . 1 1 91 91 ARG HB2 H 1 1.940 0.008 . 2 . . . . 91 R HB2 . 17199 1
860 . 1 1 91 91 ARG HD2 H 1 3.583 0.007 . 2 . . . . 91 R HD2 . 17199 1
861 . 1 1 91 91 ARG HD3 H 1 2.699 0.005 . 2 . . . . 91 R HD3 . 17199 1
862 . 1 1 91 91 ARG HG2 H 1 1.812 0.007 . 2 . . . . 91 R HG2 . 17199 1
863 . 1 1 91 91 ARG HG3 H 1 1.292 0.007 . 2 . . . . 91 R HG3 . 17199 1
864 . 1 1 91 91 ARG C C 13 178.267 0.008 . 1 . . . . 91 R C . 17199 1
865 . 1 1 91 91 ARG CA C 13 56.932 0.037 . 1 . . . . 91 R CA . 17199 1
866 . 1 1 91 91 ARG CB C 13 29.705 0.045 . 1 . . . . 91 R CB . 17199 1
867 . 1 1 91 91 ARG CD C 13 42.573 0.027 . 1 . . . . 91 R CD . 17199 1
868 . 1 1 91 91 ARG CG C 13 26.306 0.035 . 1 . . . . 91 R CG . 17199 1
869 . 1 1 91 91 ARG N N 15 120.157 0.018 . 1 . . . . 91 R N . 17199 1
870 . 1 1 92 92 LEU H H 1 8.855 0.006 . 1 . . . . 92 L H . 17199 1
871 . 1 1 92 92 LEU HA H 1 3.900 0.005 . 1 . . . . 92 L HA . 17199 1
872 . 1 1 92 92 LEU HB2 H 1 1.823 0.010 . 2 . . . . 92 L HB2 . 17199 1
873 . 1 1 92 92 LEU HB3 H 1 1.476 0.006 . 2 . . . . 92 L HB3 . 17199 1
874 . 1 1 92 92 LEU HD11 H 1 0.623 0.006 . 2 . . . . 92 L HD1 . 17199 1
875 . 1 1 92 92 LEU HD12 H 1 0.623 0.006 . 2 . . . . 92 L HD1 . 17199 1
876 . 1 1 92 92 LEU HD13 H 1 0.623 0.006 . 2 . . . . 92 L HD1 . 17199 1
877 . 1 1 92 92 LEU HD21 H 1 0.326 0.004 . 2 . . . . 92 L HD2 . 17199 1
878 . 1 1 92 92 LEU HD22 H 1 0.326 0.004 . 2 . . . . 92 L HD2 . 17199 1
879 . 1 1 92 92 LEU HD23 H 1 0.326 0.004 . 2 . . . . 92 L HD2 . 17199 1
880 . 1 1 92 92 LEU HG H 1 1.556 0.012 . 1 . . . . 92 L HG . 17199 1
881 . 1 1 92 92 LEU C C 13 178.336 0.045 . 1 . . . . 92 L C . 17199 1
882 . 1 1 92 92 LEU CA C 13 58.325 0.037 . 1 . . . . 92 L CA . 17199 1
883 . 1 1 92 92 LEU CB C 13 43.463 0.029 . 1 . . . . 92 L CB . 17199 1
884 . 1 1 92 92 LEU CD1 C 13 23.946 0.029 . 2 . . . . 92 L CD1 . 17199 1
885 . 1 1 92 92 LEU CD2 C 13 24.358 0.049 . 2 . . . . 92 L CD2 . 17199 1
886 . 1 1 92 92 LEU CG C 13 26.779 0.096 . 1 . . . . 92 L CG . 17199 1
887 . 1 1 92 92 LEU N N 15 121.922 0.014 . 1 . . . . 92 L N . 17199 1
888 . 1 1 93 93 ARG H H 1 8.087 0.005 . 1 . . . . 93 R H . 17199 1
889 . 1 1 93 93 ARG HA H 1 3.881 0.008 . 1 . . . . 93 R HA . 17199 1
890 . 1 1 93 93 ARG HB2 H 1 1.894 0.006 . 2 . . . . 93 R HB2 . 17199 1
891 . 1 1 93 93 ARG HD2 H 1 3.106 0.004 . 2 . . . . 93 R HD2 . 17199 1
892 . 1 1 93 93 ARG HG2 H 1 1.869 0.009 . 2 . . . . 93 R HG2 . 17199 1
893 . 1 1 93 93 ARG HG3 H 1 1.621 0.007 . 2 . . . . 93 R HG3 . 17199 1
894 . 1 1 93 93 ARG C C 13 179.377 0.006 . 1 . . . . 93 R C . 17199 1
895 . 1 1 93 93 ARG CA C 13 60.321 0.043 . 1 . . . . 93 R CA . 17199 1
896 . 1 1 93 93 ARG CB C 13 30.068 0.059 . 1 . . . . 93 R CB . 17199 1
897 . 1 1 93 93 ARG CD C 13 43.970 0.050 . 1 . . . . 93 R CD . 17199 1
898 . 1 1 93 93 ARG CG C 13 28.831 0.042 . 1 . . . . 93 R CG . 17199 1
899 . 1 1 93 93 ARG N N 15 116.660 0.016 . 1 . . . . 93 R N . 17199 1
900 . 1 1 94 94 GLU H H 1 7.557 0.005 . 1 . . . . 94 E H . 17199 1
901 . 1 1 94 94 GLU HA H 1 4.035 0.010 . 1 . . . . 94 E HA . 17199 1
902 . 1 1 94 94 GLU HB2 H 1 2.235 0.102 . 2 . . . . 94 E HB2 . 17199 1
903 . 1 1 94 94 GLU HB3 H 1 2.053 0.008 . 2 . . . . 94 E HB3 . 17199 1
904 . 1 1 94 94 GLU HG2 H 1 2.438 0.103 . 2 . . . . 94 E HG2 . 17199 1
905 . 1 1 94 94 GLU HG3 H 1 2.269 0.035 . 2 . . . . 94 E HG3 . 17199 1
906 . 1 1 94 94 GLU C C 13 179.760 0.035 . 1 . . . . 94 E C . 17199 1
907 . 1 1 94 94 GLU CA C 13 59.256 0.033 . 1 . . . . 94 E CA . 17199 1
908 . 1 1 94 94 GLU CB C 13 30.505 0.038 . 1 . . . . 94 E CB . 17199 1
909 . 1 1 94 94 GLU CG C 13 36.359 0.089 . 1 . . . . 94 E CG . 17199 1
910 . 1 1 94 94 GLU N N 15 119.349 0.012 . 1 . . . . 94 E N . 17199 1
911 . 1 1 95 95 ARG H H 1 8.510 0.002 . 1 . . . . 95 R H . 17199 1
912 . 1 1 95 95 ARG HA H 1 3.996 0.016 . 1 . . . . 95 R HA . 17199 1
913 . 1 1 95 95 ARG HB2 H 1 2.274 0.005 . 2 . . . . 95 R HB2 . 17199 1
914 . 1 1 95 95 ARG HB3 H 1 1.760 0.006 . 2 . . . . 95 R HB3 . 17199 1
915 . 1 1 95 95 ARG HD2 H 1 3.656 0.005 . 2 . . . . 95 R HD2 . 17199 1
916 . 1 1 95 95 ARG HD3 H 1 2.769 0.005 . 2 . . . . 95 R HD3 . 17199 1
917 . 1 1 95 95 ARG HG2 H 1 1.737 0.047 . 2 . . . . 95 R HG2 . 17199 1
918 . 1 1 95 95 ARG C C 13 178.972 0.013 . 1 . . . . 95 R C . 17199 1
919 . 1 1 95 95 ARG CA C 13 59.558 0.038 . 1 . . . . 95 R CA . 17199 1
920 . 1 1 95 95 ARG CB C 13 30.982 0.045 . 1 . . . . 95 R CB . 17199 1
921 . 1 1 95 95 ARG CD C 13 44.520 0.028 . 1 . . . . 95 R CD . 17199 1
922 . 1 1 95 95 ARG CG C 13 27.800 0.072 . 1 . . . . 95 R CG . 17199 1
923 . 1 1 95 95 ARG N N 15 119.810 0.021 . 1 . . . . 95 R N . 17199 1
924 . 1 1 96 96 VAL H H 1 8.258 0.005 . 1 . . . . 96 V H . 17199 1
925 . 1 1 96 96 VAL HA H 1 3.931 0.008 . 1 . . . . 96 V HA . 17199 1
926 . 1 1 96 96 VAL HB H 1 2.110 0.007 . 1 . . . . 96 V HB . 17199 1
927 . 1 1 96 96 VAL HG11 H 1 0.974 0.008 . 2 . . . . 96 V HG1 . 17199 1
928 . 1 1 96 96 VAL HG12 H 1 0.974 0.008 . 2 . . . . 96 V HG1 . 17199 1
929 . 1 1 96 96 VAL HG13 H 1 0.974 0.008 . 2 . . . . 96 V HG1 . 17199 1
930 . 1 1 96 96 VAL HG21 H 1 0.936 0.063 . 2 . . . . 96 V HG2 . 17199 1
931 . 1 1 96 96 VAL HG22 H 1 0.936 0.063 . 2 . . . . 96 V HG2 . 17199 1
932 . 1 1 96 96 VAL HG23 H 1 0.936 0.063 . 2 . . . . 96 V HG2 . 17199 1
933 . 1 1 96 96 VAL C C 13 177.877 0.033 . 1 . . . . 96 V C . 17199 1
934 . 1 1 96 96 VAL CA C 13 65.061 0.038 . 1 . . . . 96 V CA . 17199 1
935 . 1 1 96 96 VAL CB C 13 31.855 0.059 . 1 . . . . 96 V CB . 17199 1
936 . 1 1 96 96 VAL CG1 C 13 22.707 0.036 . 2 . . . . 96 V CG1 . 17199 1
937 . 1 1 96 96 VAL CG2 C 13 21.243 0.039 . 2 . . . . 96 V CG2 . 17199 1
938 . 1 1 96 96 VAL N N 15 117.252 0.025 . 1 . . . . 96 V N . 17199 1
939 . 1 1 97 97 SER H H 1 7.978 0.003 . 1 . . . . 97 S H . 17199 1
940 . 1 1 97 97 SER HA H 1 4.405 0.011 . 1 . . . . 97 S HA . 17199 1
941 . 1 1 97 97 SER HB2 H 1 4.005 0.008 . 2 . . . . 97 S HB2 . 17199 1
942 . 1 1 97 97 SER C C 13 175.674 0.009 . 1 . . . . 97 S C . 17199 1
943 . 1 1 97 97 SER CA C 13 60.069 0.050 . 1 . . . . 97 S CA . 17199 1
944 . 1 1 97 97 SER CB C 13 63.796 0.034 . 1 . . . . 97 S CB . 17199 1
945 . 1 1 97 97 SER N N 15 115.163 0.009 . 1 . . . . 97 S N . 17199 1
946 . 1 1 98 98 GLY H H 1 7.963 0.003 . 1 . . . . 98 G H . 17199 1
947 . 1 1 98 98 GLY HA2 H 1 4.059 0.009 . 2 . . . . 98 G HA2 . 17199 1
948 . 1 1 98 98 GLY C C 13 174.559 0.005 . 1 . . . . 98 G C . 17199 1
949 . 1 1 98 98 GLY CA C 13 45.803 0.036 . 1 . . . . 98 G CA . 17199 1
950 . 1 1 98 98 GLY N N 15 109.579 0.009 . 1 . . . . 98 G N . 17199 1
951 . 1 1 99 99 SER H H 1 8.094 0.025 . 1 . . . . 99 S H . 17199 1
952 . 1 1 99 99 SER HA H 1 4.561 0.005 . 1 . . . . 99 S HA . 17199 1
953 . 1 1 99 99 SER HB2 H 1 3.928 0.003 . 2 . . . . 99 S HB2 . 17199 1
954 . 1 1 99 99 SER C C 13 174.925 0.047 . 1 . . . . 99 S C . 17199 1
955 . 1 1 99 99 SER CA C 13 58.628 0.031 . 1 . . . . 99 S CA . 17199 1
956 . 1 1 99 99 SER CB C 13 63.929 0.045 . 1 . . . . 99 S CB . 17199 1
957 . 1 1 99 99 SER N N 15 115.449 0.009 . 1 . . . . 99 S N . 17199 1
958 . 1 1 100 100 THR H H 1 8.168 0.004 . 1 . . . . 100 T H . 17199 1
959 . 1 1 100 100 THR HA H 1 4.352 0.084 . 1 . . . . 100 T HA . 17199 1
960 . 1 1 100 100 THR HB H 1 4.311 0.008 . 1 . . . . 100 T HB . 17199 1
961 . 1 1 100 100 THR HG21 H 1 1.236 0.007 . 1 . . . . 100 T HG2 . 17199 1
962 . 1 1 100 100 THR HG22 H 1 1.236 0.007 . 1 . . . . 100 T HG2 . 17199 1
963 . 1 1 100 100 THR HG23 H 1 1.236 0.007 . 1 . . . . 100 T HG2 . 17199 1
964 . 1 1 100 100 THR C C 13 174.541 0.009 . 1 . . . . 100 T C . 17199 1
965 . 1 1 100 100 THR CA C 13 61.915 0.034 . 1 . . . . 100 T CA . 17199 1
966 . 1 1 100 100 THR CB C 13 69.786 0.040 . 1 . . . . 100 T CB . 17199 1
967 . 1 1 100 100 THR CG2 C 13 21.573 0.072 . 1 . . . . 100 T CG2 . 17199 1
968 . 1 1 100 100 THR N N 15 115.478 0.009 . 1 . . . . 100 T N . 17199 1
969 . 1 1 101 101 ALA H H 1 8.280 0.004 . 1 . . . . 101 A H . 17199 1
970 . 1 1 101 101 ALA HA H 1 4.345 0.005 . 1 . . . . 101 A HA . 17199 1
971 . 1 1 101 101 ALA HB1 H 1 1.417 0.004 . 1 . . . . 101 A HB . 17199 1
972 . 1 1 101 101 ALA HB2 H 1 1.417 0.004 . 1 . . . . 101 A HB . 17199 1
973 . 1 1 101 101 ALA HB3 H 1 1.417 0.004 . 1 . . . . 101 A HB . 17199 1
974 . 1 1 101 101 ALA C C 13 177.704 0.009 . 1 . . . . 101 A C . 17199 1
975 . 1 1 101 101 ALA CA C 13 52.725 0.037 . 1 . . . . 101 A CA . 17199 1
976 . 1 1 101 101 ALA CB C 13 19.209 0.015 . 1 . . . . 101 A CB . 17199 1
977 . 1 1 101 101 ALA N N 15 126.355 0.011 . 1 . . . . 101 A N . 17199 1
978 . 1 1 102 102 GLN H H 1 8.437 0.061 . 1 . . . . 102 Q H . 17199 1
979 . 1 1 102 102 GLN HA H 1 4.384 0.004 . 1 . . . . 102 Q HA . 17199 1
980 . 1 1 102 102 GLN HB2 H 1 2.158 0.004 . 2 . . . . 102 Q HB2 . 17199 1
981 . 1 1 102 102 GLN HB3 H 1 2.016 0.003 . 2 . . . . 102 Q HB3 . 17199 1
982 . 1 1 102 102 GLN HG2 H 1 2.412 0.003 . 2 . . . . 102 Q HG2 . 17199 1
983 . 1 1 102 102 GLN C C 13 176.019 0.019 . 1 . . . . 102 Q C . 17199 1
984 . 1 1 102 102 GLN CA C 13 55.884 0.038 . 1 . . . . 102 Q CA . 17199 1
985 . 1 1 102 102 GLN CB C 13 29.578 0.040 . 1 . . . . 102 Q CB . 17199 1
986 . 1 1 102 102 GLN CG C 13 33.877 0.047 . 1 . . . . 102 Q CG . 17199 1
987 . 1 1 102 102 GLN N N 15 119.750 0.009 . 1 . . . . 102 Q N . 17199 1
988 . 1 1 103 103 SER H H 1 8.336 0.002 . 1 . . . . 103 S H . 17199 1
989 . 1 1 103 103 SER HA H 1 4.462 0.007 . 1 . . . . 103 S HA . 17199 1
990 . 1 1 103 103 SER HB2 H 1 3.889 0.004 . 2 . . . . 103 S HB2 . 17199 1
991 . 1 1 103 103 SER C C 13 173.243 0.018 . 1 . . . . 103 S C . 17199 1
992 . 1 1 103 103 SER CA C 13 58.425 0.045 . 1 . . . . 103 S CA . 17199 1
993 . 1 1 103 103 SER CB C 13 64.162 0.026 . 1 . . . . 103 S CB . 17199 1
994 . 1 1 103 103 SER N N 15 117.722 0.027 . 1 . . . . 103 S N . 17199 1
995 . 1 1 104 104 ALA H H 1 8.054 0.001 . 1 . . . . 104 A H . 17199 1
996 . 1 1 104 104 ALA HA H 1 4.170 0.003 . 1 . . . . 104 A HA . 17199 1
997 . 1 1 104 104 ALA HB1 H 1 1.362 0.002 . 1 . . . . 104 A HB . 17199 1
998 . 1 1 104 104 ALA HB2 H 1 1.362 0.002 . 1 . . . . 104 A HB . 17199 1
999 . 1 1 104 104 ALA HB3 H 1 1.362 0.002 . 1 . . . . 104 A HB . 17199 1
1000 . 1 1 104 104 ALA C C 13 182.546 0.000 . 1 . . . . 104 A C . 17199 1
1001 . 1 1 104 104 ALA CA C 13 53.984 0.022 . 1 . . . . 104 A CA . 17199 1
1002 . 1 1 104 104 ALA CB C 13 20.187 0.015 . 1 . . . . 104 A CB . 17199 1
1003 . 1 1 104 104 ALA N N 15 131.639 0.004 . 1 . . . . 104 A N . 17199 1
stop_
save_