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 15246
_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 0.006
_Assigned_chem_shift_list.Chem_shift_13C_err 0.25
_Assigned_chem_shift_list.Chem_shift_15N_err 0.20
_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' . . . 15246 1
2 '2D 1H-13C HSQC' . . . 15246 1
3 '3D HNCACB' . . . 15246 1
4 '3D CBCA(CO)NH' . . . 15246 1
5 '3D C(CO)NH' . . . 15246 1
6 '3D HNCO' . . . 15246 1
7 '3D HNHA' . . . 15246 1
8 '3D H(CCO)NH' . . . 15246 1
9 '3D HCCH-TOCSY' . . . 15246 1
10 '3D 1H-15N NOESY' . . . 15246 1
11 '3D 1H-13C NOESY' . . . 15246 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 $NMRView . . 15246 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 23 23 MET HA H 1 4.564 0.006 . 1 . . . . 1 M HA . 15246 1
2 . 1 1 23 23 MET HB2 H 1 1.890 0.006 . 2 . . . . 1 M HB1 . 15246 1
3 . 1 1 23 23 MET HB3 H 1 1.890 0.006 . 2 . . . . 1 M HB2 . 15246 1
4 . 1 1 23 23 MET HG2 H 1 2.363 0.006 . 2 . . . . 1 M HG1 . 15246 1
5 . 1 1 23 23 MET HG3 H 1 2.363 0.006 . 2 . . . . 1 M HG2 . 15246 1
6 . 1 1 23 23 MET C C 13 175.320 0.25 . 1 . . . . 1 M C . 15246 1
7 . 1 1 23 23 MET CA C 13 54.705 0.25 . 1 . . . . 1 M CA . 15246 1
8 . 1 1 23 23 MET CB C 13 34.498 0.25 . 1 . . . . 1 M CB . 15246 1
9 . 1 1 23 23 MET CG C 13 32.618 0.25 . 1 . . . . 1 M CG . 15246 1
10 . 1 1 23 23 MET N N 15 120.277 0.20 . 1 . . . . 1 M N . 15246 1
11 . 1 1 24 24 PHE H H 1 8.940 0.006 . 1 . . . . 2 F HN . 15246 1
12 . 1 1 24 24 PHE HA H 1 4.540 0.006 . 1 . . . . 2 F HA . 15246 1
13 . 1 1 24 24 PHE HB2 H 1 2.910 0.006 . 2 . . . . 2 F HB1 . 15246 1
14 . 1 1 24 24 PHE HB3 H 1 2.747 0.006 . 2 . . . . 2 F HB2 . 15246 1
15 . 1 1 24 24 PHE HD1 H 1 7.123 0.006 . 3 . . . . 2 F HD1 . 15246 1
16 . 1 1 24 24 PHE HE1 H 1 7.410 0.006 . 3 . . . . 2 F HE1 . 15246 1
17 . 1 1 24 24 PHE C C 13 173.640 0.25 . 1 . . . . 2 F C . 15246 1
18 . 1 1 24 24 PHE CA C 13 58.262 0.25 . 1 . . . . 2 F CA . 15246 1
19 . 1 1 24 24 PHE CB C 13 40.639 0.25 . 1 . . . . 2 F CB . 15246 1
20 . 1 1 24 24 PHE N N 15 121.410 0.20 . 1 . . . . 2 F N . 15246 1
21 . 1 1 25 25 ARG H H 1 8.559 0.006 . 1 . . . . 3 R HN . 15246 1
22 . 1 1 25 25 ARG HA H 1 5.932 0.006 . 1 . . . . 3 R HA . 15246 1
23 . 1 1 25 25 ARG HB2 H 1 1.814 0.006 . 2 . . . . 3 R HB1 . 15246 1
24 . 1 1 25 25 ARG HB3 H 1 1.666 0.006 . 2 . . . . 3 R HB2 . 15246 1
25 . 1 1 25 25 ARG HD2 H 1 3.143 0.006 . 2 . . . . 3 R HD1 . 15246 1
26 . 1 1 25 25 ARG HD3 H 1 3.067 0.006 . 2 . . . . 3 R HD2 . 15246 1
27 . 1 1 25 25 ARG HG2 H 1 1.714 0.006 . 2 . . . . 3 R HG1 . 15246 1
28 . 1 1 25 25 ARG HG3 H 1 1.436 0.006 . 2 . . . . 3 R HG2 . 15246 1
29 . 1 1 25 25 ARG C C 13 175.870 0.25 . 1 . . . . 3 R C . 15246 1
30 . 1 1 25 25 ARG CA C 13 53.965 0.25 . 1 . . . . 3 R CA . 15246 1
31 . 1 1 25 25 ARG CB C 13 34.959 0.25 . 1 . . . . 3 R CB . 15246 1
32 . 1 1 25 25 ARG CD C 13 44.058 0.25 . 1 . . . . 3 R CD . 15246 1
33 . 1 1 25 25 ARG CG C 13 27.327 0.25 . 1 . . . . 3 R CG . 15246 1
34 . 1 1 25 25 ARG N N 15 123.288 0.20 . 1 . . . . 3 R N . 15246 1
35 . 1 1 26 26 SER H H 1 9.096 0.006 . 1 . . . . 4 S HN . 15246 1
36 . 1 1 26 26 SER HA H 1 5.306 0.006 . 1 . . . . 4 S HA . 15246 1
37 . 1 1 26 26 SER HB2 H 1 3.939 0.006 . 2 . . . . 4 S HB1 . 15246 1
38 . 1 1 26 26 SER HB3 H 1 3.741 0.006 . 2 . . . . 4 S HB2 . 15246 1
39 . 1 1 26 26 SER C C 13 173.230 0.25 . 1 . . . . 4 S C . 15246 1
40 . 1 1 26 26 SER CA C 13 56.908 0.25 . 1 . . . . 4 S CA . 15246 1
41 . 1 1 26 26 SER CB C 13 66.846 0.25 . 1 . . . . 4 S CB . 15246 1
42 . 1 1 26 26 SER N N 15 120.152 0.20 . 1 . . . . 4 S N . 15246 1
43 . 1 1 27 27 THR H H 1 8.889 0.006 . 1 . . . . 5 T HN . 15246 1
44 . 1 1 27 27 THR HA H 1 6.172 0.006 . 1 . . . . 5 T HA . 15246 1
45 . 1 1 27 27 THR HB H 1 4.252 0.006 . 1 . . . . 5 T HB . 15246 1
46 . 1 1 27 27 THR HG21 H 1 1.321 0.006 . 1 . . . . 5 T HG21 . 15246 1
47 . 1 1 27 27 THR HG22 H 1 1.321 0.006 . 1 . . . . 5 T HG21 . 15246 1
48 . 1 1 27 27 THR HG23 H 1 1.321 0.006 . 1 . . . . 5 T HG21 . 15246 1
49 . 1 1 27 27 THR C C 13 173.740 0.25 . 1 . . . . 5 T C . 15246 1
50 . 1 1 27 27 THR CA C 13 59.621 0.25 . 1 . . . . 5 T CA . 15246 1
51 . 1 1 27 27 THR CB C 13 75.444 0.25 . 1 . . . . 5 T CB . 15246 1
52 . 1 1 27 27 THR CG2 C 13 21.767 0.25 . 1 . . . . 5 T CG2 . 15246 1
53 . 1 1 27 27 THR N N 15 112.196 0.20 . 1 . . . . 5 T N . 15246 1
54 . 1 1 28 28 SER H H 1 8.945 0.006 . 1 . . . . 6 S HN . 15246 1
55 . 1 1 28 28 SER HA H 1 4.643 0.006 . 1 . . . . 6 S HA . 15246 1
56 . 1 1 28 28 SER HB2 H 1 2.265 0.006 . 2 . . . . 6 S HB1 . 15246 1
57 . 1 1 28 28 SER HB3 H 1 2.035 0.006 . 2 . . . . 6 S HB2 . 15246 1
58 . 1 1 28 28 SER C C 13 173.400 0.25 . 1 . . . . 6 S C . 15246 1
59 . 1 1 28 28 SER CA C 13 57.727 0.25 . 1 . . . . 6 S CA . 15246 1
60 . 1 1 28 28 SER CB C 13 65.115 0.25 . 1 . . . . 6 S CB . 15246 1
61 . 1 1 28 28 SER N N 15 115.468 0.20 . 1 . . . . 6 S N . 15246 1
62 . 1 1 29 29 HIS H H 1 8.713 0.006 . 1 . . . . 7 H HN . 15246 1
63 . 1 1 29 29 HIS HA H 1 5.046 0.006 . 1 . . . . 7 H HA . 15246 1
64 . 1 1 29 29 HIS HB2 H 1 3.033 0.006 . 2 . . . . 7 H HB1 . 15246 1
65 . 1 1 29 29 HIS HB3 H 1 2.823 0.006 . 2 . . . . 7 H HB2 . 15246 1
66 . 1 1 29 29 HIS HD2 H 1 6.423 0.006 . 1 . . . . 7 H HD2 . 15246 1
67 . 1 1 29 29 HIS C C 13 175.330 0.25 . 1 . . . . 7 H C . 15246 1
68 . 1 1 29 29 HIS CA C 13 55.507 0.25 . 1 . . . . 7 H CA . 15246 1
69 . 1 1 29 29 HIS CB C 13 31.214 0.25 . 1 . . . . 7 H CB . 15246 1
70 . 1 1 29 29 HIS N N 15 130.131 0.20 . 1 . . . . 7 H N . 15246 1
71 . 1 1 30 30 VAL H H 1 9.318 0.006 . 1 . . . . 8 V HN . 15246 1
72 . 1 1 30 30 VAL HA H 1 4.431 0.006 . 1 . . . . 8 V HA . 15246 1
73 . 1 1 30 30 VAL HB H 1 2.152 0.006 . 1 . . . . 8 V HB . 15246 1
74 . 1 1 30 30 VAL HG11 H 1 0.804 0.006 . 2 . . . . 8 V HG11 . 15246 1
75 . 1 1 30 30 VAL HG12 H 1 0.804 0.006 . 2 . . . . 8 V HG11 . 15246 1
76 . 1 1 30 30 VAL HG13 H 1 0.804 0.006 . 2 . . . . 8 V HG11 . 15246 1
77 . 1 1 30 30 VAL HG21 H 1 0.804 0.006 . 2 . . . . 8 V HG21 . 15246 1
78 . 1 1 30 30 VAL HG22 H 1 0.804 0.006 . 2 . . . . 8 V HG21 . 15246 1
79 . 1 1 30 30 VAL HG23 H 1 0.804 0.006 . 2 . . . . 8 V HG21 . 15246 1
80 . 1 1 30 30 VAL C C 13 175.620 0.25 . 1 . . . . 8 V C . 15246 1
81 . 1 1 30 30 VAL CA C 13 61.142 0.25 . 1 . . . . 8 V CA . 15246 1
82 . 1 1 30 30 VAL CB C 13 33.063 0.25 . 1 . . . . 8 V CB . 15246 1
83 . 1 1 30 30 VAL CG1 C 13 22.265 0.25 . 1 . . . . 8 V CG1 . 15246 1
84 . 1 1 30 30 VAL CG2 C 13 22.265 0.25 . 1 . . . . 8 V CG2 . 15246 1
85 . 1 1 30 30 VAL N N 15 128.679 0.20 . 1 . . . . 8 V N . 15246 1
86 . 1 1 31 31 ARG H H 1 9.212 0.006 . 1 . . . . 9 R HN . 15246 1
87 . 1 1 31 31 ARG HA H 1 4.517 0.006 . 1 . . . . 9 R HA . 15246 1
88 . 1 1 31 31 ARG HB2 H 1 1.971 0.006 . 2 . . . . 9 R HB1 . 15246 1
89 . 1 1 31 31 ARG HB3 H 1 1.924 0.006 . 2 . . . . 9 R HB2 . 15246 1
90 . 1 1 31 31 ARG HD2 H 1 3.335 0.006 . 2 . . . . 9 R HD1 . 15246 1
91 . 1 1 31 31 ARG HD3 H 1 3.335 0.006 . 2 . . . . 9 R HD2 . 15246 1
92 . 1 1 31 31 ARG HG2 H 1 1.965 0.006 . 2 . . . . 9 R HG1 . 15246 1
93 . 1 1 31 31 ARG HG3 H 1 1.811 0.006 . 2 . . . . 9 R HG2 . 15246 1
94 . 1 1 31 31 ARG C C 13 176.520 0.25 . 1 . . . . 9 R C . 15246 1
95 . 1 1 31 31 ARG CA C 13 57.458 0.25 . 1 . . . . 9 R CA . 15246 1
96 . 1 1 31 31 ARG CB C 13 29.842 0.25 . 1 . . . . 9 R CB . 15246 1
97 . 1 1 31 31 ARG CD C 13 43.017 0.25 . 1 . . . . 9 R CD . 15246 1
98 . 1 1 31 31 ARG CG C 13 27.408 0.25 . 1 . . . . 9 R CG . 15246 1
99 . 1 1 31 31 ARG N N 15 128.640 0.20 . 1 . . . . 9 R N . 15246 1
100 . 1 1 32 32 THR H H 1 7.941 0.006 . 1 . . . . 10 T HN . 15246 1
101 . 1 1 32 32 THR HA H 1 4.627 0.006 . 1 . . . . 10 T HA . 15246 1
102 . 1 1 32 32 THR HG21 H 1 1.089 0.006 . 1 . . . . 10 T HG21 . 15246 1
103 . 1 1 32 32 THR HG22 H 1 1.089 0.006 . 1 . . . . 10 T HG21 . 15246 1
104 . 1 1 32 32 THR HG23 H 1 1.089 0.006 . 1 . . . . 10 T HG21 . 15246 1
105 . 1 1 32 32 THR C C 13 172.560 0.25 . 1 . . . . 10 T C . 15246 1
106 . 1 1 32 32 THR CA C 13 61.473 0.25 . 1 . . . . 10 T CA . 15246 1
107 . 1 1 32 32 THR CB C 13 66.191 0.25 . 1 . . . . 10 T CB . 15246 1
108 . 1 1 32 32 THR CG2 C 13 17.911 0.25 . 1 . . . . 10 T CG2 . 15246 1
109 . 1 1 32 32 THR N N 15 120.036 0.20 . 1 . . . . 10 T N . 15246 1
110 . 1 1 33 33 GLU H H 1 9.022 0.006 . 1 . . . . 11 E HN . 15246 1
111 . 1 1 33 33 GLU HA H 1 4.731 0.006 . 1 . . . . 11 E HA . 15246 1
112 . 1 1 33 33 GLU HB2 H 1 1.921 0.006 . 2 . . . . 11 E HB1 . 15246 1
113 . 1 1 33 33 GLU HB3 H 1 1.921 0.006 . 2 . . . . 11 E HB2 . 15246 1
114 . 1 1 33 33 GLU HG2 H 1 2.416 0.006 . 2 . . . . 11 E HG1 . 15246 1
115 . 1 1 33 33 GLU HG3 H 1 2.416 0.006 . 2 . . . . 11 E HG2 . 15246 1
116 . 1 1 33 33 GLU C C 13 177.810 0.25 . 1 . . . . 11 E C . 15246 1
117 . 1 1 33 33 GLU CA C 13 57.466 0.25 . 1 . . . . 11 E CA . 15246 1
118 . 1 1 33 33 GLU CB C 13 30.044 0.25 . 1 . . . . 11 E CB . 15246 1
119 . 1 1 33 33 GLU CG C 13 37.571 0.25 . 1 . . . . 11 E CG . 15246 1
120 . 1 1 33 33 GLU N N 15 126.859 0.20 . 1 . . . . 11 E N . 15246 1
121 . 1 1 34 34 SER H H 1 8.930 0.006 . 1 . . . . 12 S HN . 15246 1
122 . 1 1 34 34 SER HA H 1 4.795 0.006 . 1 . . . . 12 S HA . 15246 1
123 . 1 1 34 34 SER HB2 H 1 3.458 0.006 . 2 . . . . 12 S HB1 . 15246 1
124 . 1 1 34 34 SER HB3 H 1 3.123 0.006 . 2 . . . . 12 S HB2 . 15246 1
125 . 1 1 34 34 SER C C 13 173.360 0.25 . 1 . . . . 12 S C . 15246 1
126 . 1 1 34 34 SER CA C 13 56.842 0.25 . 1 . . . . 12 S CA . 15246 1
127 . 1 1 34 34 SER CB C 13 63.756 0.25 . 1 . . . . 12 S CB . 15246 1
128 . 1 1 34 34 SER N N 15 119.717 0.20 . 1 . . . . 12 S N . 15246 1
129 . 1 1 35 35 ALA H H 1 8.756 0.006 . 1 . . . . 13 A HN . 15246 1
130 . 1 1 35 35 ALA HA H 1 3.542 0.006 . 1 . . . . 13 A HA . 15246 1
131 . 1 1 35 35 ALA HB1 H 1 1.390 0.006 . 1 . . . . 13 A HB1 . 15246 1
132 . 1 1 35 35 ALA HB2 H 1 1.390 0.006 . 1 . . . . 13 A HB1 . 15246 1
133 . 1 1 35 35 ALA HB3 H 1 1.390 0.006 . 1 . . . . 13 A HB1 . 15246 1
134 . 1 1 35 35 ALA C C 13 178.560 0.25 . 1 . . . . 13 A C . 15246 1
135 . 1 1 35 35 ALA CA C 13 56.288 0.25 . 1 . . . . 13 A CA . 15246 1
136 . 1 1 35 35 ALA CB C 13 21.558 0.25 . 1 . . . . 13 A CB . 15246 1
137 . 1 1 35 35 ALA N N 15 121.856 0.20 . 1 . . . . 13 A N . 15246 1
138 . 1 1 36 36 ALA H H 1 8.442 0.006 . 1 . . . . 14 A HN . 15246 1
139 . 1 1 36 36 ALA HA H 1 3.691 0.006 . 1 . . . . 14 A HA . 15246 1
140 . 1 1 36 36 ALA HB1 H 1 1.356 0.006 . 1 . . . . 14 A HB1 . 15246 1
141 . 1 1 36 36 ALA HB2 H 1 1.356 0.006 . 1 . . . . 14 A HB1 . 15246 1
142 . 1 1 36 36 ALA HB3 H 1 1.356 0.006 . 1 . . . . 14 A HB1 . 15246 1
143 . 1 1 36 36 ALA C C 13 179.900 0.25 . 1 . . . . 14 A C . 15246 1
144 . 1 1 36 36 ALA CA C 13 55.754 0.25 . 1 . . . . 14 A CA . 15246 1
145 . 1 1 36 36 ALA CB C 13 17.368 0.25 . 1 . . . . 14 A CB . 15246 1
146 . 1 1 36 36 ALA N N 15 117.191 0.20 . 1 . . . . 14 A N . 15246 1
147 . 1 1 37 37 ARG H H 1 7.513 0.006 . 1 . . . . 15 R HN . 15246 1
148 . 1 1 37 37 ARG HA H 1 4.097 0.006 . 1 . . . . 15 R HA . 15246 1
149 . 1 1 37 37 ARG HB2 H 1 1.787 0.006 . 2 . . . . 15 R HB1 . 15246 1
150 . 1 1 37 37 ARG HB3 H 1 1.623 0.006 . 2 . . . . 15 R HB2 . 15246 1
151 . 1 1 37 37 ARG HD2 H 1 3.215 0.006 . 2 . . . . 15 R HD1 . 15246 1
152 . 1 1 37 37 ARG HD3 H 1 3.215 0.006 . 2 . . . . 15 R HD2 . 15246 1
153 . 1 1 37 37 ARG HG2 H 1 1.475 0.006 . 2 . . . . 15 R HG1 . 15246 1
154 . 1 1 37 37 ARG HG3 H 1 1.475 0.006 . 2 . . . . 15 R HG2 . 15246 1
155 . 1 1 37 37 ARG C C 13 178.720 0.25 . 1 . . . . 15 R C . 15246 1
156 . 1 1 37 37 ARG CA C 13 58.699 0.25 . 1 . . . . 15 R CA . 15246 1
157 . 1 1 37 37 ARG CB C 13 30.024 0.25 . 1 . . . . 15 R CB . 15246 1
158 . 1 1 37 37 ARG CD C 13 43.858 0.25 . 1 . . . . 15 R CD . 15246 1
159 . 1 1 37 37 ARG CG C 13 27.067 0.25 . 1 . . . . 15 R CG . 15246 1
160 . 1 1 37 37 ARG N N 15 118.952 0.20 . 1 . . . . 15 R N . 15246 1
161 . 1 1 38 38 TYR H H 1 7.632 0.006 . 1 . . . . 16 Y HN . 15246 1
162 . 1 1 38 38 TYR HA H 1 4.433 0.006 . 1 . . . . 16 Y HA . 15246 1
163 . 1 1 38 38 TYR HB2 H 1 3.004 0.006 . 2 . . . . 16 Y HB1 . 15246 1
164 . 1 1 38 38 TYR HB3 H 1 2.834 0.006 . 2 . . . . 16 Y HB2 . 15246 1
165 . 1 1 38 38 TYR HD1 H 1 6.600 0.006 . 3 . . . . 16 Y HD1 . 15246 1
166 . 1 1 38 38 TYR C C 13 178.110 0.25 . 1 . . . . 16 Y C . 15246 1
167 . 1 1 38 38 TYR CA C 13 58.473 0.25 . 1 . . . . 16 Y CA . 15246 1
168 . 1 1 38 38 TYR CB C 13 36.286 0.25 . 1 . . . . 16 Y CB . 15246 1
169 . 1 1 38 38 TYR N N 15 118.516 0.20 . 1 . . . . 16 Y N . 15246 1
170 . 1 1 39 39 VAL H H 1 8.680 0.006 . 1 . . . . 17 V HN . 15246 1
171 . 1 1 39 39 VAL HA H 1 3.491 0.006 . 1 . . . . 17 V HA . 15246 1
172 . 1 1 39 39 VAL HB H 1 2.107 0.006 . 1 . . . . 17 V HB . 15246 1
173 . 1 1 39 39 VAL HG11 H 1 0.983 0.006 . 2 . . . . 17 V HG11 . 15246 1
174 . 1 1 39 39 VAL HG12 H 1 0.983 0.006 . 2 . . . . 17 V HG11 . 15246 1
175 . 1 1 39 39 VAL HG13 H 1 0.983 0.006 . 2 . . . . 17 V HG11 . 15246 1
176 . 1 1 39 39 VAL HG21 H 1 0.900 0.006 . 2 . . . . 17 V HG21 . 15246 1
177 . 1 1 39 39 VAL HG22 H 1 0.900 0.006 . 2 . . . . 17 V HG21 . 15246 1
178 . 1 1 39 39 VAL HG23 H 1 0.900 0.006 . 2 . . . . 17 V HG21 . 15246 1
179 . 1 1 39 39 VAL C C 13 177.450 0.25 . 1 . . . . 17 V C . 15246 1
180 . 1 1 39 39 VAL CA C 13 68.093 0.25 . 1 . . . . 17 V CA . 15246 1
181 . 1 1 39 39 VAL CB C 13 31.943 0.25 . 1 . . . . 17 V CB . 15246 1
182 . 1 1 39 39 VAL CG1 C 13 24.369 0.25 . 1 . . . . 17 V CG1 . 15246 1
183 . 1 1 39 39 VAL CG2 C 13 21.770 0.25 . 1 . . . . 17 V CG2 . 15246 1
184 . 1 1 39 39 VAL N N 15 119.126 0.20 . 1 . . . . 17 V N . 15246 1
185 . 1 1 40 40 ASN H H 1 7.813 0.006 . 1 . . . . 18 N HN . 15246 1
186 . 1 1 40 40 ASN HA H 1 4.280 0.006 . 1 . . . . 18 N HA . 15246 1
187 . 1 1 40 40 ASN HB2 H 1 2.959 0.006 . 2 . . . . 18 N HB1 . 15246 1
188 . 1 1 40 40 ASN HB3 H 1 2.864 0.006 . 2 . . . . 18 N HB2 . 15246 1
189 . 1 1 40 40 ASN C C 13 177.190 0.25 . 1 . . . . 18 N C . 15246 1
190 . 1 1 40 40 ASN CA C 13 57.525 0.25 . 1 . . . . 18 N CA . 15246 1
191 . 1 1 40 40 ASN CB C 13 39.474 0.25 . 1 . . . . 18 N CB . 15246 1
192 . 1 1 40 40 ASN N N 15 118.013 0.20 . 1 . . . . 18 N N . 15246 1
193 . 1 1 41 41 ARG H H 1 8.425 0.006 . 1 . . . . 19 R HN . 15246 1
194 . 1 1 41 41 ARG HA H 1 4.010 0.006 . 1 . . . . 19 R HA . 15246 1
195 . 1 1 41 41 ARG HB2 H 1 2.200 0.006 . 2 . . . . 19 R HB1 . 15246 1
196 . 1 1 41 41 ARG HB3 H 1 1.939 0.006 . 2 . . . . 19 R HB2 . 15246 1
197 . 1 1 41 41 ARG HD2 H 1 3.334 0.006 . 2 . . . . 19 R HD1 . 15246 1
198 . 1 1 41 41 ARG HD3 H 1 3.334 0.006 . 2 . . . . 19 R HD2 . 15246 1
199 . 1 1 41 41 ARG HG2 H 1 2.131 0.006 . 2 . . . . 19 R HG1 . 15246 1
200 . 1 1 41 41 ARG HG3 H 1 1.921 0.006 . 2 . . . . 19 R HG2 . 15246 1
201 . 1 1 41 41 ARG C C 13 180.050 0.25 . 1 . . . . 19 R C . 15246 1
202 . 1 1 41 41 ARG CA C 13 59.734 0.25 . 1 . . . . 19 R CA . 15246 1
203 . 1 1 41 41 ARG CB C 13 30.877 0.25 . 1 . . . . 19 R CB . 15246 1
204 . 1 1 41 41 ARG CD C 13 43.973 0.25 . 1 . . . . 19 R CD . 15246 1
205 . 1 1 41 41 ARG CG C 13 27.935 0.25 . 1 . . . . 19 R CG . 15246 1
206 . 1 1 41 41 ARG N N 15 116.687 0.20 . 1 . . . . 19 R N . 15246 1
207 . 1 1 42 42 LEU H H 1 8.731 0.006 . 1 . . . . 20 L HN . 15246 1
208 . 1 1 42 42 LEU HA H 1 3.904 0.006 . 1 . . . . 20 L HA . 15246 1
209 . 1 1 42 42 LEU HB2 H 1 1.819 0.006 . 2 . . . . 20 L HB1 . 15246 1
210 . 1 1 42 42 LEU HB3 H 1 1.671 0.006 . 2 . . . . 20 L HB2 . 15246 1
211 . 1 1 42 42 LEU HD11 H 1 0.613 0.006 . 2 . . . . 20 L HD11 . 15246 1
212 . 1 1 42 42 LEU HD12 H 1 0.613 0.006 . 2 . . . . 20 L HD11 . 15246 1
213 . 1 1 42 42 LEU HD13 H 1 0.613 0.006 . 2 . . . . 20 L HD11 . 15246 1
214 . 1 1 42 42 LEU HD21 H 1 0.531 0.006 . 2 . . . . 20 L HD21 . 15246 1
215 . 1 1 42 42 LEU HD22 H 1 0.531 0.006 . 2 . . . . 20 L HD21 . 15246 1
216 . 1 1 42 42 LEU HD23 H 1 0.531 0.006 . 2 . . . . 20 L HD21 . 15246 1
217 . 1 1 42 42 LEU HG H 1 1.656 0.006 . 1 . . . . 20 L HG . 15246 1
218 . 1 1 42 42 LEU C C 13 178.690 0.25 . 1 . . . . 20 L C . 15246 1
219 . 1 1 42 42 LEU CA C 13 58.238 0.25 . 1 . . . . 20 L CA . 15246 1
220 . 1 1 42 42 LEU CB C 13 41.659 0.25 . 1 . . . . 20 L CB . 15246 1
221 . 1 1 42 42 LEU CD1 C 13 25.085 0.25 . 1 . . . . 20 L CD1 . 15246 1
222 . 1 1 42 42 LEU CD2 C 13 24.028 0.25 . 1 . . . . 20 L CD2 . 15246 1
223 . 1 1 42 42 LEU CG C 13 27.053 0.25 . 1 . . . . 20 L CG . 15246 1
224 . 1 1 42 42 LEU N N 15 120.849 0.20 . 1 . . . . 20 L N . 15246 1
225 . 1 1 43 43 CYS H H 1 8.241 0.006 . 1 . . . . 21 C HN . 15246 1
226 . 1 1 43 43 CYS HA H 1 4.268 0.006 . 1 . . . . 21 C HA . 15246 1
227 . 1 1 43 43 CYS HB2 H 1 3.179 0.006 . 2 . . . . 21 C HB1 . 15246 1
228 . 1 1 43 43 CYS HB3 H 1 2.770 0.006 . 2 . . . . 21 C HB2 . 15246 1
229 . 1 1 43 43 CYS C C 13 177.530 0.25 . 1 . . . . 21 C C . 15246 1
230 . 1 1 43 43 CYS CA C 13 65.374 0.25 . 1 . . . . 21 C CA . 15246 1
231 . 1 1 43 43 CYS CB C 13 27.962 0.25 . 1 . . . . 21 C CB . 15246 1
232 . 1 1 43 43 CYS N N 15 115.952 0.20 . 1 . . . . 21 C N . 15246 1
233 . 1 1 44 44 LYS H H 1 8.364 0.006 . 1 . . . . 22 K HN . 15246 1
234 . 1 1 44 44 LYS HA H 1 4.091 0.006 . 1 . . . . 22 K HA . 15246 1
235 . 1 1 44 44 LYS HB2 H 1 1.930 0.006 . 2 . . . . 22 K HB1 . 15246 1
236 . 1 1 44 44 LYS HB3 H 1 1.930 0.006 . 2 . . . . 22 K HB2 . 15246 1
237 . 1 1 44 44 LYS HD2 H 1 1.687 0.006 . 2 . . . . 22 K HD1 . 15246 1
238 . 1 1 44 44 LYS HD3 H 1 1.687 0.006 . 2 . . . . 22 K HD2 . 15246 1
239 . 1 1 44 44 LYS HE2 H 1 2.994 0.006 . 2 . . . . 22 K HE1 . 15246 1
240 . 1 1 44 44 LYS HE3 H 1 2.994 0.006 . 2 . . . . 22 K HE2 . 15246 1
241 . 1 1 44 44 LYS HG2 H 1 1.591 0.006 . 2 . . . . 22 K HG1 . 15246 1
242 . 1 1 44 44 LYS HG3 H 1 1.487 0.006 . 2 . . . . 22 K HG2 . 15246 1
243 . 1 1 44 44 LYS C C 13 179.020 0.25 . 1 . . . . 22 K C . 15246 1
244 . 1 1 44 44 LYS CA C 13 59.004 0.25 . 1 . . . . 22 K CA . 15246 1
245 . 1 1 44 44 LYS CB C 13 31.921 0.25 . 1 . . . . 22 K CB . 15246 1
246 . 1 1 44 44 LYS CD C 13 28.841 0.25 . 1 . . . . 22 K CD . 15246 1
247 . 1 1 44 44 LYS CE C 13 42.399 0.25 . 1 . . . . 22 K CE . 15246 1
248 . 1 1 44 44 LYS CG C 13 25.488 0.25 . 1 . . . . 22 K CG . 15246 1
249 . 1 1 44 44 LYS N N 15 119.823 0.20 . 1 . . . . 22 K N . 15246 1
250 . 1 1 45 45 HIS H H 1 8.036 0.006 . 1 . . . . 23 H HN . 15246 1
251 . 1 1 45 45 HIS HA H 1 4.408 0.006 . 1 . . . . 23 H HA . 15246 1
252 . 1 1 45 45 HIS HB2 H 1 3.100 0.006 . 2 . . . . 23 H HB1 . 15246 1
253 . 1 1 45 45 HIS HB3 H 1 3.100 0.006 . 2 . . . . 23 H HB2 . 15246 1
254 . 1 1 45 45 HIS HD2 H 1 7.206 0.006 . 1 . . . . 23 H HD2 . 15246 1
255 . 1 1 45 45 HIS C C 13 177.870 0.25 . 1 . . . . 23 H C . 15246 1
256 . 1 1 45 45 HIS CA C 13 60.404 0.25 . 1 . . . . 23 H CA . 15246 1
257 . 1 1 45 45 HIS CB C 13 30.954 0.25 . 1 . . . . 23 H CB . 15246 1
258 . 1 1 45 45 HIS N N 15 118.729 0.20 . 1 . . . . 23 H N . 15246 1
259 . 1 1 46 46 TRP H H 1 8.426 0.006 . 1 . . . . 24 W HN . 15246 1
260 . 1 1 46 46 TRP HA H 1 4.903 0.006 . 1 . . . . 24 W HA . 15246 1
261 . 1 1 46 46 TRP HB2 H 1 3.357 0.006 . 2 . . . . 24 W HB1 . 15246 1
262 . 1 1 46 46 TRP HB3 H 1 3.237 0.006 . 2 . . . . 24 W HB2 . 15246 1
263 . 1 1 46 46 TRP HD1 H 1 7.527 0.006 . 1 . . . . 24 W HD1 . 15246 1
264 . 1 1 46 46 TRP HE1 H 1 10.009 0.006 . 1 . . . . 24 W HE1 . 15246 1
265 . 1 1 46 46 TRP C C 13 177.900 0.25 . 1 . . . . 24 W C . 15246 1
266 . 1 1 46 46 TRP CA C 13 58.973 0.25 . 1 . . . . 24 W CA . 15246 1
267 . 1 1 46 46 TRP CB C 13 29.328 0.25 . 1 . . . . 24 W CB . 15246 1
268 . 1 1 46 46 TRP N N 15 117.297 0.20 . 1 . . . . 24 W N . 15246 1
269 . 1 1 46 46 TRP NE1 N 15 128.860 0.20 . 1 . . . . 24 W NE1 . 15246 1
270 . 1 1 47 47 GLY H H 1 8.254 0.006 . 1 . . . . 25 G HN . 15246 1
271 . 1 1 47 47 GLY HA2 H 1 4.362 0.006 . 2 . . . . 25 G HA1 . 15246 1
272 . 1 1 47 47 GLY HA3 H 1 3.936 0.006 . 2 . . . . 25 G HA2 . 15246 1
273 . 1 1 47 47 GLY CA C 13 46.812 0.25 . 1 . . . . 25 G CA . 15246 1
274 . 1 1 47 47 GLY N N 15 108.683 0.20 . 1 . . . . 25 G N . 15246 1
275 . 1 1 48 48 HIS C C 13 176.030 0.25 . 1 . . . . 26 H C . 15246 1
276 . 1 1 48 48 HIS CA C 13 58.358 0.25 . 1 . . . . 26 H CA . 15246 1
277 . 1 1 48 48 HIS CB C 13 30.438 0.25 . 1 . . . . 26 H CB . 15246 1
278 . 1 1 49 49 LYS H H 1 7.544 0.006 . 1 . . . . 27 K HN . 15246 1
279 . 1 1 49 49 LYS HA H 1 4.236 0.006 . 1 . . . . 27 K HA . 15246 1
280 . 1 1 49 49 LYS HB2 H 1 1.191 0.006 . 2 . . . . 27 K HB1 . 15246 1
281 . 1 1 49 49 LYS HB3 H 1 1.017 0.006 . 2 . . . . 27 K HB2 . 15246 1
282 . 1 1 49 49 LYS HD2 H 1 1.514 0.006 . 2 . . . . 27 K HD1 . 15246 1
283 . 1 1 49 49 LYS HD3 H 1 1.514 0.006 . 2 . . . . 27 K HD2 . 15246 1
284 . 1 1 49 49 LYS HE2 H 1 2.892 0.006 . 2 . . . . 27 K HE1 . 15246 1
285 . 1 1 49 49 LYS HE3 H 1 2.892 0.006 . 2 . . . . 27 K HE2 . 15246 1
286 . 1 1 49 49 LYS HG2 H 1 0.922 0.006 . 2 . . . . 27 K HG1 . 15246 1
287 . 1 1 49 49 LYS HG3 H 1 0.723 0.006 . 2 . . . . 27 K HG2 . 15246 1
288 . 1 1 49 49 LYS C C 13 174.880 0.25 . 1 . . . . 27 K C . 15246 1
289 . 1 1 49 49 LYS CA C 13 56.572 0.25 . 1 . . . . 27 K CA . 15246 1
290 . 1 1 49 49 LYS CB C 13 35.793 0.25 . 1 . . . . 27 K CB . 15246 1
291 . 1 1 49 49 LYS CD C 13 29.137 0.25 . 1 . . . . 27 K CD . 15246 1
292 . 1 1 49 49 LYS CE C 13 42.108 0.25 . 1 . . . . 27 K CE . 15246 1
293 . 1 1 49 49 LYS CG C 13 24.589 0.25 . 1 . . . . 27 K CG . 15246 1
294 . 1 1 49 49 LYS N N 15 117.278 0.20 . 1 . . . . 27 K N . 15246 1
295 . 1 1 50 50 PHE H H 1 8.178 0.006 . 1 . . . . 28 F HN . 15246 1
296 . 1 1 50 50 PHE HA H 1 5.016 0.006 . 1 . . . . 28 F HA . 15246 1
297 . 1 1 50 50 PHE HB2 H 1 3.129 0.006 . 2 . . . . 28 F HB1 . 15246 1
298 . 1 1 50 50 PHE HB3 H 1 2.091 0.006 . 2 . . . . 28 F HB2 . 15246 1
299 . 1 1 50 50 PHE HD1 H 1 7.212 0.006 . 3 . . . . 28 F HD1 . 15246 1
300 . 1 1 50 50 PHE HE1 H 1 7.353 0.006 . 3 . . . . 28 F HE1 . 15246 1
301 . 1 1 50 50 PHE C C 13 174.190 0.25 . 1 . . . . 28 F C . 15246 1
302 . 1 1 50 50 PHE CA C 13 55.756 0.25 . 1 . . . . 28 F CA . 15246 1
303 . 1 1 50 50 PHE CB C 13 41.140 0.25 . 1 . . . . 28 F CB . 15246 1
304 . 1 1 50 50 PHE N N 15 118.846 0.20 . 1 . . . . 28 F N . 15246 1
305 . 1 1 51 51 GLU H H 1 7.812 0.006 . 1 . . . . 29 E HN . 15246 1
306 . 1 1 51 51 GLU HA H 1 4.449 0.006 . 1 . . . . 29 E HA . 15246 1
307 . 1 1 51 51 GLU HB2 H 1 2.148 0.006 . 2 . . . . 29 E HB1 . 15246 1
308 . 1 1 51 51 GLU HB3 H 1 2.091 0.006 . 2 . . . . 29 E HB2 . 15246 1
309 . 1 1 51 51 GLU HG2 H 1 2.393 0.006 . 2 . . . . 29 E HG1 . 15246 1
310 . 1 1 51 51 GLU HG3 H 1 2.362 0.006 . 2 . . . . 29 E HG2 . 15246 1
311 . 1 1 51 51 GLU C C 13 175.570 0.25 . 1 . . . . 29 E C . 15246 1
312 . 1 1 51 51 GLU CA C 13 56.852 0.25 . 1 . . . . 29 E CA . 15246 1
313 . 1 1 51 51 GLU CB C 13 30.207 0.25 . 1 . . . . 29 E CB . 15246 1
314 . 1 1 51 51 GLU CG C 13 36.156 0.25 . 1 . . . . 29 E CG . 15246 1
315 . 1 1 51 51 GLU N N 15 120.355 0.20 . 1 . . . . 29 E N . 15246 1
316 . 1 1 52 52 VAL H H 1 8.395 0.006 . 1 . . . . 30 V HN . 15246 1
317 . 1 1 52 52 VAL HA H 1 5.383 0.006 . 1 . . . . 30 V HA . 15246 1
318 . 1 1 52 52 VAL HB H 1 2.048 0.006 . 1 . . . . 30 V HB . 15246 1
319 . 1 1 52 52 VAL HG11 H 1 0.996 0.006 . 2 . . . . 30 V HG11 . 15246 1
320 . 1 1 52 52 VAL HG12 H 1 0.996 0.006 . 2 . . . . 30 V HG11 . 15246 1
321 . 1 1 52 52 VAL HG13 H 1 0.996 0.006 . 2 . . . . 30 V HG11 . 15246 1
322 . 1 1 52 52 VAL HG21 H 1 0.956 0.006 . 2 . . . . 30 V HG21 . 15246 1
323 . 1 1 52 52 VAL HG22 H 1 0.956 0.006 . 2 . . . . 30 V HG21 . 15246 1
324 . 1 1 52 52 VAL HG23 H 1 0.956 0.006 . 2 . . . . 30 V HG21 . 15246 1
325 . 1 1 52 52 VAL C C 13 175.850 0.25 . 1 . . . . 30 V C . 15246 1
326 . 1 1 52 52 VAL CA C 13 59.969 0.25 . 1 . . . . 30 V CA . 15246 1
327 . 1 1 52 52 VAL CB C 13 36.173 0.25 . 1 . . . . 30 V CB . 15246 1
328 . 1 1 52 52 VAL CG1 C 13 21.629 0.25 . 1 . . . . 30 V CG1 . 15246 1
329 . 1 1 52 52 VAL CG2 C 13 21.083 0.25 . 1 . . . . 30 V CG2 . 15246 1
330 . 1 1 52 52 VAL N N 15 124.120 0.20 . 1 . . . . 30 V N . 15246 1
331 . 1 1 53 53 GLU H H 1 9.289 0.006 . 1 . . . . 31 E HN . 15246 1
332 . 1 1 53 53 GLU HA H 1 4.717 0.006 . 1 . . . . 31 E HA . 15246 1
333 . 1 1 53 53 GLU HB2 H 1 2.158 0.006 . 2 . . . . 31 E HB1 . 15246 1
334 . 1 1 53 53 GLU HB3 H 1 2.067 0.006 . 2 . . . . 31 E HB2 . 15246 1
335 . 1 1 53 53 GLU HG2 H 1 2.366 0.006 . 2 . . . . 31 E HG1 . 15246 1
336 . 1 1 53 53 GLU HG3 H 1 2.282 0.006 . 2 . . . . 31 E HG2 . 15246 1
337 . 1 1 53 53 GLU C C 13 174.370 0.25 . 1 . . . . 31 E C . 15246 1
338 . 1 1 53 53 GLU CA C 13 55.415 0.25 . 1 . . . . 31 E CA . 15246 1
339 . 1 1 53 53 GLU CB C 13 33.211 0.25 . 1 . . . . 31 E CB . 15246 1
340 . 1 1 53 53 GLU CG C 13 36.156 0.25 . 1 . . . . 31 E CG . 15246 1
341 . 1 1 53 53 GLU N N 15 126.346 0.20 . 1 . . . . 31 E N . 15246 1
342 . 1 1 54 54 LEU H H 1 8.763 0.006 . 1 . . . . 32 L HN . 15246 1
343 . 1 1 54 54 LEU HA H 1 5.375 0.006 . 1 . . . . 32 L HA . 15246 1
344 . 1 1 54 54 LEU HB2 H 1 1.835 0.006 . 2 . . . . 32 L HB1 . 15246 1
345 . 1 1 54 54 LEU HB3 H 1 1.350 0.006 . 2 . . . . 32 L HB2 . 15246 1
346 . 1 1 54 54 LEU HD11 H 1 1.097 0.006 . 2 . . . . 32 L HD11 . 15246 1
347 . 1 1 54 54 LEU HD12 H 1 1.097 0.006 . 2 . . . . 32 L HD11 . 15246 1
348 . 1 1 54 54 LEU HD13 H 1 1.097 0.006 . 2 . . . . 32 L HD11 . 15246 1
349 . 1 1 54 54 LEU HD21 H 1 1.097 0.006 . 2 . . . . 32 L HD21 . 15246 1
350 . 1 1 54 54 LEU HD22 H 1 1.097 0.006 . 2 . . . . 32 L HD21 . 15246 1
351 . 1 1 54 54 LEU HD23 H 1 1.097 0.006 . 2 . . . . 32 L HD21 . 15246 1
352 . 1 1 54 54 LEU HG H 1 0.952 0.006 . 1 . . . . 32 L HG . 15246 1
353 . 1 1 54 54 LEU C C 13 175.100 0.25 . 1 . . . . 32 L C . 15246 1
354 . 1 1 54 54 LEU CA C 13 55.010 0.25 . 1 . . . . 32 L CA . 15246 1
355 . 1 1 54 54 LEU CB C 13 45.485 0.25 . 1 . . . . 32 L CB . 15246 1
356 . 1 1 54 54 LEU CD1 C 13 23.668 0.25 . 1 . . . . 32 L CD1 . 15246 1
357 . 1 1 54 54 LEU CD2 C 13 23.668 0.25 . 1 . . . . 32 L CD2 . 15246 1
358 . 1 1 54 54 LEU CG C 13 26.361 0.25 . 1 . . . . 32 L CG . 15246 1
359 . 1 1 54 54 LEU N N 15 126.898 0.20 . 1 . . . . 32 L N . 15246 1
360 . 1 1 55 55 THR H H 1 9.159 0.006 . 1 . . . . 33 T HN . 15246 1
361 . 1 1 55 55 THR HA H 1 4.886 0.006 . 1 . . . . 33 T HA . 15246 1
362 . 1 1 55 55 THR HB H 1 4.775 0.006 . 1 . . . . 33 T HB . 15246 1
363 . 1 1 55 55 THR HG21 H 1 1.303 0.006 . 1 . . . . 33 T HG21 . 15246 1
364 . 1 1 55 55 THR HG22 H 1 1.303 0.006 . 1 . . . . 33 T HG21 . 15246 1
365 . 1 1 55 55 THR HG23 H 1 1.303 0.006 . 1 . . . . 33 T HG21 . 15246 1
366 . 1 1 55 55 THR CA C 13 59.489 0.25 . 1 . . . . 33 T CA . 15246 1
367 . 1 1 55 55 THR CB C 13 69.241 0.25 . 1 . . . . 33 T CB . 15246 1
368 . 1 1 55 55 THR CG2 C 13 22.450 0.25 . 1 . . . . 33 T CG2 . 15246 1
369 . 1 1 55 55 THR N N 15 121.246 0.20 . 1 . . . . 33 T N . 15246 1
370 . 1 1 56 56 PRO HA H 1 4.269 0.006 . 1 . . . . 34 P HA . 15246 1
371 . 1 1 56 56 PRO HB2 H 1 2.380 0.006 . 2 . . . . 34 P HB1 . 15246 1
372 . 1 1 56 56 PRO HB3 H 1 1.847 0.006 . 2 . . . . 34 P HB2 . 15246 1
373 . 1 1 56 56 PRO HD2 H 1 3.887 0.006 . 2 . . . . 34 P HD1 . 15246 1
374 . 1 1 56 56 PRO HD3 H 1 3.802 0.006 . 2 . . . . 34 P HD2 . 15246 1
375 . 1 1 56 56 PRO HG2 H 1 2.199 0.006 . 2 . . . . 34 P HG1 . 15246 1
376 . 1 1 56 56 PRO HG3 H 1 1.970 0.006 . 2 . . . . 34 P HG2 . 15246 1
377 . 1 1 56 56 PRO C C 13 177.750 0.25 . 1 . . . . 34 P C . 15246 1
378 . 1 1 56 56 PRO CA C 13 65.968 0.25 . 1 . . . . 34 P CA . 15246 1
379 . 1 1 56 56 PRO CB C 13 31.786 0.25 . 1 . . . . 34 P CB . 15246 1
380 . 1 1 56 56 PRO CD C 13 50.616 0.25 . 1 . . . . 34 P CD . 15246 1
381 . 1 1 56 56 PRO CG C 13 28.408 0.25 . 1 . . . . 34 P CG . 15246 1
382 . 1 1 57 57 GLU H H 1 8.148 0.006 . 1 . . . . 35 E HN . 15246 1
383 . 1 1 57 57 GLU HA H 1 4.351 0.006 . 1 . . . . 35 E HA . 15246 1
384 . 1 1 57 57 GLU HB2 H 1 2.176 0.006 . 2 . . . . 35 E HB1 . 15246 1
385 . 1 1 57 57 GLU HB3 H 1 1.998 0.006 . 2 . . . . 35 E HB2 . 15246 1
386 . 1 1 57 57 GLU HG2 H 1 2.246 0.006 . 2 . . . . 35 E HG1 . 15246 1
387 . 1 1 57 57 GLU HG3 H 1 2.170 0.006 . 2 . . . . 35 E HG2 . 15246 1
388 . 1 1 57 57 GLU C C 13 175.720 0.25 . 1 . . . . 35 E C . 15246 1
389 . 1 1 57 57 GLU CA C 13 57.085 0.25 . 1 . . . . 35 E CA . 15246 1
390 . 1 1 57 57 GLU CB C 13 30.299 0.25 . 1 . . . . 35 E CB . 15246 1
391 . 1 1 57 57 GLU CG C 13 36.704 0.25 . 1 . . . . 35 E CG . 15246 1
392 . 1 1 57 57 GLU N N 15 112.303 0.20 . 1 . . . . 35 E N . 15246 1
393 . 1 1 58 58 ARG H H 1 7.777 0.006 . 1 . . . . 36 R HN . 15246 1
394 . 1 1 58 58 ARG HA H 1 5.418 0.006 . 1 . . . . 36 R HA . 15246 1
395 . 1 1 58 58 ARG HB2 H 1 1.721 0.006 . 2 . . . . 36 R HB1 . 15246 1
396 . 1 1 58 58 ARG HB3 H 1 1.580 0.006 . 2 . . . . 36 R HB2 . 15246 1
397 . 1 1 58 58 ARG HD2 H 1 3.022 0.006 . 2 . . . . 36 R HD1 . 15246 1
398 . 1 1 58 58 ARG HD3 H 1 3.022 0.006 . 2 . . . . 36 R HD2 . 15246 1
399 . 1 1 58 58 ARG HG2 H 1 1.585 0.006 . 2 . . . . 36 R HG1 . 15246 1
400 . 1 1 58 58 ARG HG3 H 1 1.307 0.006 . 2 . . . . 36 R HG2 . 15246 1
401 . 1 1 58 58 ARG C C 13 173.610 0.25 . 1 . . . . 36 R C . 15246 1
402 . 1 1 58 58 ARG CA C 13 55.576 0.25 . 1 . . . . 36 R CA . 15246 1
403 . 1 1 58 58 ARG CB C 13 33.324 0.25 . 1 . . . . 36 R CB . 15246 1
404 . 1 1 58 58 ARG CD C 13 43.714 0.25 . 1 . . . . 36 R CD . 15246 1
405 . 1 1 58 58 ARG CG C 13 28.347 0.25 . 1 . . . . 36 R CG . 15246 1
406 . 1 1 58 58 ARG N N 15 122.018 0.20 . 1 . . . . 36 R N . 15246 1
407 . 1 1 59 59 GLY H H 1 9.650 0.006 . 1 . . . . 37 G HN . 15246 1
408 . 1 1 59 59 GLY HA2 H 1 5.484 0.006 . 2 . . . . 37 G HA1 . 15246 1
409 . 1 1 59 59 GLY HA3 H 1 3.554 0.006 . 2 . . . . 37 G HA2 . 15246 1
410 . 1 1 59 59 GLY C C 13 171.630 0.25 . 1 . . . . 37 G C . 15246 1
411 . 1 1 59 59 GLY CA C 13 44.563 0.25 . 1 . . . . 37 G CA . 15246 1
412 . 1 1 59 59 GLY N N 15 113.745 0.20 . 1 . . . . 37 G N . 15246 1
413 . 1 1 60 60 PHE H H 1 9.138 0.006 . 1 . . . . 38 F HN . 15246 1
414 . 1 1 60 60 PHE HA H 1 5.472 0.006 . 1 . . . . 38 F HA . 15246 1
415 . 1 1 60 60 PHE HB2 H 1 2.934 0.006 . 2 . . . . 38 F HB1 . 15246 1
416 . 1 1 60 60 PHE HB3 H 1 2.934 0.006 . 2 . . . . 38 F HB2 . 15246 1
417 . 1 1 60 60 PHE HD1 H 1 7.031 0.006 . 3 . . . . 38 F HD1 . 15246 1
418 . 1 1 60 60 PHE HE1 H 1 7.180 0.006 . 3 . . . . 38 F HE1 . 15246 1
419 . 1 1 60 60 PHE C C 13 173.180 0.25 . 1 . . . . 38 F C . 15246 1
420 . 1 1 60 60 PHE CA C 13 57.234 0.25 . 1 . . . . 38 F CA . 15246 1
421 . 1 1 60 60 PHE CB C 13 43.107 0.25 . 1 . . . . 38 F CB . 15246 1
422 . 1 1 60 60 PHE N N 15 124.144 0.20 . 1 . . . . 38 F N . 15246 1
423 . 1 1 61 61 ILE H H 1 8.618 0.006 . 1 . . . . 39 I HN . 15246 1
424 . 1 1 61 61 ILE HA H 1 4.226 0.006 . 1 . . . . 39 I HA . 15246 1
425 . 1 1 61 61 ILE HB H 1 0.854 0.006 . 1 . . . . 39 I HB . 15246 1
426 . 1 1 61 61 ILE HD11 H 1 0.984 0.006 . 1 . . . . 39 I HD11 . 15246 1
427 . 1 1 61 61 ILE HD12 H 1 0.984 0.006 . 1 . . . . 39 I HD11 . 15246 1
428 . 1 1 61 61 ILE HD13 H 1 0.984 0.006 . 1 . . . . 39 I HD11 . 15246 1
429 . 1 1 61 61 ILE HG12 H 1 1.445 0.006 . 1 . . . . 39 I HG11 . 15246 1
430 . 1 1 61 61 ILE HG13 H 1 1.113 0.006 . 1 . . . . 39 I HG12 . 15246 1
431 . 1 1 61 61 ILE HG21 H 1 -0.570 0.006 . 1 . . . . 39 I HG21 . 15246 1
432 . 1 1 61 61 ILE HG22 H 1 -0.570 0.006 . 1 . . . . 39 I HG21 . 15246 1
433 . 1 1 61 61 ILE HG23 H 1 -0.570 0.006 . 1 . . . . 39 I HG21 . 15246 1
434 . 1 1 61 61 ILE C C 13 172.950 0.25 . 1 . . . . 39 I C . 15246 1
435 . 1 1 61 61 ILE CA C 13 60.357 0.25 . 1 . . . . 39 I CA . 15246 1
436 . 1 1 61 61 ILE CB C 13 41.488 0.25 . 1 . . . . 39 I CB . 15246 1
437 . 1 1 61 61 ILE CD1 C 13 17.349 0.25 . 1 . . . . 39 I CD1 . 15246 1
438 . 1 1 61 61 ILE CG1 C 13 29.274 0.25 . 1 . . . . 39 I CG1 . 15246 1
439 . 1 1 61 61 ILE CG2 C 13 19.414 0.25 . 1 . . . . 39 I CG2 . 15246 1
440 . 1 1 61 61 ILE N N 15 126.753 0.20 . 1 . . . . 39 I N . 15246 1
441 . 1 1 62 62 ASP H H 1 8.192 0.006 . 1 . . . . 40 D HN . 15246 1
442 . 1 1 62 62 ASP HA H 1 4.464 0.006 . 1 . . . . 40 D HA . 15246 1
443 . 1 1 62 62 ASP HB2 H 1 3.039 0.006 . 2 . . . . 40 D HB1 . 15246 1
444 . 1 1 62 62 ASP HB3 H 1 2.422 0.006 . 2 . . . . 40 D HB2 . 15246 1
445 . 1 1 62 62 ASP C C 13 176.240 0.25 . 1 . . . . 40 D C . 15246 1
446 . 1 1 62 62 ASP CA C 13 52.208 0.25 . 1 . . . . 40 D CA . 15246 1
447 . 1 1 62 62 ASP CB C 13 41.489 0.25 . 1 . . . . 40 D CB . 15246 1
448 . 1 1 62 62 ASP N N 15 124.314 0.20 . 1 . . . . 40 D N . 15246 1
449 . 1 1 63 63 PHE H H 1 8.165 0.006 . 1 . . . . 41 F HN . 15246 1
450 . 1 1 63 63 PHE HA H 1 4.007 0.006 . 1 . . . . 41 F HA . 15246 1
451 . 1 1 63 63 PHE HB2 H 1 2.849 0.006 . 2 . . . . 41 F HB1 . 15246 1
452 . 1 1 63 63 PHE HB3 H 1 2.417 0.006 . 2 . . . . 41 F HB2 . 15246 1
453 . 1 1 63 63 PHE HD1 H 1 5.532 0.006 . 3 . . . . 41 F HD1 . 15246 1
454 . 1 1 63 63 PHE C C 13 175.640 0.25 . 1 . . . . 41 F C . 15246 1
455 . 1 1 63 63 PHE CA C 13 58.407 0.25 . 1 . . . . 41 F CA . 15246 1
456 . 1 1 63 63 PHE CB C 13 38.486 0.25 . 1 . . . . 41 F CB . 15246 1
457 . 1 1 63 63 PHE N N 15 123.395 0.20 . 1 . . . . 41 F N . 15246 1
458 . 1 1 64 64 GLY H H 1 9.003 0.006 . 1 . . . . 42 G HN . 15246 1
459 . 1 1 64 64 GLY HA2 H 1 4.675 0.006 . 2 . . . . 42 G HA1 . 15246 1
460 . 1 1 64 64 GLY HA3 H 1 3.484 0.006 . 2 . . . . 42 G HA2 . 15246 1
461 . 1 1 64 64 GLY CA C 13 45.938 0.25 . 1 . . . . 42 G CA . 15246 1
462 . 1 1 64 64 GLY N N 15 112.196 0.20 . 1 . . . . 42 G N . 15246 1
463 . 1 1 65 65 ASP HA H 1 4.675 0.006 . 1 . . . . 43 D HA . 15246 1
464 . 1 1 65 65 ASP HB2 H 1 2.723 0.006 . 2 . . . . 43 D HB1 . 15246 1
465 . 1 1 65 65 ASP HB3 H 1 2.723 0.006 . 2 . . . . 43 D HB2 . 15246 1
466 . 1 1 65 65 ASP C C 13 176.170 0.25 . 1 . . . . 43 D C . 15246 1
467 . 1 1 65 65 ASP CA C 13 55.415 0.25 . 1 . . . . 43 D CA . 15246 1
468 . 1 1 65 65 ASP CB C 13 41.379 0.25 . 1 . . . . 43 D CB . 15246 1
469 . 1 1 66 66 SER H H 1 7.743 0.006 . 1 . . . . 44 S HN . 15246 1
470 . 1 1 66 66 SER HA H 1 5.292 0.006 . 1 . . . . 44 S HA . 15246 1
471 . 1 1 66 66 SER HB2 H 1 3.920 0.006 . 2 . . . . 44 S HB1 . 15246 1
472 . 1 1 66 66 SER HB3 H 1 3.580 0.006 . 2 . . . . 44 S HB2 . 15246 1
473 . 1 1 66 66 SER C C 13 172.190 0.25 . 1 . . . . 44 S C . 15246 1
474 . 1 1 66 66 SER CA C 13 57.890 0.25 . 1 . . . . 44 S CA . 15246 1
475 . 1 1 66 66 SER CB C 13 66.054 0.25 . 1 . . . . 44 S CB . 15246 1
476 . 1 1 66 66 SER N N 15 112.796 0.20 . 1 . . . . 44 S N . 15246 1
477 . 1 1 67 67 ASN H H 1 9.075 0.006 . 1 . . . . 45 N HN . 15246 1
478 . 1 1 67 67 ASN HA H 1 5.126 0.006 . 1 . . . . 45 N HA . 15246 1
479 . 1 1 67 67 ASN HB2 H 1 2.851 0.006 . 2 . . . . 45 N HB1 . 15246 1
480 . 1 1 67 67 ASN HB3 H 1 2.458 0.006 . 2 . . . . 45 N HB2 . 15246 1
481 . 1 1 67 67 ASN C C 13 172.300 0.25 . 1 . . . . 45 N C . 15246 1
482 . 1 1 67 67 ASN CA C 13 52.997 0.25 . 1 . . . . 45 N CA . 15246 1
483 . 1 1 67 67 ASN CB C 13 42.047 0.25 . 1 . . . . 45 N CB . 15246 1
484 . 1 1 67 67 ASN N N 15 114.955 0.20 . 1 . . . . 45 N N . 15246 1
485 . 1 1 68 68 CYS H H 1 8.757 0.006 . 1 . . . . 46 C HN . 15246 1
486 . 1 1 68 68 CYS HA H 1 5.652 0.006 . 1 . . . . 46 C HA . 15246 1
487 . 1 1 68 68 CYS HB2 H 1 2.621 0.006 . 2 . . . . 46 C HB1 . 15246 1
488 . 1 1 68 68 CYS HB3 H 1 2.621 0.006 . 2 . . . . 46 C HB2 . 15246 1
489 . 1 1 68 68 CYS C C 13 170.650 0.25 . 1 . . . . 46 C C . 15246 1
490 . 1 1 68 68 CYS CA C 13 56.668 0.25 . 1 . . . . 46 C CA . 15246 1
491 . 1 1 68 68 CYS CB C 13 31.195 0.25 . 1 . . . . 46 C CB . 15246 1
492 . 1 1 68 68 CYS N N 15 119.184 0.20 . 1 . . . . 46 C N . 15246 1
493 . 1 1 69 69 GLU H H 1 9.587 0.006 . 1 . . . . 47 E HN . 15246 1
494 . 1 1 69 69 GLU HA H 1 5.283 0.006 . 1 . . . . 47 E HA . 15246 1
495 . 1 1 69 69 GLU HB2 H 1 2.407 0.006 . 2 . . . . 47 E HB1 . 15246 1
496 . 1 1 69 69 GLU HB3 H 1 2.140 0.006 . 2 . . . . 47 E HB2 . 15246 1
497 . 1 1 69 69 GLU HG2 H 1 2.417 0.006 . 2 . . . . 47 E HG1 . 15246 1
498 . 1 1 69 69 GLU HG3 H 1 2.330 0.006 . 2 . . . . 47 E HG2 . 15246 1
499 . 1 1 69 69 GLU C C 13 174.190 0.25 . 1 . . . . 47 E C . 15246 1
500 . 1 1 69 69 GLU CA C 13 54.401 0.25 . 1 . . . . 47 E CA . 15246 1
501 . 1 1 69 69 GLU CB C 13 33.607 0.25 . 1 . . . . 47 E CB . 15246 1
502 . 1 1 69 69 GLU CG C 13 36.836 0.25 . 1 . . . . 47 E CG . 15246 1
503 . 1 1 69 69 GLU N N 15 131.612 0.20 . 1 . . . . 47 E N . 15246 1
504 . 1 1 70 70 LEU H H 1 9.523 0.006 . 1 . . . . 48 L HN . 15246 1
505 . 1 1 70 70 LEU HA H 1 5.314 0.006 . 1 . . . . 48 L HA . 15246 1
506 . 1 1 70 70 LEU HB2 H 1 1.795 0.006 . 2 . . . . 48 L HB1 . 15246 1
507 . 1 1 70 70 LEU HB3 H 1 1.296 0.006 . 2 . . . . 48 L HB2 . 15246 1
508 . 1 1 70 70 LEU HD11 H 1 0.929 0.006 . 2 . . . . 48 L HD11 . 15246 1
509 . 1 1 70 70 LEU HD12 H 1 0.929 0.006 . 2 . . . . 48 L HD11 . 15246 1
510 . 1 1 70 70 LEU HD13 H 1 0.929 0.006 . 2 . . . . 48 L HD11 . 15246 1
511 . 1 1 70 70 LEU HD21 H 1 0.929 0.006 . 2 . . . . 48 L HD21 . 15246 1
512 . 1 1 70 70 LEU HD22 H 1 0.929 0.006 . 2 . . . . 48 L HD21 . 15246 1
513 . 1 1 70 70 LEU HD23 H 1 0.929 0.006 . 2 . . . . 48 L HD21 . 15246 1
514 . 1 1 70 70 LEU HG H 1 1.030 0.006 . 1 . . . . 48 L HG . 15246 1
515 . 1 1 70 70 LEU C C 13 174.730 0.25 . 1 . . . . 48 L C . 15246 1
516 . 1 1 70 70 LEU CA C 13 53.570 0.25 . 1 . . . . 48 L CA . 15246 1
517 . 1 1 70 70 LEU CB C 13 46.109 0.25 . 1 . . . . 48 L CB . 15246 1
518 . 1 1 70 70 LEU CD1 C 13 26.430 0.25 . 1 . . . . 48 L CD1 . 15246 1
519 . 1 1 70 70 LEU CD2 C 13 26.430 0.25 . 1 . . . . 48 L CD2 . 15246 1
520 . 1 1 70 70 LEU CG C 13 28.518 0.25 . 1 . . . . 48 L CG . 15246 1
521 . 1 1 70 70 LEU N N 15 125.069 0.20 . 1 . . . . 48 L N . 15246 1
522 . 1 1 71 71 LEU H H 1 9.493 0.006 . 1 . . . . 49 L HN . 15246 1
523 . 1 1 71 71 LEU HA H 1 5.001 0.006 . 1 . . . . 49 L HA . 15246 1
524 . 1 1 71 71 LEU HB2 H 1 1.962 0.006 . 2 . . . . 49 L HB1 . 15246 1
525 . 1 1 71 71 LEU HB3 H 1 1.504 0.006 . 2 . . . . 49 L HB2 . 15246 1
526 . 1 1 71 71 LEU HD11 H 1 1.029 0.006 . 2 . . . . 49 L HD11 . 15246 1
527 . 1 1 71 71 LEU HD12 H 1 1.029 0.006 . 2 . . . . 49 L HD11 . 15246 1
528 . 1 1 71 71 LEU HD13 H 1 1.029 0.006 . 2 . . . . 49 L HD11 . 15246 1
529 . 1 1 71 71 LEU HD21 H 1 1.029 0.006 . 2 . . . . 49 L HD21 . 15246 1
530 . 1 1 71 71 LEU HD22 H 1 1.029 0.006 . 2 . . . . 49 L HD21 . 15246 1
531 . 1 1 71 71 LEU HD23 H 1 1.029 0.006 . 2 . . . . 49 L HD21 . 15246 1
532 . 1 1 71 71 LEU HG H 1 1.705 0.006 . 1 . . . . 49 L HG . 15246 1
533 . 1 1 71 71 LEU C C 13 175.310 0.25 . 1 . . . . 49 L C . 15246 1
534 . 1 1 71 71 LEU CA C 13 53.809 0.25 . 1 . . . . 49 L CA . 15246 1
535 . 1 1 71 71 LEU CB C 13 42.880 0.25 . 1 . . . . 49 L CB . 15246 1
536 . 1 1 71 71 LEU CD1 C 13 25.270 0.25 . 1 . . . . 49 L CD1 . 15246 1
537 . 1 1 71 71 LEU CD2 C 13 25.270 0.25 . 1 . . . . 49 L CD2 . 15246 1
538 . 1 1 71 71 LEU CG C 13 27.643 0.25 . 1 . . . . 49 L CG . 15246 1
539 . 1 1 71 71 LEU N N 15 123.714 0.20 . 1 . . . . 49 L N . 15246 1
540 . 1 1 72 72 ALA H H 1 8.255 0.006 . 1 . . . . 50 A HN . 15246 1
541 . 1 1 72 72 ALA HA H 1 4.307 0.006 . 1 . . . . 50 A HA . 15246 1
542 . 1 1 72 72 ALA HB1 H 1 1.117 0.006 . 1 . . . . 50 A HB1 . 15246 1
543 . 1 1 72 72 ALA HB2 H 1 1.117 0.006 . 1 . . . . 50 A HB1 . 15246 1
544 . 1 1 72 72 ALA HB3 H 1 1.117 0.006 . 1 . . . . 50 A HB1 . 15246 1
545 . 1 1 72 72 ALA C C 13 174.800 0.25 . 1 . . . . 50 A C . 15246 1
546 . 1 1 72 72 ALA CA C 13 51.618 0.25 . 1 . . . . 50 A CA . 15246 1
547 . 1 1 72 72 ALA CB C 13 18.634 0.25 . 1 . . . . 50 A CB . 15246 1
548 . 1 1 72 72 ALA N N 15 125.398 0.20 . 1 . . . . 50 A N . 15246 1
549 . 1 1 73 73 HIS H H 1 8.053 0.006 . 1 . . . . 51 H HN . 15246 1
550 . 1 1 73 73 HIS HA H 1 4.953 0.006 . 1 . . . . 51 H HA . 15246 1
551 . 1 1 73 73 HIS HB2 H 1 3.074 0.006 . 2 . . . . 51 H HB1 . 15246 1
552 . 1 1 73 73 HIS HB3 H 1 2.239 0.006 . 2 . . . . 51 H HB2 . 15246 1
553 . 1 1 73 73 HIS HD2 H 1 6.485 0.006 . 1 . . . . 51 H HD2 . 15246 1
554 . 1 1 73 73 HIS CA C 13 54.682 0.25 . 1 . . . . 51 H CA . 15246 1
555 . 1 1 73 73 HIS CB C 13 31.150 0.25 . 1 . . . . 51 H CB . 15246 1
556 . 1 1 73 73 HIS N N 15 123.172 0.20 . 1 . . . . 51 H N . 15246 1
557 . 1 1 74 74 PRO HA H 1 4.385 0.006 . 1 . . . . 52 P HA . 15246 1
558 . 1 1 74 74 PRO HB2 H 1 1.977 0.006 . 2 . . . . 52 P HB1 . 15246 1
559 . 1 1 74 74 PRO HB3 H 1 2.535 0.006 . 2 . . . . 52 P HB2 . 15246 1
560 . 1 1 74 74 PRO HD2 H 1 4.000 0.006 . 2 . . . . 52 P HD1 . 15246 1
561 . 1 1 74 74 PRO HD3 H 1 3.835 0.006 . 2 . . . . 52 P HD2 . 15246 1
562 . 1 1 74 74 PRO HG2 H 1 2.213 0.006 . 2 . . . . 52 P HG1 . 15246 1
563 . 1 1 74 74 PRO HG3 H 1 2.097 0.006 . 2 . . . . 52 P HG2 . 15246 1
564 . 1 1 74 74 PRO C C 13 176.370 0.25 . 1 . . . . 52 P C . 15246 1
565 . 1 1 74 74 PRO CA C 13 65.625 0.25 . 1 . . . . 52 P CA . 15246 1
566 . 1 1 74 74 PRO CB C 13 32.014 0.25 . 1 . . . . 52 P CB . 15246 1
567 . 1 1 74 74 PRO CD C 13 51.109 0.25 . 1 . . . . 52 P CD . 15246 1
568 . 1 1 74 74 PRO CG C 13 28.037 0.25 . 1 . . . . 52 P CG . 15246 1
569 . 1 1 75 75 ASP H H 1 8.303 0.006 . 1 . . . . 53 D HN . 15246 1
570 . 1 1 75 75 ASP HA H 1 4.955 0.006 . 1 . . . . 53 D HA . 15246 1
571 . 1 1 75 75 ASP HB2 H 1 3.136 0.006 . 2 . . . . 53 D HB1 . 15246 1
572 . 1 1 75 75 ASP HB3 H 1 2.695 0.006 . 2 . . . . 53 D HB2 . 15246 1
573 . 1 1 75 75 ASP C C 13 177.380 0.25 . 1 . . . . 53 D C . 15246 1
574 . 1 1 75 75 ASP CA C 13 52.034 0.25 . 1 . . . . 53 D CA . 15246 1
575 . 1 1 75 75 ASP CB C 13 41.826 0.25 . 1 . . . . 53 D CB . 15246 1
576 . 1 1 75 75 ASP N N 15 109.961 0.20 . 1 . . . . 53 D N . 15246 1
577 . 1 1 76 76 HIS H H 1 7.379 0.006 . 1 . . . . 54 H HN . 15246 1
578 . 1 1 76 76 HIS HA H 1 5.421 0.006 . 1 . . . . 54 H HA . 15246 1
579 . 1 1 76 76 HIS HB2 H 1 3.222 0.006 . 2 . . . . 54 H HB1 . 15246 1
580 . 1 1 76 76 HIS HB3 H 1 2.469 0.006 . 2 . . . . 54 H HB2 . 15246 1
581 . 1 1 76 76 HIS HD2 H 1 5.929 0.006 . 1 . . . . 54 H HD2 . 15246 1
582 . 1 1 76 76 HIS C C 13 172.470 0.25 . 1 . . . . 54 H C . 15246 1
583 . 1 1 76 76 HIS CA C 13 56.943 0.25 . 1 . . . . 54 H CA . 15246 1
584 . 1 1 76 76 HIS CB C 13 29.909 0.25 . 1 . . . . 54 H CB . 15246 1
585 . 1 1 76 76 HIS N N 15 114.752 0.20 . 1 . . . . 54 H N . 15246 1
586 . 1 1 77 77 VAL H H 1 8.933 0.006 . 1 . . . . 55 V HN . 15246 1
587 . 1 1 77 77 VAL HA H 1 4.837 0.006 . 1 . . . . 55 V HA . 15246 1
588 . 1 1 77 77 VAL HB H 1 1.927 0.006 . 1 . . . . 55 V HB . 15246 1
589 . 1 1 77 77 VAL HG11 H 1 0.901 0.006 . 2 . . . . 55 V HG11 . 15246 1
590 . 1 1 77 77 VAL HG12 H 1 0.901 0.006 . 2 . . . . 55 V HG11 . 15246 1
591 . 1 1 77 77 VAL HG13 H 1 0.901 0.006 . 2 . . . . 55 V HG11 . 15246 1
592 . 1 1 77 77 VAL HG21 H 1 0.901 0.006 . 2 . . . . 55 V HG21 . 15246 1
593 . 1 1 77 77 VAL HG22 H 1 0.901 0.006 . 2 . . . . 55 V HG21 . 15246 1
594 . 1 1 77 77 VAL HG23 H 1 0.901 0.006 . 2 . . . . 55 V HG21 . 15246 1
595 . 1 1 77 77 VAL C C 13 173.420 0.25 . 1 . . . . 55 V C . 15246 1
596 . 1 1 77 77 VAL CA C 13 59.429 0.25 . 1 . . . . 55 V CA . 15246 1
597 . 1 1 77 77 VAL CB C 13 35.121 0.25 . 1 . . . . 55 V CB . 15246 1
598 . 1 1 77 77 VAL CG1 C 13 22.098 0.25 . 1 . . . . 55 V CG1 . 15246 1
599 . 1 1 77 77 VAL CG2 C 13 22.098 0.25 . 1 . . . . 55 V CG2 . 15246 1
600 . 1 1 77 77 VAL N N 15 117.287 0.20 . 1 . . . . 55 V N . 15246 1
601 . 1 1 78 78 LEU H H 1 9.004 0.006 . 1 . . . . 56 L HN . 15246 1
602 . 1 1 78 78 LEU HA H 1 5.466 0.006 . 1 . . . . 56 L HA . 15246 1
603 . 1 1 78 78 LEU HB2 H 1 2.138 0.006 . 2 . . . . 56 L HB1 . 15246 1
604 . 1 1 78 78 LEU HB3 H 1 1.602 0.006 . 2 . . . . 56 L HB2 . 15246 1
605 . 1 1 78 78 LEU HD11 H 1 0.874 0.006 . 2 . . . . 56 L HD11 . 15246 1
606 . 1 1 78 78 LEU HD12 H 1 0.874 0.006 . 2 . . . . 56 L HD11 . 15246 1
607 . 1 1 78 78 LEU HD13 H 1 0.874 0.006 . 2 . . . . 56 L HD11 . 15246 1
608 . 1 1 78 78 LEU HD21 H 1 0.874 0.006 . 2 . . . . 56 L HD21 . 15246 1
609 . 1 1 78 78 LEU HD22 H 1 0.874 0.006 . 2 . . . . 56 L HD21 . 15246 1
610 . 1 1 78 78 LEU HD23 H 1 0.874 0.006 . 2 . . . . 56 L HD21 . 15246 1
611 . 1 1 78 78 LEU HG H 1 1.095 0.006 . 1 . . . . 56 L HG . 15246 1
612 . 1 1 78 78 LEU C C 13 175.140 0.25 . 1 . . . . 56 L C . 15246 1
613 . 1 1 78 78 LEU CA C 13 53.084 0.25 . 1 . . . . 56 L CA . 15246 1
614 . 1 1 78 78 LEU CB C 13 44.499 0.25 . 1 . . . . 56 L CB . 15246 1
615 . 1 1 78 78 LEU CD1 C 13 22.767 0.25 . 1 . . . . 56 L CD1 . 15246 1
616 . 1 1 78 78 LEU CD2 C 13 22.767 0.25 . 1 . . . . 56 L CD2 . 15246 1
617 . 1 1 78 78 LEU CG C 13 26.172 0.25 . 1 . . . . 56 L CG . 15246 1
618 . 1 1 78 78 LEU N N 15 130.334 0.20 . 1 . . . . 56 L N . 15246 1
619 . 1 1 79 79 MET H H 1 9.381 0.006 . 1 . . . . 57 M HN . 15246 1
620 . 1 1 79 79 MET HA H 1 5.678 0.006 . 1 . . . . 57 M HA . 15246 1
621 . 1 1 79 79 MET HB2 H 1 2.188 0.006 . 2 . . . . 57 M HB1 . 15246 1
622 . 1 1 79 79 MET HB3 H 1 1.759 0.006 . 2 . . . . 57 M HB2 . 15246 1
623 . 1 1 79 79 MET HG2 H 1 2.356 0.006 . 2 . . . . 57 M HG1 . 15246 1
624 . 1 1 79 79 MET HG3 H 1 2.166 0.006 . 2 . . . . 57 M HG2 . 15246 1
625 . 1 1 79 79 MET C C 13 175.160 0.25 . 1 . . . . 57 M C . 15246 1
626 . 1 1 79 79 MET CA C 13 54.216 0.25 . 1 . . . . 57 M CA . 15246 1
627 . 1 1 79 79 MET CB C 13 37.309 0.25 . 1 . . . . 57 M CB . 15246 1
628 . 1 1 79 79 MET CG C 13 32.374 0.25 . 1 . . . . 57 M CG . 15246 1
629 . 1 1 79 79 MET N N 15 124.304 0.20 . 1 . . . . 57 M N . 15246 1
630 . 1 1 80 80 ILE H H 1 9.552 0.006 . 1 . . . . 58 I HN . 15246 1
631 . 1 1 80 80 ILE HA H 1 4.957 0.006 . 1 . . . . 58 I HA . 15246 1
632 . 1 1 80 80 ILE HB H 1 2.072 0.006 . 1 . . . . 58 I HB . 15246 1
633 . 1 1 80 80 ILE HD11 H 1 0.947 0.006 . 1 . . . . 58 I HD11 . 15246 1
634 . 1 1 80 80 ILE HD12 H 1 0.947 0.006 . 1 . . . . 58 I HD11 . 15246 1
635 . 1 1 80 80 ILE HD13 H 1 0.947 0.006 . 1 . . . . 58 I HD11 . 15246 1
636 . 1 1 80 80 ILE HG12 H 1 1.567 0.006 . 1 . . . . 58 I HG11 . 15246 1
637 . 1 1 80 80 ILE HG13 H 1 1.098 0.006 . 1 . . . . 58 I HG12 . 15246 1
638 . 1 1 80 80 ILE HG21 H 1 0.963 0.006 . 1 . . . . 58 I HG21 . 15246 1
639 . 1 1 80 80 ILE HG22 H 1 0.963 0.006 . 1 . . . . 58 I HG21 . 15246 1
640 . 1 1 80 80 ILE HG23 H 1 0.963 0.006 . 1 . . . . 58 I HG21 . 15246 1
641 . 1 1 80 80 ILE C C 13 175.160 0.25 . 1 . . . . 58 I C . 15246 1
642 . 1 1 80 80 ILE CA C 13 61.338 0.25 . 1 . . . . 58 I CA . 15246 1
643 . 1 1 80 80 ILE CB C 13 41.092 0.25 . 1 . . . . 58 I CB . 15246 1
644 . 1 1 80 80 ILE CD1 C 13 14.599 0.25 . 1 . . . . 58 I CD1 . 15246 1
645 . 1 1 80 80 ILE CG1 C 13 27.529 0.25 . 1 . . . . 58 I CG1 . 15246 1
646 . 1 1 80 80 ILE CG2 C 13 18.353 0.25 . 1 . . . . 58 I CG2 . 15246 1
647 . 1 1 80 80 ILE N N 15 122.359 0.20 . 1 . . . . 58 I N . 15246 1
648 . 1 1 81 81 LEU H H 1 9.549 0.006 . 1 . . . . 59 L HN . 15246 1
649 . 1 1 81 81 LEU HA H 1 5.274 0.006 . 1 . . . . 59 L HA . 15246 1
650 . 1 1 81 81 LEU HB2 H 1 1.545 0.006 . 2 . . . . 59 L HB1 . 15246 1
651 . 1 1 81 81 LEU HB3 H 1 1.478 0.006 . 2 . . . . 59 L HB2 . 15246 1
652 . 1 1 81 81 LEU HD11 H 1 0.431 0.006 . 2 . . . . 59 L HD11 . 15246 1
653 . 1 1 81 81 LEU HD12 H 1 0.431 0.006 . 2 . . . . 59 L HD11 . 15246 1
654 . 1 1 81 81 LEU HD13 H 1 0.431 0.006 . 2 . . . . 59 L HD11 . 15246 1
655 . 1 1 81 81 LEU HD21 H 1 0.431 0.006 . 2 . . . . 59 L HD21 . 15246 1
656 . 1 1 81 81 LEU HD22 H 1 0.431 0.006 . 2 . . . . 59 L HD21 . 15246 1
657 . 1 1 81 81 LEU HD23 H 1 0.431 0.006 . 2 . . . . 59 L HD21 . 15246 1
658 . 1 1 81 81 LEU HG H 1 0.508 0.006 . 1 . . . . 59 L HG . 15246 1
659 . 1 1 81 81 LEU C C 13 174.280 0.25 . 1 . . . . 59 L C . 15246 1
660 . 1 1 81 81 LEU CA C 13 53.621 0.25 . 1 . . . . 59 L CA . 15246 1
661 . 1 1 81 81 LEU CB C 13 46.837 0.25 . 1 . . . . 59 L CB . 15246 1
662 . 1 1 81 81 LEU CD1 C 13 24.474 0.25 . 1 . . . . 59 L CD1 . 15246 1
663 . 1 1 81 81 LEU CD2 C 13 24.474 0.25 . 1 . . . . 59 L CD2 . 15246 1
664 . 1 1 81 81 LEU CG C 13 26.110 0.25 . 1 . . . . 59 L CG . 15246 1
665 . 1 1 81 81 LEU N N 15 131.901 0.20 . 1 . . . . 59 L N . 15246 1
666 . 1 1 82 82 ASN H H 1 8.516 0.006 . 1 . . . . 60 N HN . 15246 1
667 . 1 1 82 82 ASN HA H 1 5.851 0.006 . 1 . . . . 60 N HA . 15246 1
668 . 1 1 82 82 ASN HB2 H 1 2.777 0.006 . 2 . . . . 60 N HB1 . 15246 1
669 . 1 1 82 82 ASN HB3 H 1 2.384 0.006 . 2 . . . . 60 N HB2 . 15246 1
670 . 1 1 82 82 ASN C C 13 174.840 0.25 . 1 . . . . 60 N C . 15246 1
671 . 1 1 82 82 ASN CA C 13 52.549 0.25 . 1 . . . . 60 N CA . 15246 1
672 . 1 1 82 82 ASN CB C 13 43.188 0.25 . 1 . . . . 60 N CB . 15246 1
673 . 1 1 82 82 ASN N N 15 120.142 0.20 . 1 . . . . 60 N N . 15246 1
674 . 1 1 83 83 SER H H 1 9.176 0.006 . 1 . . . . 61 S HN . 15246 1
675 . 1 1 83 83 SER HA H 1 5.295 0.006 . 1 . . . . 61 S HA . 15246 1
676 . 1 1 83 83 SER HB2 H 1 3.824 0.006 . 2 . . . . 61 S HB1 . 15246 1
677 . 1 1 83 83 SER HB3 H 1 3.387 0.006 . 2 . . . . 61 S HB2 . 15246 1
678 . 1 1 83 83 SER CA C 13 57.388 0.25 . 1 . . . . 61 S CA . 15246 1
679 . 1 1 83 83 SER CB C 13 68.052 0.25 . 1 . . . . 61 S CB . 15246 1
680 . 1 1 83 83 SER N N 15 116.871 0.20 . 1 . . . . 61 S N . 15246 1
681 . 1 1 84 84 PRO HA H 1 4.907 0.006 . 1 . . . . 62 P HA . 15246 1
682 . 1 1 84 84 PRO HB2 H 1 2.371 0.006 . 2 . . . . 62 P HB1 . 15246 1
683 . 1 1 84 84 PRO HB3 H 1 2.162 0.006 . 2 . . . . 62 P HB2 . 15246 1
684 . 1 1 84 84 PRO HD2 H 1 3.830 0.006 . 2 . . . . 62 P HD1 . 15246 1
685 . 1 1 84 84 PRO HD3 H 1 3.691 0.006 . 2 . . . . 62 P HD2 . 15246 1
686 . 1 1 84 84 PRO HG2 H 1 2.055 0.006 . 2 . . . . 62 P HG1 . 15246 1
687 . 1 1 84 84 PRO HG3 H 1 2.013 0.006 . 2 . . . . 62 P HG2 . 15246 1
688 . 1 1 84 84 PRO C C 13 175.210 0.25 . 1 . . . . 62 P C . 15246 1
689 . 1 1 84 84 PRO CA C 13 64.539 0.25 . 1 . . . . 62 P CA . 15246 1
690 . 1 1 84 84 PRO CB C 13 32.726 0.25 . 1 . . . . 62 P CB . 15246 1
691 . 1 1 84 84 PRO CD C 13 51.173 0.25 . 1 . . . . 62 P CD . 15246 1
692 . 1 1 84 84 PRO CG C 13 27.495 0.25 . 1 . . . . 62 P CG . 15246 1
693 . 1 1 85 85 ASP H H 1 7.228 0.006 . 1 . . . . 63 D HN . 15246 1
694 . 1 1 85 85 ASP HA H 1 4.630 0.006 . 1 . . . . 63 D HA . 15246 1
695 . 1 1 85 85 ASP HB2 H 1 2.825 0.006 . 2 . . . . 63 D HB1 . 15246 1
696 . 1 1 85 85 ASP HB3 H 1 2.825 0.006 . 2 . . . . 63 D HB2 . 15246 1
697 . 1 1 85 85 ASP C C 13 174.540 0.25 . 1 . . . . 63 D C . 15246 1
698 . 1 1 85 85 ASP CA C 13 53.119 0.25 . 1 . . . . 63 D CA . 15246 1
699 . 1 1 85 85 ASP CB C 13 42.880 0.25 . 1 . . . . 63 D CB . 15246 1
700 . 1 1 85 85 ASP N N 15 112.313 0.20 . 1 . . . . 63 D N . 15246 1
701 . 1 1 86 86 GLU H H 1 8.761 0.006 . 1 . . . . 64 E HN . 15246 1
702 . 1 1 86 86 GLU HA H 1 3.321 0.006 . 1 . . . . 64 E HA . 15246 1
703 . 1 1 86 86 GLU HB2 H 1 1.750 0.006 . 2 . . . . 64 E HB1 . 15246 1
704 . 1 1 86 86 GLU HB3 H 1 1.637 0.006 . 2 . . . . 64 E HB2 . 15246 1
705 . 1 1 86 86 GLU HG2 H 1 1.762 0.006 . 2 . . . . 64 E HG1 . 15246 1
706 . 1 1 86 86 GLU HG3 H 1 1.513 0.006 . 2 . . . . 64 E HG2 . 15246 1
707 . 1 1 86 86 GLU C C 13 178.440 0.25 . 1 . . . . 64 E C . 15246 1
708 . 1 1 86 86 GLU CA C 13 59.937 0.25 . 1 . . . . 64 E CA . 15246 1
709 . 1 1 86 86 GLU CB C 13 29.707 0.25 . 1 . . . . 64 E CB . 15246 1
710 . 1 1 86 86 GLU CG C 13 37.096 0.25 . 1 . . . . 64 E CG . 15246 1
711 . 1 1 86 86 GLU N N 15 120.055 0.20 . 1 . . . . 64 E N . 15246 1
712 . 1 1 87 87 ASP H H 1 8.332 0.006 . 1 . . . . 65 D HN . 15246 1
713 . 1 1 87 87 ASP HA H 1 4.414 0.006 . 1 . . . . 65 D HA . 15246 1
714 . 1 1 87 87 ASP HB2 H 1 2.582 0.006 . 2 . . . . 65 D HB1 . 15246 1
715 . 1 1 87 87 ASP HB3 H 1 2.629 0.006 . 2 . . . . 65 D HB2 . 15246 1
716 . 1 1 87 87 ASP C C 13 179.400 0.25 . 1 . . . . 65 D C . 15246 1
717 . 1 1 87 87 ASP CA C 13 57.203 0.25 . 1 . . . . 65 D CA . 15246 1
718 . 1 1 87 87 ASP CB C 13 40.323 0.25 . 1 . . . . 65 D CB . 15246 1
719 . 1 1 87 87 ASP N N 15 121.933 0.20 . 1 . . . . 65 D N . 15246 1
720 . 1 1 88 88 SER H H 1 8.949 0.006 . 1 . . . . 66 S HN . 15246 1
721 . 1 1 88 88 SER HA H 1 4.169 0.006 . 1 . . . . 66 S HA . 15246 1
722 . 1 1 88 88 SER HB2 H 1 3.776 0.006 . 2 . . . . 66 S HB1 . 15246 1
723 . 1 1 88 88 SER HB3 H 1 3.776 0.006 . 2 . . . . 66 S HB2 . 15246 1
724 . 1 1 88 88 SER C C 13 176.110 0.25 . 1 . . . . 66 S C . 15246 1
725 . 1 1 88 88 SER CA C 13 62.032 0.25 . 1 . . . . 66 S CA . 15246 1
726 . 1 1 88 88 SER CB C 13 62.178 0.25 . 1 . . . . 66 S CB . 15246 1
727 . 1 1 88 88 SER N N 15 119.726 0.20 . 1 . . . . 66 S N . 15246 1
728 . 1 1 89 89 LEU H H 1 7.737 0.006 . 1 . . . . 67 L HN . 15246 1
729 . 1 1 89 89 LEU HA H 1 4.017 0.006 . 1 . . . . 67 L HA . 15246 1
730 . 1 1 89 89 LEU HB2 H 1 1.760 0.006 . 2 . . . . 67 L HB1 . 15246 1
731 . 1 1 89 89 LEU HB3 H 1 1.298 0.006 . 2 . . . . 67 L HB2 . 15246 1
732 . 1 1 89 89 LEU HD11 H 1 0.714 0.006 . 2 . . . . 67 L HD11 . 15246 1
733 . 1 1 89 89 LEU HD12 H 1 0.714 0.006 . 2 . . . . 67 L HD11 . 15246 1
734 . 1 1 89 89 LEU HD13 H 1 0.714 0.006 . 2 . . . . 67 L HD11 . 15246 1
735 . 1 1 89 89 LEU HD21 H 1 0.714 0.006 . 2 . . . . 67 L HD21 . 15246 1
736 . 1 1 89 89 LEU HD22 H 1 0.714 0.006 . 2 . . . . 67 L HD21 . 15246 1
737 . 1 1 89 89 LEU HD23 H 1 0.714 0.006 . 2 . . . . 67 L HD21 . 15246 1
738 . 1 1 89 89 LEU HG H 1 0.767 0.006 . 1 . . . . 67 L HG . 15246 1
739 . 1 1 89 89 LEU C C 13 177.790 0.25 . 1 . . . . 67 L C . 15246 1
740 . 1 1 89 89 LEU CA C 13 57.958 0.25 . 1 . . . . 67 L CA . 15246 1
741 . 1 1 89 89 LEU CB C 13 42.394 0.25 . 1 . . . . 67 L CB . 15246 1
742 . 1 1 89 89 LEU CD1 C 13 22.655 0.25 . 1 . . . . 67 L CD1 . 15246 1
743 . 1 1 89 89 LEU CD2 C 13 22.655 0.25 . 1 . . . . 67 L CD2 . 15246 1
744 . 1 1 89 89 LEU CG C 13 26.697 0.25 . 1 . . . . 67 L CG . 15246 1
745 . 1 1 89 89 LEU N N 15 122.942 0.20 . 1 . . . . 67 L N . 15246 1
746 . 1 1 90 90 ALA H H 1 7.483 0.006 . 1 . . . . 68 A HN . 15246 1
747 . 1 1 90 90 ALA HA H 1 3.780 0.006 . 1 . . . . 68 A HA . 15246 1
748 . 1 1 90 90 ALA HB1 H 1 1.433 0.006 . 1 . . . . 68 A HB1 . 15246 1
749 . 1 1 90 90 ALA HB2 H 1 1.433 0.006 . 1 . . . . 68 A HB1 . 15246 1
750 . 1 1 90 90 ALA HB3 H 1 1.433 0.006 . 1 . . . . 68 A HB1 . 15246 1
751 . 1 1 90 90 ALA C C 13 180.410 0.25 . 1 . . . . 68 A C . 15246 1
752 . 1 1 90 90 ALA CA C 13 54.782 0.25 . 1 . . . . 68 A CA . 15246 1
753 . 1 1 90 90 ALA CB C 13 17.857 0.25 . 1 . . . . 68 A CB . 15246 1
754 . 1 1 90 90 ALA N N 15 119.446 0.20 . 1 . . . . 68 A N . 15246 1
755 . 1 1 91 91 HIS H H 1 7.707 0.006 . 1 . . . . 69 H HN . 15246 1
756 . 1 1 91 91 HIS HA H 1 4.377 0.006 . 1 . . . . 69 H HA . 15246 1
757 . 1 1 91 91 HIS HB2 H 1 3.095 0.006 . 2 . . . . 69 H HB1 . 15246 1
758 . 1 1 91 91 HIS HB3 H 1 3.095 0.006 . 2 . . . . 69 H HB2 . 15246 1
759 . 1 1 91 91 HIS HD2 H 1 6.892 0.006 . 1 . . . . 69 H HD2 . 15246 1
760 . 1 1 91 91 HIS C C 13 177.865 0.25 . 1 . . . . 69 H C . 15246 1
761 . 1 1 91 91 HIS CA C 13 59.518 0.25 . 1 . . . . 69 H CA . 15246 1
762 . 1 1 91 91 HIS CB C 13 30.954 0.25 . 1 . . . . 69 H CB . 15246 1
763 . 1 1 91 91 HIS N N 15 116.881 0.20 . 1 . . . . 69 H N . 15246 1
764 . 1 1 92 92 MET H H 1 8.467 0.006 . 1 . . . . 70 M HN . 15246 1
765 . 1 1 92 92 MET HA H 1 4.087 0.006 . 1 . . . . 70 M HA . 15246 1
766 . 1 1 92 92 MET HB2 H 1 2.003 0.006 . 2 . . . . 70 M HB1 . 15246 1
767 . 1 1 92 92 MET HB3 H 1 1.515 0.006 . 2 . . . . 70 M HB2 . 15246 1
768 . 1 1 92 92 MET HG2 H 1 2.547 0.006 . 2 . . . . 70 M HG1 . 15246 1
769 . 1 1 92 92 MET HG3 H 1 2.240 0.006 . 2 . . . . 70 M HG2 . 15246 1
770 . 1 1 92 92 MET C C 13 178.390 0.25 . 1 . . . . 70 M C . 15246 1
771 . 1 1 92 92 MET CA C 13 55.584 0.25 . 1 . . . . 70 M CA . 15246 1
772 . 1 1 92 92 MET CB C 13 29.773 0.25 . 1 . . . . 70 M CB . 15246 1
773 . 1 1 92 92 MET CG C 13 31.733 0.25 . 1 . . . . 70 M CG . 15246 1
774 . 1 1 92 92 MET N N 15 116.968 0.20 . 1 . . . . 70 M N . 15246 1
775 . 1 1 93 93 GLN H H 1 8.309 0.006 . 1 . . . . 71 Q HN . 15246 1
776 . 1 1 93 93 GLN HA H 1 2.874 0.006 . 1 . . . . 71 Q HA . 15246 1
777 . 1 1 93 93 GLN HB2 H 1 1.720 0.006 . 2 . . . . 71 Q HB1 . 15246 1
778 . 1 1 93 93 GLN HB3 H 1 0.766 0.006 . 2 . . . . 71 Q HB2 . 15246 1
779 . 1 1 93 93 GLN HG2 H 1 1.858 0.006 . 2 . . . . 71 Q HG1 . 15246 1
780 . 1 1 93 93 GLN HG3 H 1 -0.214 0.006 . 2 . . . . 71 Q HG2 . 15246 1
781 . 1 1 93 93 GLN C C 13 178.420 0.25 . 1 . . . . 71 Q C . 15246 1
782 . 1 1 93 93 GLN CA C 13 58.852 0.25 . 1 . . . . 71 Q CA . 15246 1
783 . 1 1 93 93 GLN CB C 13 27.658 0.25 . 1 . . . . 71 Q CB . 15246 1
784 . 1 1 93 93 GLN CG C 13 34.522 0.25 . 1 . . . . 71 Q CG . 15246 1
785 . 1 1 93 93 GLN N N 15 120.665 0.20 . 1 . . . . 71 Q N . 15246 1
786 . 1 1 94 94 ASN H H 1 6.899 0.006 . 1 . . . . 72 N HN . 15246 1
787 . 1 1 94 94 ASN HA H 1 4.596 0.006 . 1 . . . . 72 N HA . 15246 1
788 . 1 1 94 94 ASN HB2 H 1 3.033 0.006 . 2 . . . . 72 N HB1 . 15246 1
789 . 1 1 94 94 ASN HB3 H 1 2.888 0.006 . 2 . . . . 72 N HB2 . 15246 1
790 . 1 1 94 94 ASN C C 13 177.380 0.25 . 1 . . . . 72 N C . 15246 1
791 . 1 1 94 94 ASN CA C 13 56.037 0.25 . 1 . . . . 72 N CA . 15246 1
792 . 1 1 94 94 ASN CB C 13 38.219 0.25 . 1 . . . . 72 N CB . 15246 1
793 . 1 1 94 94 ASN N N 15 116.271 0.20 . 1 . . . . 72 N N . 15246 1
794 . 1 1 95 95 VAL H H 1 8.050 0.006 . 1 . . . . 73 V HN . 15246 1
795 . 1 1 95 95 VAL HA H 1 3.983 0.006 . 1 . . . . 73 V HA . 15246 1
796 . 1 1 95 95 VAL HB H 1 1.930 0.006 . 1 . . . . 73 V HB . 15246 1
797 . 1 1 95 95 VAL HG11 H 1 0.932 0.006 . 2 . . . . 73 V HG11 . 15246 1
798 . 1 1 95 95 VAL HG12 H 1 0.932 0.006 . 2 . . . . 73 V HG11 . 15246 1
799 . 1 1 95 95 VAL HG13 H 1 0.932 0.006 . 2 . . . . 73 V HG11 . 15246 1
800 . 1 1 95 95 VAL HG21 H 1 0.716 0.006 . 2 . . . . 73 V HG21 . 15246 1
801 . 1 1 95 95 VAL HG22 H 1 0.716 0.006 . 2 . . . . 73 V HG21 . 15246 1
802 . 1 1 95 95 VAL HG23 H 1 0.716 0.006 . 2 . . . . 73 V HG21 . 15246 1
803 . 1 1 95 95 VAL C C 13 180.050 0.25 . 1 . . . . 73 V C . 15246 1
804 . 1 1 95 95 VAL CA C 13 66.515 0.25 . 1 . . . . 73 V CA . 15246 1
805 . 1 1 95 95 VAL CB C 13 32.587 0.25 . 1 . . . . 73 V CB . 15246 1
806 . 1 1 95 95 VAL CG1 C 13 21.195 0.25 . 1 . . . . 73 V CG1 . 15246 1
807 . 1 1 95 95 VAL CG2 C 13 22.655 0.25 . 1 . . . . 73 V CG2 . 15246 1
808 . 1 1 95 95 VAL N N 15 121.798 0.20 . 1 . . . . 73 V N . 15246 1
809 . 1 1 96 96 VAL H H 1 9.082 0.006 . 1 . . . . 74 V HN . 15246 1
810 . 1 1 96 96 VAL HA H 1 3.986 0.006 . 1 . . . . 74 V HA . 15246 1
811 . 1 1 96 96 VAL HB H 1 2.423 0.006 . 1 . . . . 74 V HB . 15246 1
812 . 1 1 96 96 VAL HG11 H 1 1.375 0.006 . 2 . . . . 74 V HG11 . 15246 1
813 . 1 1 96 96 VAL HG12 H 1 1.375 0.006 . 2 . . . . 74 V HG11 . 15246 1
814 . 1 1 96 96 VAL HG13 H 1 1.375 0.006 . 2 . . . . 74 V HG11 . 15246 1
815 . 1 1 96 96 VAL HG21 H 1 1.158 0.006 . 2 . . . . 74 V HG21 . 15246 1
816 . 1 1 96 96 VAL HG22 H 1 1.158 0.006 . 2 . . . . 74 V HG21 . 15246 1
817 . 1 1 96 96 VAL HG23 H 1 1.158 0.006 . 2 . . . . 74 V HG21 . 15246 1
818 . 1 1 96 96 VAL C C 13 177.490 0.25 . 1 . . . . 74 V C . 15246 1
819 . 1 1 96 96 VAL CA C 13 67.947 0.25 . 1 . . . . 74 V CA . 15246 1
820 . 1 1 96 96 VAL CB C 13 31.966 0.25 . 1 . . . . 74 V CB . 15246 1
821 . 1 1 96 96 VAL CG1 C 13 23.032 0.25 . 1 . . . . 74 V CG1 . 15246 1
822 . 1 1 96 96 VAL CG2 C 13 23.435 0.25 . 1 . . . . 74 V CG2 . 15246 1
823 . 1 1 96 96 VAL N N 15 120.549 0.20 . 1 . . . . 74 V N . 15246 1
824 . 1 1 97 97 ALA H H 1 8.285 0.006 . 1 . . . . 75 A HN . 15246 1
825 . 1 1 97 97 ALA HA H 1 4.108 0.006 . 1 . . . . 75 A HA . 15246 1
826 . 1 1 97 97 ALA HB1 H 1 1.838 0.006 . 1 . . . . 75 A HB1 . 15246 1
827 . 1 1 97 97 ALA HB2 H 1 1.838 0.006 . 1 . . . . 75 A HB1 . 15246 1
828 . 1 1 97 97 ALA HB3 H 1 1.838 0.006 . 1 . . . . 75 A HB1 . 15246 1
829 . 1 1 97 97 ALA C C 13 179.320 0.25 . 1 . . . . 75 A C . 15246 1
830 . 1 1 97 97 ALA CA C 13 56.117 0.25 . 1 . . . . 75 A CA . 15246 1
831 . 1 1 97 97 ALA CB C 13 19.867 0.25 . 1 . . . . 75 A CB . 15246 1
832 . 1 1 97 97 ALA N N 15 120.375 0.20 . 1 . . . . 75 A N . 15246 1
833 . 1 1 98 98 ASP H H 1 8.522 0.006 . 1 . . . . 76 D HN . 15246 1
834 . 1 1 98 98 ASP HA H 1 4.356 0.006 . 1 . . . . 76 D HA . 15246 1
835 . 1 1 98 98 ASP HB2 H 1 2.964 0.006 . 2 . . . . 76 D HB1 . 15246 1
836 . 1 1 98 98 ASP HB3 H 1 2.764 0.006 . 2 . . . . 76 D HB2 . 15246 1
837 . 1 1 98 98 ASP C C 13 179.100 0.25 . 1 . . . . 76 D C . 15246 1
838 . 1 1 98 98 ASP CA C 13 57.252 0.25 . 1 . . . . 76 D CA . 15246 1
839 . 1 1 98 98 ASP CB C 13 41.335 0.25 . 1 . . . . 76 D CB . 15246 1
840 . 1 1 98 98 ASP N N 15 116.871 0.20 . 1 . . . . 76 D N . 15246 1
841 . 1 1 99 99 HIS H H 1 8.162 0.006 . 1 . . . . 77 H HN . 15246 1
842 . 1 1 99 99 HIS HA H 1 3.847 0.006 . 1 . . . . 77 H HA . 15246 1
843 . 1 1 99 99 HIS HB2 H 1 3.073 0.006 . 2 . . . . 77 H HB1 . 15246 1
844 . 1 1 99 99 HIS HB3 H 1 2.519 0.006 . 2 . . . . 77 H HB2 . 15246 1
845 . 1 1 99 99 HIS HD2 H 1 6.536 0.006 . 1 . . . . 77 H HD2 . 15246 1
846 . 1 1 99 99 HIS C C 13 177.440 0.25 . 1 . . . . 77 H C . 15246 1
847 . 1 1 99 99 HIS CA C 13 61.636 0.25 . 1 . . . . 77 H CA . 15246 1
848 . 1 1 99 99 HIS CB C 13 29.328 0.25 . 1 . . . . 77 H CB . 15246 1
849 . 1 1 99 99 HIS N N 15 116.758 0.20 . 1 . . . . 77 H N . 15246 1
850 . 1 1 100 100 LEU H H 1 8.718 0.006 . 1 . . . . 78 L HN . 15246 1
851 . 1 1 100 100 LEU HA H 1 3.862 0.006 . 1 . . . . 78 L HA . 15246 1
852 . 1 1 100 100 LEU HB2 H 1 1.883 0.006 . 2 . . . . 78 L HB1 . 15246 1
853 . 1 1 100 100 LEU HB3 H 1 1.427 0.006 . 2 . . . . 78 L HB2 . 15246 1
854 . 1 1 100 100 LEU HD11 H 1 0.706 0.006 . 2 . . . . 78 L HD11 . 15246 1
855 . 1 1 100 100 LEU HD12 H 1 0.706 0.006 . 2 . . . . 78 L HD11 . 15246 1
856 . 1 1 100 100 LEU HD13 H 1 0.706 0.006 . 2 . . . . 78 L HD11 . 15246 1
857 . 1 1 100 100 LEU HD21 H 1 0.706 0.006 . 2 . . . . 78 L HD21 . 15246 1
858 . 1 1 100 100 LEU HD22 H 1 0.706 0.006 . 2 . . . . 78 L HD21 . 15246 1
859 . 1 1 100 100 LEU HD23 H 1 0.706 0.006 . 2 . . . . 78 L HD21 . 15246 1
860 . 1 1 100 100 LEU HG H 1 0.891 0.006 . 1 . . . . 78 L HG . 15246 1
861 . 1 1 100 100 LEU C C 13 177.720 0.25 . 1 . . . . 78 L C . 15246 1
862 . 1 1 100 100 LEU CA C 13 58.746 0.25 . 1 . . . . 78 L CA . 15246 1
863 . 1 1 100 100 LEU CB C 13 40.324 0.25 . 1 . . . . 78 L CB . 15246 1
864 . 1 1 100 100 LEU CD1 C 13 22.791 0.25 . 1 . . . . 78 L CD1 . 15246 1
865 . 1 1 100 100 LEU CD2 C 13 22.791 0.25 . 1 . . . . 78 L CD2 . 15246 1
866 . 1 1 100 100 LEU CG C 13 26.211 0.25 . 1 . . . . 78 L CG . 15246 1
867 . 1 1 100 100 LEU N N 15 120.332 0.20 . 1 . . . . 78 L N . 15246 1
868 . 1 1 101 101 GLN H H 1 8.167 0.006 . 1 . . . . 79 Q HN . 15246 1
869 . 1 1 101 101 GLN HA H 1 3.973 0.006 . 1 . . . . 79 Q HA . 15246 1
870 . 1 1 101 101 GLN HB2 H 1 2.263 0.006 . 2 . . . . 79 Q HB1 . 15246 1
871 . 1 1 101 101 GLN HB3 H 1 2.093 0.006 . 2 . . . . 79 Q HB2 . 15246 1
872 . 1 1 101 101 GLN HG2 H 1 2.451 0.006 . 2 . . . . 79 Q HG1 . 15246 1
873 . 1 1 101 101 GLN HG3 H 1 2.311 0.006 . 2 . . . . 79 Q HG2 . 15246 1
874 . 1 1 101 101 GLN C C 13 178.990 0.25 . 1 . . . . 79 Q C . 15246 1
875 . 1 1 101 101 GLN CA C 13 58.359 0.25 . 1 . . . . 79 Q CA . 15246 1
876 . 1 1 101 101 GLN CB C 13 29.575 0.25 . 1 . . . . 79 Q CB . 15246 1
877 . 1 1 101 101 GLN CG C 13 34.482 0.25 . 1 . . . . 79 Q CG . 15246 1
878 . 1 1 101 101 GLN N N 15 115.715 0.20 . 1 . . . . 79 Q N . 15246 1
879 . 1 1 102 102 ARG H H 1 7.835 0.006 . 1 . . . . 80 R HN . 15246 1
880 . 1 1 102 102 ARG HA H 1 3.990 0.006 . 1 . . . . 80 R HA . 15246 1
881 . 1 1 102 102 ARG HB2 H 1 1.770 0.006 . 2 . . . . 80 R HB1 . 15246 1
882 . 1 1 102 102 ARG HB3 H 1 1.770 0.006 . 2 . . . . 80 R HB2 . 15246 1
883 . 1 1 102 102 ARG HD2 H 1 3.001 0.006 . 2 . . . . 80 R HD1 . 15246 1
884 . 1 1 102 102 ARG HD3 H 1 2.831 0.006 . 2 . . . . 80 R HD2 . 15246 1
885 . 1 1 102 102 ARG HG2 H 1 1.718 0.006 . 2 . . . . 80 R HG1 . 15246 1
886 . 1 1 102 102 ARG HG3 H 1 1.516 0.006 . 2 . . . . 80 R HG2 . 15246 1
887 . 1 1 102 102 ARG C C 13 178.540 0.25 . 1 . . . . 80 R C . 15246 1
888 . 1 1 102 102 ARG CA C 13 58.789 0.25 . 1 . . . . 80 R CA . 15246 1
889 . 1 1 102 102 ARG CB C 13 30.218 0.25 . 1 . . . . 80 R CB . 15246 1
890 . 1 1 102 102 ARG CD C 13 43.638 0.25 . 1 . . . . 80 R CD . 15246 1
891 . 1 1 102 102 ARG CG C 13 27.699 0.25 . 1 . . . . 80 R CG . 15246 1
892 . 1 1 102 102 ARG N N 15 118.207 0.20 . 1 . . . . 80 R N . 15246 1
893 . 1 1 103 103 MET H H 1 7.645 0.006 . 1 . . . . 81 M HN . 15246 1
894 . 1 1 103 103 MET HA H 1 4.353 0.006 . 1 . . . . 81 M HA . 15246 1
895 . 1 1 103 103 MET HB2 H 1 2.103 0.006 . 2 . . . . 81 M HB1 . 15246 1
896 . 1 1 103 103 MET HB3 H 1 1.822 0.006 . 2 . . . . 81 M HB2 . 15246 1
897 . 1 1 103 103 MET HG2 H 1 2.841 0.006 . 2 . . . . 81 M HG1 . 15246 1
898 . 1 1 103 103 MET HG3 H 1 2.435 0.006 . 2 . . . . 81 M HG2 . 15246 1
899 . 1 1 103 103 MET C C 13 176.300 0.25 . 1 . . . . 81 M C . 15246 1
900 . 1 1 103 103 MET CA C 13 55.646 0.25 . 1 . . . . 81 M CA . 15246 1
901 . 1 1 103 103 MET CB C 13 32.620 0.25 . 1 . . . . 81 M CB . 15246 1
902 . 1 1 103 103 MET CG C 13 32.864 0.25 . 1 . . . . 81 M CG . 15246 1
903 . 1 1 103 103 MET N N 15 116.250 0.20 . 1 . . . . 81 M N . 15246 1
904 . 1 1 104 104 ALA H H 1 7.324 0.006 . 1 . . . . 82 A HN . 15246 1
905 . 1 1 104 104 ALA HA H 1 4.386 0.006 . 1 . . . . 82 A HA . 15246 1
906 . 1 1 104 104 ALA HB1 H 1 0.913 0.006 . 1 . . . . 82 A HB1 . 15246 1
907 . 1 1 104 104 ALA HB2 H 1 0.913 0.006 . 1 . . . . 82 A HB1 . 15246 1
908 . 1 1 104 104 ALA HB3 H 1 0.913 0.006 . 1 . . . . 82 A HB1 . 15246 1
909 . 1 1 104 104 ALA CA C 13 51.004 0.25 . 1 . . . . 82 A CA . 15246 1
910 . 1 1 104 104 ALA CB C 13 17.678 0.25 . 1 . . . . 82 A CB . 15246 1
911 . 1 1 104 104 ALA N N 15 123.602 0.20 . 1 . . . . 82 A N . 15246 1
912 . 1 1 106 106 SER HA H 1 4.610 0.006 . 1 . . . . 84 S HA . 15246 1
913 . 1 1 106 106 SER HB2 H 1 4.050 0.006 . 2 . . . . 84 S HB1 . 15246 1
914 . 1 1 106 106 SER HB3 H 1 3.895 0.006 . 2 . . . . 84 S HB2 . 15246 1
915 . 1 1 106 106 SER C C 13 173.480 0.25 . 1 . . . . 84 S C . 15246 1
916 . 1 1 106 106 SER CA C 13 58.041 0.25 . 1 . . . . 84 S CA . 15246 1
917 . 1 1 106 106 SER CB C 13 64.139 0.25 . 1 . . . . 84 S CB . 15246 1
918 . 1 1 107 107 GLU H H 1 7.443 0.006 . 1 . . . . 85 E HN . 15246 1
919 . 1 1 107 107 GLU HA H 1 4.640 0.006 . 1 . . . . 85 E HA . 15246 1
920 . 1 1 107 107 GLU HB2 H 1 1.958 0.006 . 2 . . . . 85 E HB1 . 15246 1
921 . 1 1 107 107 GLU HB3 H 1 1.958 0.006 . 2 . . . . 85 E HB2 . 15246 1
922 . 1 1 107 107 GLU HG2 H 1 2.176 0.006 . 2 . . . . 85 E HG1 . 15246 1
923 . 1 1 107 107 GLU HG3 H 1 2.176 0.006 . 2 . . . . 85 E HG2 . 15246 1
924 . 1 1 107 107 GLU CA C 13 55.058 0.25 . 1 . . . . 85 E CA . 15246 1
925 . 1 1 107 107 GLU CB C 13 32.203 0.25 . 1 . . . . 85 E CB . 15246 1
926 . 1 1 107 107 GLU CG C 13 35.322 0.25 . 1 . . . . 85 E CG . 15246 1
927 . 1 1 107 107 GLU N N 15 119.316 0.20 . 1 . . . . 85 E N . 15246 1
928 . 1 1 108 108 SER HA H 1 4.549 0.006 . 1 . . . . 86 S HA . 15246 1
929 . 1 1 108 108 SER HB2 H 1 3.892 0.006 . 2 . . . . 86 S HB1 . 15246 1
930 . 1 1 108 108 SER HB3 H 1 3.775 0.006 . 2 . . . . 86 S HB2 . 15246 1
931 . 1 1 108 108 SER C C 13 174.220 0.25 . 1 . . . . 86 S C . 15246 1
932 . 1 1 108 108 SER CA C 13 57.291 0.25 . 1 . . . . 86 S CA . 15246 1
933 . 1 1 108 108 SER CB C 13 62.819 0.25 . 1 . . . . 86 S CB . 15246 1
934 . 1 1 109 109 LEU H H 1 9.011 0.006 . 1 . . . . 87 L HN . 15246 1
935 . 1 1 109 109 LEU HA H 1 4.606 0.006 . 1 . . . . 87 L HA . 15246 1
936 . 1 1 109 109 LEU HB2 H 1 1.581 0.006 . 2 . . . . 87 L HB1 . 15246 1
937 . 1 1 109 109 LEU HB3 H 1 1.007 0.006 . 2 . . . . 87 L HB2 . 15246 1
938 . 1 1 109 109 LEU HD11 H 1 0.814 0.006 . 2 . . . . 87 L HD11 . 15246 1
939 . 1 1 109 109 LEU HD12 H 1 0.814 0.006 . 2 . . . . 87 L HD11 . 15246 1
940 . 1 1 109 109 LEU HD13 H 1 0.814 0.006 . 2 . . . . 87 L HD11 . 15246 1
941 . 1 1 109 109 LEU HD21 H 1 0.814 0.006 . 2 . . . . 87 L HD21 . 15246 1
942 . 1 1 109 109 LEU HD22 H 1 0.814 0.006 . 2 . . . . 87 L HD21 . 15246 1
943 . 1 1 109 109 LEU HD23 H 1 0.814 0.006 . 2 . . . . 87 L HD21 . 15246 1
944 . 1 1 109 109 LEU HG H 1 0.511 0.006 . 1 . . . . 87 L HG . 15246 1
945 . 1 1 109 109 LEU C C 13 176.720 0.25 . 1 . . . . 87 L C . 15246 1
946 . 1 1 109 109 LEU CA C 13 54.024 0.25 . 1 . . . . 87 L CA . 15246 1
947 . 1 1 109 109 LEU CB C 13 43.358 0.25 . 1 . . . . 87 L CB . 15246 1
948 . 1 1 109 109 LEU CD1 C 13 22.190 0.25 . 1 . . . . 87 L CD1 . 15246 1
949 . 1 1 109 109 LEU CD2 C 13 22.190 0.25 . 1 . . . . 87 L CD2 . 15246 1
950 . 1 1 109 109 LEU CG C 13 26.282 0.25 . 1 . . . . 87 L CG . 15246 1
951 . 1 1 109 109 LEU N N 15 126.582 0.20 . 1 . . . . 87 L N . 15246 1
952 . 1 1 110 110 GLU H H 1 8.530 0.006 . 1 . . . . 88 E HN . 15246 1
953 . 1 1 110 110 GLU HA H 1 4.541 0.006 . 1 . . . . 88 E HA . 15246 1
954 . 1 1 110 110 GLU HB2 H 1 1.963 0.006 . 2 . . . . 88 E HB1 . 15246 1
955 . 1 1 110 110 GLU HB3 H 1 1.963 0.006 . 2 . . . . 88 E HB2 . 15246 1
956 . 1 1 110 110 GLU HG2 H 1 2.224 0.006 . 2 . . . . 88 E HG1 . 15246 1
957 . 1 1 110 110 GLU HG3 H 1 2.140 0.006 . 2 . . . . 88 E HG2 . 15246 1
958 . 1 1 110 110 GLU C C 13 175.340 0.25 . 1 . . . . 88 E C . 15246 1
959 . 1 1 110 110 GLU CA C 13 55.555 0.25 . 1 . . . . 88 E CA . 15246 1
960 . 1 1 110 110 GLU CB C 13 29.970 0.25 . 1 . . . . 88 E CB . 15246 1
961 . 1 1 110 110 GLU CG C 13 36.003 0.25 . 1 . . . . 88 E CG . 15246 1
962 . 1 1 110 110 GLU N N 15 123.263 0.20 . 1 . . . . 88 E N . 15246 1
963 . 1 1 111 111 ILE H H 1 8.842 0.006 . 1 . . . . 89 I HN . 15246 1
964 . 1 1 111 111 ILE HA H 1 3.911 0.006 . 1 . . . . 89 I HA . 15246 1
965 . 1 1 111 111 ILE HB H 1 1.713 0.006 . 1 . . . . 89 I HB . 15246 1
966 . 1 1 111 111 ILE HD11 H 1 0.894 0.006 . 1 . . . . 89 I HD11 . 15246 1
967 . 1 1 111 111 ILE HD12 H 1 0.894 0.006 . 1 . . . . 89 I HD11 . 15246 1
968 . 1 1 111 111 ILE HD13 H 1 0.894 0.006 . 1 . . . . 89 I HD11 . 15246 1
969 . 1 1 111 111 ILE HG12 H 1 1.279 0.006 . 1 . . . . 89 I HG11 . 15246 1
970 . 1 1 111 111 ILE HG13 H 1 0.712 0.006 . 1 . . . . 89 I HG12 . 15246 1
971 . 1 1 111 111 ILE HG21 H 1 0.352 0.006 . 1 . . . . 89 I HG21 . 15246 1
972 . 1 1 111 111 ILE HG22 H 1 0.352 0.006 . 1 . . . . 89 I HG21 . 15246 1
973 . 1 1 111 111 ILE HG23 H 1 0.352 0.006 . 1 . . . . 89 I HG21 . 15246 1
974 . 1 1 111 111 ILE C C 13 173.250 0.25 . 1 . . . . 89 I C . 15246 1
975 . 1 1 111 111 ILE CA C 13 61.207 0.25 . 1 . . . . 89 I CA . 15246 1
976 . 1 1 111 111 ILE CB C 13 38.989 0.25 . 1 . . . . 89 I CB . 15246 1
977 . 1 1 111 111 ILE CD1 C 13 15.534 0.25 . 1 . . . . 89 I CD1 . 15246 1
978 . 1 1 111 111 ILE CG1 C 13 26.866 0.25 . 1 . . . . 89 I CG1 . 15246 1
979 . 1 1 111 111 ILE CG2 C 13 16.807 0.25 . 1 . . . . 89 I CG2 . 15246 1
980 . 1 1 111 111 ILE N N 15 128.558 0.20 . 1 . . . . 89 I N . 15246 1
981 . 1 1 112 112 ALA H H 1 8.651 0.006 . 1 . . . . 90 A HN . 15246 1
982 . 1 1 112 112 ALA HA H 1 4.733 0.006 . 1 . . . . 90 A HA . 15246 1
983 . 1 1 112 112 ALA HB1 H 1 1.370 0.006 . 1 . . . . 90 A HB1 . 15246 1
984 . 1 1 112 112 ALA HB2 H 1 1.370 0.006 . 1 . . . . 90 A HB1 . 15246 1
985 . 1 1 112 112 ALA HB3 H 1 1.370 0.006 . 1 . . . . 90 A HB1 . 15246 1
986 . 1 1 112 112 ALA C C 13 177.040 0.25 . 1 . . . . 90 A C . 15246 1
987 . 1 1 112 112 ALA CA C 13 50.598 0.25 . 1 . . . . 90 A CA . 15246 1
988 . 1 1 112 112 ALA CB C 13 21.517 0.25 . 1 . . . . 90 A CB . 15246 1
989 . 1 1 112 112 ALA N N 15 131.215 0.20 . 1 . . . . 90 A N . 15246 1
990 . 1 1 113 113 TRP H H 1 9.084 0.006 . 1 . . . . 91 W HN . 15246 1
991 . 1 1 113 113 TRP HA H 1 5.129 0.006 . 1 . . . . 91 W HA . 15246 1
992 . 1 1 113 113 TRP HB2 H 1 3.172 0.006 . 2 . . . . 91 W HB1 . 15246 1
993 . 1 1 113 113 TRP HB3 H 1 2.867 0.006 . 2 . . . . 91 W HB2 . 15246 1
994 . 1 1 113 113 TRP HD1 H 1 6.483 0.006 . 1 . . . . 91 W HD1 . 15246 1
995 . 1 1 113 113 TRP HE1 H 1 8.940 0.006 . 1 . . . . 91 W HE1 . 15246 1
996 . 1 1 113 113 TRP C C 13 176.725 0.25 . 1 . . . . 91 W C . 15246 1
997 . 1 1 113 113 TRP CA C 13 56.263 0.25 . 1 . . . . 91 W CA . 15246 1
998 . 1 1 113 113 TRP CB C 13 31.282 0.25 . 1 . . . . 91 W CB . 15246 1
999 . 1 1 113 113 TRP N N 15 125.391 0.20 . 1 . . . . 91 W N . 15246 1
1000 . 1 1 113 113 TRP NE1 N 15 127.462 0.20 . 1 . . . . 91 W NE1 . 15246 1
1001 . 1 1 114 114 GLN H H 1 9.712 0.006 . 1 . . . . 92 Q HN . 15246 1
1002 . 1 1 114 114 GLN HA H 1 5.078 0.006 . 1 . . . . 92 Q HA . 15246 1
1003 . 1 1 114 114 GLN HB2 H 1 2.235 0.006 . 2 . . . . 92 Q HB1 . 15246 1
1004 . 1 1 114 114 GLN HB3 H 1 2.136 0.006 . 2 . . . . 92 Q HB2 . 15246 1
1005 . 1 1 114 114 GLN HG2 H 1 2.470 0.006 . 2 . . . . 92 Q HG1 . 15246 1
1006 . 1 1 114 114 GLN HG3 H 1 2.470 0.006 . 2 . . . . 92 Q HG2 . 15246 1
1007 . 1 1 114 114 GLN CA C 13 52.872 0.25 . 1 . . . . 92 Q CA . 15246 1
1008 . 1 1 114 114 GLN CB C 13 30.288 0.25 . 1 . . . . 92 Q CB . 15246 1
1009 . 1 1 114 114 GLN CG C 13 33.680 0.25 . 1 . . . . 92 Q CG . 15246 1
1010 . 1 1 114 114 GLN N N 15 122.696 0.20 . 1 . . . . 92 Q N . 15246 1
1011 . 1 1 115 115 PRO HA H 1 4.689 0.006 . 1 . . . . 93 P HA . 15246 1
1012 . 1 1 115 115 PRO HB2 H 1 2.522 0.006 . 2 . . . . 93 P HB1 . 15246 1
1013 . 1 1 115 115 PRO HB3 H 1 2.039 0.006 . 2 . . . . 93 P HB2 . 15246 1
1014 . 1 1 115 115 PRO HD2 H 1 3.966 0.006 . 2 . . . . 93 P HD1 . 15246 1
1015 . 1 1 115 115 PRO HD3 H 1 3.848 0.006 . 2 . . . . 93 P HD2 . 15246 1
1016 . 1 1 115 115 PRO HG2 H 1 2.198 0.006 . 2 . . . . 93 P HG1 . 15246 1
1017 . 1 1 115 115 PRO HG3 H 1 2.152 0.006 . 2 . . . . 93 P HG2 . 15246 1
1018 . 1 1 115 115 PRO C C 13 176.690 0.25 . 1 . . . . 93 P C . 15246 1
1019 . 1 1 115 115 PRO CA C 13 63.246 0.25 . 1 . . . . 93 P CA . 15246 1
1020 . 1 1 115 115 PRO CB C 13 32.152 0.25 . 1 . . . . 93 P CB . 15246 1
1021 . 1 1 115 115 PRO CD C 13 51.058 0.25 . 1 . . . . 93 P CD . 15246 1
1022 . 1 1 115 115 PRO CG C 13 27.563 0.25 . 1 . . . . 93 P CG . 15246 1
1023 . 1 1 116 116 ALA H H 1 8.429 0.006 . 1 . . . . 94 A HN . 15246 1
1024 . 1 1 116 116 ALA HA H 1 4.615 0.006 . 1 . . . . 94 A HA . 15246 1
1025 . 1 1 116 116 ALA HB1 H 1 1.412 0.006 . 1 . . . . 94 A HB1 . 15246 1
1026 . 1 1 116 116 ALA HB2 H 1 1.412 0.006 . 1 . . . . 94 A HB1 . 15246 1
1027 . 1 1 116 116 ALA HB3 H 1 1.412 0.006 . 1 . . . . 94 A HB1 . 15246 1
1028 . 1 1 116 116 ALA C C 13 177.230 0.25 . 1 . . . . 94 A C . 15246 1
1029 . 1 1 116 116 ALA CA C 13 51.966 0.25 . 1 . . . . 94 A CA . 15246 1
1030 . 1 1 116 116 ALA CB C 13 20.497 0.25 . 1 . . . . 94 A CB . 15246 1
1031 . 1 1 116 116 ALA N N 15 125.566 0.20 . 1 . . . . 94 A N . 15246 1
1032 . 1 1 117 117 GLU H H 1 8.754 0.006 . 1 . . . . 95 E HN . 15246 1
1033 . 1 1 117 117 GLU HA H 1 4.479 0.006 . 1 . . . . 95 E HA . 15246 1
1034 . 1 1 117 117 GLU HB2 H 1 2.139 0.006 . 2 . . . . 95 E HB1 . 15246 1
1035 . 1 1 117 117 GLU HB3 H 1 2.009 0.006 . 2 . . . . 95 E HB2 . 15246 1
1036 . 1 1 117 117 GLU HG2 H 1 2.356 0.006 . 2 . . . . 95 E HG1 . 15246 1
1037 . 1 1 117 117 GLU HG3 H 1 2.356 0.006 . 2 . . . . 95 E HG2 . 15246 1
1038 . 1 1 117 117 GLU CA C 13 56.146 0.25 . 1 . . . . 95 E CA . 15246 1
1039 . 1 1 117 117 GLU CB C 13 30.856 0.25 . 1 . . . . 95 E CB . 15246 1
1040 . 1 1 117 117 GLU CG C 13 36.223 0.25 . 1 . . . . 95 E CG . 15246 1
1041 . 1 1 117 117 GLU N N 15 121.044 0.20 . 1 . . . . 95 E N . 15246 1
stop_
save_