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 17638
_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' . . . 17638 1
2 '2D 1H-13C HSQC aliphatic' . . . 17638 1
3 '2D 1H-13C HSQC aromatic' . . . 17638 1
4 '3D HNCA' . . . 17638 1
5 '3D HN(CO)CA' . . . 17638 1
6 '3D HNCACB' . . . 17638 1
7 '3D HNCO' . . . 17638 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 ALA HA H 1 4.101 0.004 . 1 . . . A 507 ALA HA . 17638 1
2 . 1 1 1 1 ALA HB1 H 1 1.497 0.008 . 1 . . . . 507 Ala HB2 . 17638 1
3 . 1 1 1 1 ALA HB2 H 1 1.497 0.008 . 1 . . . . 507 Ala HB2 . 17638 1
4 . 1 1 1 1 ALA HB3 H 1 1.497 0.008 . 1 . . . . 507 Ala HB2 . 17638 1
5 . 1 1 1 1 ALA CA C 13 51.725 0.034 . 1 . . . A 507 ALA CA . 17638 1
6 . 1 1 1 1 ALA CB C 13 19.791 0.322 . 1 . . . A 507 ALA CB . 17638 1
7 . 1 1 2 2 GLN H H 1 8.653 0.044 . 1 . . . A 508 GLN H . 17638 1
8 . 1 1 2 2 GLN HA H 1 4.647 0.016 . 1 . . . A 508 GLN HA . 17638 1
9 . 1 1 2 2 GLN HB2 H 1 1.947 0.000 . 2 . . . . 508 Gln HB2 . 17638 1
10 . 1 1 2 2 GLN HB3 H 1 1.956 0.003 . 2 . . . . 508 Gln HB3 . 17638 1
11 . 1 1 2 2 GLN HG2 H 1 2.393 0.001 . 2 . . . . 508 Gln QG . 17638 1
12 . 1 1 2 2 GLN HG3 H 1 2.393 0.001 . 2 . . . . 508 Gln QG . 17638 1
13 . 1 1 2 2 GLN HE21 H 1 7.550 0.000 . 2 . . . . 508 Gln HE21 . 17638 1
14 . 1 1 2 2 GLN HE22 H 1 6.866 0.000 . 2 . . . . 508 Gln HE22 . 17638 1
15 . 1 1 2 2 GLN CA C 13 53.784 0.079 . 1 . . . A 508 GLN CA . 17638 1
16 . 1 1 2 2 GLN CB C 13 29.282 0.000 . 1 . . . A 508 GLN CB . 17638 1
17 . 1 1 2 2 GLN CG C 13 33.576 0.152 . 1 . . . A 508 GLN CG . 17638 1
18 . 1 1 2 2 GLN N N 15 121.072 0.370 . 1 . . . A 508 GLN N . 17638 1
19 . 1 1 3 3 PRO HA H 1 4.418 0.006 . 1 . . . A 509 PRO HA . 17638 1
20 . 1 1 3 3 PRO HB2 H 1 2.269 0.009 . 2 . . . . 509 Pro HB2 . 17638 1
21 . 1 1 3 3 PRO HB3 H 1 1.930 0.008 . 2 . . . . 509 Pro HB3 . 17638 1
22 . 1 1 3 3 PRO HG2 H 1 1.940 0.018 . 2 . . . . 509 Pro QG . 17638 1
23 . 1 1 3 3 PRO HG3 H 1 1.940 0.018 . 2 . . . . 509 Pro QG . 17638 1
24 . 1 1 3 3 PRO HD2 H 1 3.770 0.047 . 2 . . . . 509 Pro HD2 . 17638 1
25 . 1 1 3 3 PRO HD3 H 1 3.651 0.013 . 2 . . . . 509 Pro HD3 . 17638 1
26 . 1 1 3 3 PRO CA C 13 63.134 0.126 . 1 . . . A 509 PRO CA . 17638 1
27 . 1 1 3 3 PRO CB C 13 32.527 0.739 . 1 . . . A 509 PRO CB . 17638 1
28 . 1 1 3 3 PRO CD C 13 50.688 0.031 . 1 . . . A 509 PRO CD . 17638 1
29 . 1 1 4 4 LYS H H 1 8.411 0.032 . 1 . . . A 510 LYS H . 17638 1
30 . 1 1 4 4 LYS HA H 1 4.294 0.015 . 1 . . . A 510 LYS HA . 17638 1
31 . 1 1 4 4 LYS HB2 H 1 1.736 0.005 . 2 . . . . 510 Lys HB2 . 17638 1
32 . 1 1 4 4 LYS HB3 H 1 1.729 0.012 . 2 . . . . 510 Lys HB3 . 17638 1
33 . 1 1 4 4 LYS HG2 H 1 1.444 0.012 . 2 . . . . 510 Lys QG . 17638 1
34 . 1 1 4 4 LYS HG3 H 1 1.444 0.012 . 2 . . . . 510 Lys QG . 17638 1
35 . 1 1 4 4 LYS HD2 H 1 1.667 0.004 . 2 . . . . 510 Lys HD# . 17638 1
36 . 1 1 4 4 LYS HD3 H 1 1.667 0.004 . 2 . . . . 510 Lys HD# . 17638 1
37 . 1 1 4 4 LYS HE2 H 1 2.977 0.003 . 2 . . . . 510 Lys QE . 17638 1
38 . 1 1 4 4 LYS HE3 H 1 2.977 0.003 . 2 . . . . 510 Lys QE . 17638 1
39 . 1 1 4 4 LYS CA C 13 56.191 0.101 . 1 . . . A 510 LYS CA . 17638 1
40 . 1 1 4 4 LYS CB C 13 33.280 0.079 . 1 . . . A 510 LYS CB . 17638 1
41 . 1 1 4 4 LYS CG C 13 24.851 0.025 . 1 . . . A 510 LYS CG . 17638 1
42 . 1 1 4 4 LYS CD C 13 29.036 0.062 . 1 . . . A 510 LYS CD . 17638 1
43 . 1 1 4 4 LYS N N 15 121.601 0.318 . 1 . . . A 510 LYS N . 17638 1
44 . 1 1 5 5 CYS H H 1 8.354 0.035 . 1 . . . A 511 CYS H . 17638 1
45 . 1 1 5 5 CYS HA H 1 4.656 0.041 . 1 . . . A 511 CYS HA . 17638 1
46 . 1 1 5 5 CYS HB2 H 1 3.074 0.000 . 2 . . . . 511 Cys HB2 . 17638 1
47 . 1 1 5 5 CYS HB3 H 1 2.958 0.000 . 2 . . . . 511 Cys HB3 . 17638 1
48 . 1 1 5 5 CYS CA C 13 55.144 0.110 . 1 . . . A 511 CYS CA . 17638 1
49 . 1 1 5 5 CYS CB C 13 41.908 0.112 . 1 . . . A 511 CYS CB . 17638 1
50 . 1 1 5 5 CYS N N 15 119.748 0.350 . 1 . . . A 511 CYS N . 17638 1
51 . 1 1 6 6 ASN H H 1 8.692 0.036 . 1 . . . A 512 ASN H . 17638 1
52 . 1 1 6 6 ASN HA H 1 4.981 0.011 . 1 . . . A 512 ASN HA . 17638 1
53 . 1 1 6 6 ASN HB2 H 1 2.846 0.013 . 2 . . . . 512 Asn HB2 . 17638 1
54 . 1 1 6 6 ASN HB3 H 1 2.706 0.013 . 2 . . . . 512 Asn HB3 . 17638 1
55 . 1 1 6 6 ASN CA C 13 51.028 0.153 . 1 . . . A 512 ASN CA . 17638 1
56 . 1 1 6 6 ASN CB C 13 39.064 0.084 . 1 . . . A 512 ASN CB . 17638 1
57 . 1 1 6 6 ASN N N 15 122.726 0.365 . 1 . . . A 512 ASN N . 17638 1
58 . 1 1 7 7 PRO HA H 1 4.378 0.006 . 1 . . . A 513 PRO HA . 17638 1
59 . 1 1 7 7 PRO HB2 H 1 2.179 0.006 . 2 . . . . 513 Pro HB2 . 17638 1
60 . 1 1 7 7 PRO HG2 H 1 1.977 0.106 . 2 . . . . 513 Pro QG . 17638 1
61 . 1 1 7 7 PRO HG3 H 1 1.977 0.106 . 2 . . . . 513 Pro QG . 17638 1
62 . 1 1 7 7 PRO HD2 H 1 3.784 0.012 . 2 . . . . 513 Pro HD# . 17638 1
63 . 1 1 7 7 PRO HD3 H 1 3.784 0.012 . 2 . . . . 513 Pro HD# . 17638 1
64 . 1 1 7 7 PRO CA C 13 63.616 0.020 . 1 . . . A 513 PRO CA . 17638 1
65 . 1 1 7 7 PRO CB C 13 32.060 0.148 . 1 . . . A 513 PRO CB . 17638 1
66 . 1 1 7 7 PRO CD C 13 50.724 0.000 . 1 . . . A 513 PRO CD . 17638 1
67 . 1 1 8 8 ASN H H 1 8.356 0.027 . 1 . . . A 514 ASN H . 17638 1
68 . 1 1 8 8 ASN HA H 1 4.631 0.036 . 1 . . . A 514 ASN HA . 17638 1
69 . 1 1 8 8 ASN HB2 H 1 2.745 0.011 . 2 . . . . 514 Asn HB2 . 17638 1
70 . 1 1 8 8 ASN HB3 H 1 2.682 0.010 . 2 . . . . 514 Asn HB3 . 17638 1
71 . 1 1 8 8 ASN HD21 H 1 7.623 0.023 . 2 . . . . 514 Asn HD21 . 17638 1
72 . 1 1 8 8 ASN HD22 H 1 6.943 0.014 . 2 . . . . 514 Asn HD22 . 17638 1
73 . 1 1 8 8 ASN CA C 13 53.264 0.001 . 1 . . . A 514 ASN CA . 17638 1
74 . 1 1 8 8 ASN CB C 13 38.940 0.086 . 1 . . . A 514 ASN CB . 17638 1
75 . 1 1 8 8 ASN N N 15 117.652 0.283 . 1 . . . A 514 ASN N . 17638 1
76 . 1 1 9 9 LEU H H 1 7.845 0.032 . 1 . . . A 515 LEU H . 17638 1
77 . 1 1 9 9 LEU HA H 1 4.231 0.011 . 1 . . . A 515 LEU HA . 17638 1
78 . 1 1 9 9 LEU HB2 H 1 1.483 0.003 . 2 . . . . 515 Leu HB2 . 17638 1
79 . 1 1 9 9 LEU HD11 H 1 0.817 0.013 . 2 . . . . 515 Leu QQD . 17638 1
80 . 1 1 9 9 LEU HD12 H 1 0.817 0.013 . 2 . . . . 515 Leu QQD . 17638 1
81 . 1 1 9 9 LEU HD13 H 1 0.817 0.013 . 2 . . . . 515 Leu QQD . 17638 1
82 . 1 1 9 9 LEU HD21 H 1 0.817 0.013 . 2 . . . . 515 Leu QQD . 17638 1
83 . 1 1 9 9 LEU HD22 H 1 0.817 0.013 . 2 . . . . 515 Leu QQD . 17638 1
84 . 1 1 9 9 LEU HD23 H 1 0.817 0.013 . 2 . . . . 515 Leu QQD . 17638 1
85 . 1 1 9 9 LEU CA C 13 55.180 0.003 . 1 . . . A 515 LEU CA . 17638 1
86 . 1 1 9 9 LEU CB C 13 42.448 0.052 . 1 . . . A 515 LEU CB . 17638 1
87 . 1 1 9 9 LEU N N 15 121.298 0.303 . 1 . . . A 515 LEU N . 17638 1
88 . 1 1 10 10 HIS H H 1 8.194 0.033 . 1 . . . A 516 HIS H . 17638 1
89 . 1 1 10 10 HIS HA H 1 4.544 0.003 . 1 . . . A 516 HIS HA . 17638 1
90 . 1 1 10 10 HIS HB2 H 1 2.946 0.013 . 2 . . . . 516 His HB2 . 17638 1
91 . 1 1 10 10 HIS HD2 H 1 7.080 0.003 . 1 . . . . 516 His HD2 . 17638 1
92 . 1 1 10 10 HIS HE1 H 1 8.464 0.000 . 1 . . . . 516 His HE1 . 17638 1
93 . 1 1 10 10 HIS CA C 13 55.221 0.171 . 1 . . . A 516 HIS CA . 17638 1
94 . 1 1 10 10 HIS CB C 13 29.246 0.030 . 1 . . . A 516 HIS CB . 17638 1
95 . 1 1 10 10 HIS CD2 C 13 120.202 0.098 . 1 . . . A 516 HIS CD2 . 17638 1
96 . 1 1 10 10 HIS CE1 C 13 136.505 0.000 . 1 . . . A 516 HIS CE1 . 17638 1
97 . 1 1 10 10 HIS N N 15 117.846 0.324 . 1 . . . A 516 HIS N . 17638 1
98 . 1 1 11 11 TYR H H 1 8.193 0.040 . 1 . . . A 517 TYR H . 17638 1
99 . 1 1 11 11 TYR HA H 1 4.359 0.071 . 1 . . . A 517 TYR HA . 17638 1
100 . 1 1 11 11 TYR HB2 H 1 2.792 0.019 . 2 . . . . 517 Tyr HB2 . 17638 1
101 . 1 1 11 11 TYR HD1 H 1 6.805 0.011 . 3 . . . . 517 Tyr HD# . 17638 1
102 . 1 1 11 11 TYR HD2 H 1 6.805 0.011 . 3 . . . . 517 Tyr HD# . 17638 1
103 . 1 1 11 11 TYR HE1 H 1 6.703 0.037 . 3 . . . . 517 Tyr QE . 17638 1
104 . 1 1 11 11 TYR HE2 H 1 6.703 0.037 . 3 . . . . 517 Tyr QE . 17638 1
105 . 1 1 11 11 TYR CA C 13 59.137 0.072 . 1 . . . A 517 TYR CA . 17638 1
106 . 1 1 11 11 TYR CB C 13 38.922 0.061 . 1 . . . A 517 TYR CB . 17638 1
107 . 1 1 11 11 TYR CD2 C 13 133.014 0.050 . 3 . . . A 517 TYR CD2 . 17638 1
108 . 1 1 11 11 TYR CE2 C 13 118.230 0.112 . 3 . . . A 517 TYR CE2 . 17638 1
109 . 1 1 11 11 TYR N N 15 120.459 0.321 . 1 . . . A 517 TYR N . 17638 1
110 . 1 1 12 12 TRP H H 1 7.748 0.030 . 1 . . . A 518 TRP H . 17638 1
111 . 1 1 12 12 TRP HA H 1 4.637 0.036 . 1 . . . A 518 TRP HA . 17638 1
112 . 1 1 12 12 TRP HB2 H 1 3.235 0.013 . 2 . . . . 518 Trp HB2 . 17638 1
113 . 1 1 12 12 TRP HD1 H 1 7.244 0.006 . 1 . . . . 518 Trp HD1 . 17638 1
114 . 1 1 12 12 TRP HE1 H 1 10.470 0.018 . 1 . . . . 518 Trp HE1 . 17638 1
115 . 1 1 12 12 TRP HE3 H 1 7.519 0.015 . 1 . . . . 518 Trp HE3 . 17638 1
116 . 1 1 12 12 TRP HZ2 H 1 7.375 0.010 . 1 . . . . 518 Trp HZ2 . 17638 1
117 . 1 1 12 12 TRP HZ3 H 1 7.052 0.008 . 1 . . . . 518 Trp HZ3 . 17638 1
118 . 1 1 12 12 TRP HH2 H 1 7.057 0.002 . 1 . . . . 518 Trp HH2 . 17638 1
119 . 1 1 12 12 TRP CA C 13 57.611 0.073 . 1 . . . A 518 TRP CA . 17638 1
120 . 1 1 12 12 TRP CB C 13 30.051 0.038 . 1 . . . A 518 TRP CB . 17638 1
121 . 1 1 12 12 TRP CD1 C 13 127.114 0.143 . 1 . . . A 518 TRP CD1 . 17638 1
122 . 1 1 12 12 TRP CE3 C 13 121.090 0.317 . 1 . . . A 518 TRP CE3 . 17638 1
123 . 1 1 12 12 TRP CZ2 C 13 114.546 0.049 . 1 . . . A 518 TRP CZ2 . 17638 1
124 . 1 1 12 12 TRP CH2 C 13 124.075 0.025 . 1 . . . A 518 TRP CH2 . 17638 1
125 . 1 1 12 12 TRP N N 15 118.827 0.303 . 1 . . . A 518 TRP N . 17638 1
126 . 1 1 13 13 THR H H 1 7.988 0.031 . 1 . . . A 519 THR H . 17638 1
127 . 1 1 13 13 THR HA H 1 4.452 0.009 . 1 . . . A 519 THR HA . 17638 1
128 . 1 1 13 13 THR HB H 1 4.226 0.015 . 1 . . . A 519 THR HB . 17638 1
129 . 1 1 13 13 THR HG21 H 1 1.138 0.008 . 1 . . . . 519 Thr QG2 . 17638 1
130 . 1 1 13 13 THR HG22 H 1 1.138 0.008 . 1 . . . . 519 Thr QG2 . 17638 1
131 . 1 1 13 13 THR HG23 H 1 1.138 0.008 . 1 . . . . 519 Thr QG2 . 17638 1
132 . 1 1 13 13 THR CA C 13 61.626 0.097 . 1 . . . A 519 THR CA . 17638 1
133 . 1 1 13 13 THR CB C 13 69.871 0.119 . 1 . . . A 519 THR CB . 17638 1
134 . 1 1 13 13 THR CG2 C 13 21.640 0.035 . 1 . . . A 519 THR CG2 . 17638 1
135 . 1 1 13 13 THR N N 15 112.779 0.348 . 1 . . . A 519 THR N . 17638 1
136 . 1 1 14 14 THR H H 1 8.048 0.031 . 1 . . . A 520 THR H . 17638 1
137 . 1 1 14 14 THR HA H 1 4.348 0.030 . 1 . . . A 520 THR HA . 17638 1
138 . 1 1 14 14 THR HB H 1 4.251 0.008 . 1 . . . A 520 THR HB . 17638 1
139 . 1 1 14 14 THR HG21 H 1 1.155 0.019 . 1 . . . . 520 Thr QG2 . 17638 1
140 . 1 1 14 14 THR HG22 H 1 1.155 0.019 . 1 . . . . 520 Thr QG2 . 17638 1
141 . 1 1 14 14 THR HG23 H 1 1.155 0.019 . 1 . . . . 520 Thr QG2 . 17638 1
142 . 1 1 14 14 THR CA C 13 62.066 0.068 . 1 . . . A 520 THR CA . 17638 1
143 . 1 1 14 14 THR CB C 13 69.564 0.323 . 1 . . . A 520 THR CB . 17638 1
144 . 1 1 14 14 THR CG2 C 13 21.790 0.021 . 1 . . . A 520 THR CG2 . 17638 1
145 . 1 1 14 14 THR N N 15 114.805 0.348 . 1 . . . A 520 THR N . 17638 1
146 . 1 1 15 15 GLN H H 1 8.326 0.028 . 1 . . . A 521 GLN H . 17638 1
147 . 1 1 15 15 GLN HA H 1 4.279 0.010 . 1 . . . A 521 GLN HA . 17638 1
148 . 1 1 15 15 GLN HB2 H 1 2.017 0.010 . 2 . . . . 521 Gln HB2 . 17638 1
149 . 1 1 15 15 GLN HB3 H 1 2.092 0.024 . 2 . . . . 521 Gln HB3 . 17638 1
150 . 1 1 15 15 GLN HG2 H 1 2.290 0.008 . 2 . . . . 521 Gln QG . 17638 1
151 . 1 1 15 15 GLN HG3 H 1 2.290 0.008 . 2 . . . . 521 Gln QG . 17638 1
152 . 1 1 15 15 GLN HE21 H 1 7.519 0.032 . 2 . . . . 521 Gln HE21 . 17638 1
153 . 1 1 15 15 GLN HE22 H 1 6.774 0.000 . 2 . . . . 521 Gln HE22 . 17638 1
154 . 1 1 15 15 GLN CA C 13 56.320 0.037 . 1 . . . A 521 GLN CA . 17638 1
155 . 1 1 15 15 GLN CB C 13 29.362 0.105 . 1 . . . A 521 GLN CB . 17638 1
156 . 1 1 15 15 GLN CG C 13 34.097 0.123 . 1 . . . A 521 GLN CG . 17638 1
157 . 1 1 15 15 GLN N N 15 121.797 0.314 . 1 . . . A 521 GLN N . 17638 1
158 . 1 1 16 16 ASP H H 1 8.226 0.033 . 1 . . . A 522 ASP H . 17638 1
159 . 1 1 16 16 ASP HA H 1 4.538 0.009 . 1 . . . A 522 ASP HA . 17638 1
160 . 1 1 16 16 ASP HB2 H 1 2.389 0.374 . 2 . . . . 522 Asp HB2 . 17638 1
161 . 1 1 16 16 ASP CA C 13 54.767 0.094 . 1 . . . A 522 ASP CA . 17638 1
162 . 1 1 16 16 ASP CB C 13 41.162 0.029 . 1 . . . A 522 ASP CB . 17638 1
163 . 1 1 16 16 ASP N N 15 120.779 0.304 . 1 . . . A 522 ASP N . 17638 1
164 . 1 1 17 17 GLU H H 1 8.364 0.028 . 1 . . . A 523 GLU H . 17638 1
165 . 1 1 17 17 GLU HA H 1 4.183 0.012 . 1 . . . A 523 GLU HA . 17638 1
166 . 1 1 17 17 GLU HB2 H 1 2.022 0.033 . 2 . . . . 523 Glu HB2 . 17638 1
167 . 1 1 17 17 GLU HB3 H 1 1.877 0.101 . 2 . . . . 523 Glu HB3 . 17638 1
168 . 1 1 17 17 GLU HG2 H 1 2.284 0.013 . 2 . . . . 523 Glu QG . 17638 1
169 . 1 1 17 17 GLU HG3 H 1 2.284 0.013 . 2 . . . . 523 Glu QG . 17638 1
170 . 1 1 17 17 GLU CA C 13 57.350 0.027 . 1 . . . A 523 GLU CA . 17638 1
171 . 1 1 17 17 GLU CB C 13 29.647 0.158 . 1 . . . A 523 GLU CB . 17638 1
172 . 1 1 17 17 GLU CG C 13 35.599 0.058 . 1 . . . A 523 GLU CG . 17638 1
173 . 1 1 17 17 GLU N N 15 120.946 0.262 . 1 . . . A 523 GLU N . 17638 1
174 . 1 1 18 18 GLY H H 1 8.386 0.025 . 1 . . . A 524 GLY H . 17638 1
175 . 1 1 18 18 GLY HA2 H 1 3.874 0.011 . 2 . . . . 524 Gly QA . 17638 1
176 . 1 1 18 18 GLY HA3 H 1 3.874 0.011 . 2 . . . . 524 Gly QA . 17638 1
177 . 1 1 18 18 GLY CA C 13 45.848 0.121 . 1 . . . A 524 GLY CA . 17638 1
178 . 1 1 18 18 GLY N N 15 108.758 0.287 . 1 . . . A 524 GLY N . 17638 1
179 . 1 1 19 19 ALA H H 1 7.968 0.026 . 1 . . . A 525 ALA H . 17638 1
180 . 1 1 19 19 ALA HA H 1 4.252 0.012 . 1 . . . A 525 ALA HA . 17638 1
181 . 1 1 19 19 ALA HB1 H 1 1.367 0.009 . 1 . . . . 525 Ala HB2 . 17638 1
182 . 1 1 19 19 ALA HB2 H 1 1.367 0.009 . 1 . . . . 525 Ala HB2 . 17638 1
183 . 1 1 19 19 ALA HB3 H 1 1.367 0.009 . 1 . . . . 525 Ala HB2 . 17638 1
184 . 1 1 19 19 ALA CA C 13 52.751 0.048 . 1 . . . A 525 ALA CA . 17638 1
185 . 1 1 19 19 ALA CB C 13 19.538 0.392 . 1 . . . A 525 ALA CB . 17638 1
186 . 1 1 19 19 ALA N N 15 123.267 0.268 . 1 . . . A 525 ALA N . 17638 1
187 . 1 1 20 20 ALA H H 1 8.121 0.031 . 1 . . . A 526 ALA H . 17638 1
188 . 1 1 20 20 ALA HA H 1 4.263 0.013 . 1 . . . A 526 ALA HA . 17638 1
189 . 1 1 20 20 ALA HB1 H 1 1.365 0.009 . 1 . . . . 526 Ala HB2 . 17638 1
190 . 1 1 20 20 ALA HB2 H 1 1.365 0.009 . 1 . . . . 526 Ala HB2 . 17638 1
191 . 1 1 20 20 ALA HB3 H 1 1.365 0.009 . 1 . . . . 526 Ala HB2 . 17638 1
192 . 1 1 20 20 ALA CA C 13 52.826 0.018 . 1 . . . A 526 ALA CA . 17638 1
193 . 1 1 20 20 ALA CB C 13 19.305 0.142 . 1 . . . A 526 ALA CB . 17638 1
194 . 1 1 20 20 ALA N N 15 122.058 0.313 . 1 . . . A 526 ALA N . 17638 1
195 . 1 1 21 21 ILE H H 1 8.020 0.031 . 1 . . . A 527 ILE H . 17638 1
196 . 1 1 21 21 ILE HA H 1 4.034 0.062 . 1 . . . A 527 ILE HA . 17638 1
197 . 1 1 21 21 ILE HB H 1 1.850 0.017 . 1 . . . A 527 ILE HB . 17638 1
198 . 1 1 21 21 ILE HG12 H 1 1.378 0.040 . 2 . . . . 527 Ile HG12 . 17638 1
199 . 1 1 21 21 ILE HG13 H 1 1.138 0.013 . 2 . . . . 527 Ile HG13 . 17638 1
200 . 1 1 21 21 ILE HD11 H 1 0.837 0.013 . 1 . . . . 527 Ile QD1 . 17638 1
201 . 1 1 21 21 ILE HD12 H 1 0.837 0.013 . 1 . . . . 527 Ile QD1 . 17638 1
202 . 1 1 21 21 ILE HD13 H 1 0.837 0.013 . 1 . . . . 527 Ile QD1 . 17638 1
203 . 1 1 21 21 ILE CA C 13 61.968 0.087 . 1 . . . A 527 ILE CA . 17638 1
204 . 1 1 21 21 ILE CB C 13 38.781 0.403 . 1 . . . A 527 ILE CB . 17638 1
205 . 1 1 21 21 ILE CG1 C 13 27.871 0.083 . 1 . . . A 527 ILE CG1 . 17638 1
206 . 1 1 21 21 ILE N N 15 118.402 0.278 . 1 . . . A 527 ILE N . 17638 1
207 . 1 1 22 22 GLY H H 1 8.181 0.029 . 1 . . . A 528 GLY H . 17638 1
208 . 1 1 22 22 GLY HA2 H 1 3.920 0.007 . 2 . . . . 528 Gly QA . 17638 1
209 . 1 1 22 22 GLY HA3 H 1 3.920 0.007 . 2 . . . . 528 Gly QA . 17638 1
210 . 1 1 22 22 GLY CA C 13 45.851 0.036 . 1 . . . A 528 GLY CA . 17638 1
211 . 1 1 22 22 GLY N N 15 109.880 0.279 . 1 . . . A 528 GLY N . 17638 1
212 . 1 1 23 23 LEU H H 1 8.168 0.032 . 1 . . . A 529 LEU H . 17638 1
213 . 1 1 23 23 LEU HA H 1 4.188 0.015 . 1 . . . A 529 LEU HA . 17638 1
214 . 1 1 23 23 LEU HB2 H 1 1.572 0.009 . 2 . . . . 529 Leu HB2 . 17638 1
215 . 1 1 23 23 LEU HD11 H 1 0.830 0.018 . 2 . . . . 529 Leu QQD . 17638 1
216 . 1 1 23 23 LEU HD12 H 1 0.830 0.018 . 2 . . . . 529 Leu QQD . 17638 1
217 . 1 1 23 23 LEU HD13 H 1 0.830 0.018 . 2 . . . . 529 Leu QQD . 17638 1
218 . 1 1 23 23 LEU HD21 H 1 0.830 0.018 . 2 . . . . 529 Leu QQD . 17638 1
219 . 1 1 23 23 LEU HD22 H 1 0.830 0.018 . 2 . . . . 529 Leu QQD . 17638 1
220 . 1 1 23 23 LEU HD23 H 1 0.830 0.018 . 2 . . . . 529 Leu QQD . 17638 1
221 . 1 1 23 23 LEU CA C 13 55.459 0.100 . 1 . . . A 529 LEU CA . 17638 1
222 . 1 1 23 23 LEU CB C 13 42.475 0.222 . 1 . . . A 529 LEU CB . 17638 1
223 . 1 1 23 23 LEU N N 15 119.616 0.292 . 1 . . . A 529 LEU N . 17638 1
224 . 1 1 24 24 ALA H H 1 8.137 0.030 . 1 . . . A 530 ALA H . 17638 1
225 . 1 1 24 24 ALA HA H 1 4.008 0.031 . 1 . . . A 530 ALA HA . 17638 1
226 . 1 1 24 24 ALA HB1 H 1 1.366 0.004 . 1 . . . . 530 Ala HB2 . 17638 1
227 . 1 1 24 24 ALA HB2 H 1 1.366 0.004 . 1 . . . . 530 Ala HB2 . 17638 1
228 . 1 1 24 24 ALA HB3 H 1 1.366 0.004 . 1 . . . . 530 Ala HB2 . 17638 1
229 . 1 1 24 24 ALA CA C 13 53.894 0.060 . 1 . . . A 530 ALA CA . 17638 1
230 . 1 1 24 24 ALA CB C 13 19.147 0.244 . 1 . . . A 530 ALA CB . 17638 1
231 . 1 1 24 24 ALA N N 15 120.798 0.307 . 1 . . . A 530 ALA N . 17638 1
232 . 1 1 25 25 TRP H H 1 7.481 0.026 . 1 . . . A 531 TRP H . 17638 1
233 . 1 1 25 25 TRP HA H 1 4.478 0.009 . 1 . . . A 531 TRP HA . 17638 1
234 . 1 1 25 25 TRP HB2 H 1 3.375 0.021 . 2 . . . . 531 Trp HB2 . 17638 1
235 . 1 1 25 25 TRP HB3 H 1 3.223 0.027 . 2 . . . . 531 Trp HB3 . 17638 1
236 . 1 1 25 25 TRP HD1 H 1 7.334 0.009 . 1 . . . . 531 Trp HD1 . 17638 1
237 . 1 1 25 25 TRP HE1 H 1 10.381 0.002 . 1 . . . . 531 Trp HE1 . 17638 1
238 . 1 1 25 25 TRP HE3 H 1 7.476 0.012 . 1 . . . . 531 Trp HE3 . 17638 1
239 . 1 1 25 25 TRP HZ2 H 1 7.408 0.009 . 1 . . . . 531 Trp HZ2 . 17638 1
240 . 1 1 25 25 TRP HZ3 H 1 6.916 0.014 . 1 . . . . 531 Trp HZ3 . 17638 1
241 . 1 1 25 25 TRP HH2 H 1 7.046 0.013 . 1 . . . . 531 Trp HH2 . 17638 1
242 . 1 1 25 25 TRP CA C 13 56.503 0.088 . 1 . . . A 531 TRP CA . 17638 1
243 . 1 1 25 25 TRP CB C 13 29.814 0.007 . 1 . . . A 531 TRP CB . 17638 1
244 . 1 1 25 25 TRP CD1 C 13 127.054 0.067 . 1 . . . A 531 TRP CD1 . 17638 1
245 . 1 1 25 25 TRP CE3 C 13 121.492 0.235 . 1 . . . A 531 TRP CE3 . 17638 1
246 . 1 1 25 25 TRP CZ2 C 13 114.619 0.086 . 1 . . . A 531 TRP CZ2 . 17638 1
247 . 1 1 25 25 TRP CZ3 C 13 120.971 0.006 . 1 . . . A 531 TRP CZ3 . 17638 1
248 . 1 1 25 25 TRP CH2 C 13 124.139 0.035 . 1 . . . A 531 TRP CH2 . 17638 1
249 . 1 1 25 25 TRP N N 15 115.166 0.328 . 1 . . . A 531 TRP N . 17638 1
250 . 1 1 26 26 ILE H H 1 7.282 0.025 . 1 . . . A 532 ILE H . 17638 1
251 . 1 1 26 26 ILE HA H 1 3.899 0.026 . 1 . . . A 532 ILE HA . 17638 1
252 . 1 1 26 26 ILE HB H 1 1.697 0.000 . 1 . . . A 532 ILE HB . 17638 1
253 . 1 1 26 26 ILE HG12 H 1 1.409 0.000 . 2 . . . . 532 Ile HG12 . 17638 1
254 . 1 1 26 26 ILE HG21 H 1 0.806 0.013 . 1 . . . . 532 Ile QG2 . 17638 1
255 . 1 1 26 26 ILE HG22 H 1 0.806 0.013 . 1 . . . . 532 Ile QG2 . 17638 1
256 . 1 1 26 26 ILE HG23 H 1 0.806 0.013 . 1 . . . . 532 Ile QG2 . 17638 1
257 . 1 1 26 26 ILE HD11 H 1 0.716 0.125 . 1 . . . . 532 Ile QD1 . 17638 1
258 . 1 1 26 26 ILE HD12 H 1 0.716 0.125 . 1 . . . . 532 Ile QD1 . 17638 1
259 . 1 1 26 26 ILE HD13 H 1 0.716 0.125 . 1 . . . . 532 Ile QD1 . 17638 1
260 . 1 1 26 26 ILE CA C 13 61.736 0.047 . 1 . . . A 532 ILE CA . 17638 1
261 . 1 1 26 26 ILE N N 15 121.710 0.242 . 1 . . . A 532 ILE N . 17638 1
262 . 1 1 27 27 PRO HA H 1 4.258 0.005 . 1 . . . A 533 PRO HA . 17638 1
263 . 1 1 27 27 PRO HB2 H 1 2.176 0.000 . 2 . . . . 533 Pro HB2 . 17638 1
264 . 1 1 27 27 PRO HG2 H 1 1.928 0.000 . 2 . . . . 533 Pro QG . 17638 1
265 . 1 1 27 27 PRO HG3 H 1 1.928 0.000 . 2 . . . . 533 Pro QG . 17638 1
266 . 1 1 27 27 PRO CA C 13 64.199 0.025 . 1 . . . A 533 PRO CA . 17638 1
267 . 1 1 28 28 TYR H H 1 7.935 0.038 . 1 . . . A 534 TYR H . 17638 1
268 . 1 1 28 28 TYR HA H 1 4.072 0.022 . 1 . . . A 534 TYR HA . 17638 1
269 . 1 1 28 28 TYR HB2 H 1 2.916 0.016 . 2 . . . . 534 Tyr HB2 . 17638 1
270 . 1 1 28 28 TYR HD1 H 1 6.858 0.004 . 3 . . . . 534 Tyr HD# . 17638 1
271 . 1 1 28 28 TYR HD2 H 1 6.858 0.004 . 3 . . . . 534 Tyr HD# . 17638 1
272 . 1 1 28 28 TYR HE1 H 1 6.780 0.030 . 3 . . . . 534 Tyr QE . 17638 1
273 . 1 1 28 28 TYR HE2 H 1 6.780 0.030 . 3 . . . . 534 Tyr QE . 17638 1
274 . 1 1 28 28 TYR CA C 13 60.802 0.000 . 1 . . . A 534 TYR CA . 17638 1
275 . 1 1 28 28 TYR CD2 C 13 132.935 0.044 . 3 . . . A 534 TYR CD2 . 17638 1
276 . 1 1 28 28 TYR CE2 C 13 118.233 0.016 . 3 . . . A 534 TYR CE2 . 17638 1
277 . 1 1 28 28 TYR N N 15 115.671 0.283 . 1 . . . A 534 TYR N . 17638 1
278 . 1 1 29 29 PHE H H 1 8.186 0.201 . 1 . . . A 535 PHE H . 17638 1
279 . 1 1 29 29 PHE HA H 1 4.403 0.111 . 1 . . . A 535 PHE HA . 17638 1
280 . 1 1 29 29 PHE HB2 H 1 2.902 0.000 . 2 . . . . 535 Phe HB2 . 17638 1
281 . 1 1 29 29 PHE HB3 H 1 2.940 0.000 . 2 . . . . 535 Phe HB3 . 17638 1
282 . 1 1 29 29 PHE HD1 H 1 7.248 0.012 . 3 . . . . 535 Phe HD# . 17638 1
283 . 1 1 29 29 PHE HD2 H 1 7.248 0.012 . 3 . . . . 535 Phe HD# . 17638 1
284 . 1 1 29 29 PHE HZ H 1 7.115 0.008 . 1 . . . A 535 PHE HZ . 17638 1
285 . 1 1 29 29 PHE CA C 13 58.756 0.095 . 1 . . . A 535 PHE CA . 17638 1
286 . 1 1 29 29 PHE CD1 C 13 131.132 0.067 . 3 . . . A 535 PHE CD1 . 17638 1
287 . 1 1 29 29 PHE CZ C 13 129.351 0.095 . 1 . . . A 535 PHE CZ . 17638 1
288 . 1 1 30 30 GLY H H 1 7.977 0.023 . 1 . . . A 536 GLY H . 17638 1
289 . 1 1 30 30 GLY HA2 H 1 3.612 0.003 . 2 . . . . 536 Gly QA . 17638 1
290 . 1 1 30 30 GLY HA3 H 1 3.612 0.003 . 2 . . . . 536 Gly QA . 17638 1
291 . 1 1 30 30 GLY CA C 13 46.913 0.000 . 1 . . . A 536 GLY CA . 17638 1
292 . 1 1 30 30 GLY N N 15 107.210 0.243 . 1 . . . A 536 GLY N . 17638 1
293 . 1 1 31 31 PRO HA H 1 4.332 0.003 . 1 . . . A 537 PRO HA . 17638 1
294 . 1 1 31 31 PRO HB2 H 1 2.313 0.007 . 2 . . . . 537 Pro HB2 . 17638 1
295 . 1 1 31 31 PRO HG2 H 1 1.918 0.022 . 2 . . . . 537 Pro QG . 17638 1
296 . 1 1 31 31 PRO HG3 H 1 1.918 0.022 . 2 . . . . 537 Pro QG . 17638 1
297 . 1 1 31 31 PRO CA C 13 64.489 0.128 . 1 . . . A 537 PRO CA . 17638 1
298 . 1 1 31 31 PRO CB C 13 32.000 0.000 . 1 . . . A 537 PRO CB . 17638 1
299 . 1 1 32 32 ALA H H 1 7.957 0.031 . 1 . . . A 538 ALA H . 17638 1
300 . 1 1 32 32 ALA HA H 1 4.217 0.006 . 1 . . . A 538 ALA HA . 17638 1
301 . 1 1 32 32 ALA HB1 H 1 1.404 0.018 . 1 . . . . 538 Ala HB2 . 17638 1
302 . 1 1 32 32 ALA HB2 H 1 1.404 0.018 . 1 . . . . 538 Ala HB2 . 17638 1
303 . 1 1 32 32 ALA HB3 H 1 1.404 0.018 . 1 . . . . 538 Ala HB2 . 17638 1
304 . 1 1 32 32 ALA CA C 13 53.829 0.048 . 1 . . . A 538 ALA CA . 17638 1
305 . 1 1 32 32 ALA CB C 13 19.177 0.291 . 1 . . . A 538 ALA CB . 17638 1
306 . 1 1 32 32 ALA N N 15 120.906 0.302 . 1 . . . A 538 ALA N . 17638 1
307 . 1 1 33 33 ALA H H 1 8.139 0.035 . 1 . . . A 539 ALA H . 17638 1
308 . 1 1 33 33 ALA HA H 1 4.077 0.007 . 1 . . . A 539 ALA HA . 17638 1
309 . 1 1 33 33 ALA HB1 H 1 1.365 0.013 . 1 . . . . 539 Ala HB2 . 17638 1
310 . 1 1 33 33 ALA HB2 H 1 1.365 0.013 . 1 . . . . 539 Ala HB2 . 17638 1
311 . 1 1 33 33 ALA HB3 H 1 1.365 0.013 . 1 . . . . 539 Ala HB2 . 17638 1
312 . 1 1 33 33 ALA CA C 13 53.882 0.049 . 1 . . . A 539 ALA CA . 17638 1
313 . 1 1 33 33 ALA CB C 13 19.360 0.386 . 1 . . . A 539 ALA CB . 17638 1
314 . 1 1 33 33 ALA N N 15 120.550 0.307 . 1 . . . A 539 ALA N . 17638 1
315 . 1 1 34 34 GLU H H 1 8.105 0.040 . 1 . . . A 540 GLU H . 17638 1
316 . 1 1 34 34 GLU HA H 1 4.083 0.008 . 1 . . . A 540 GLU HA . 17638 1
317 . 1 1 34 34 GLU HB2 H 1 2.035 0.020 . 2 . . . . 540 Glu HB2 . 17638 1
318 . 1 1 34 34 GLU HG2 H 1 2.312 0.010 . 2 . . . . 540 Glu QG . 17638 1
319 . 1 1 34 34 GLU HG3 H 1 2.312 0.010 . 2 . . . . 540 Glu QG . 17638 1
320 . 1 1 34 34 GLU CA C 13 58.411 0.103 . 1 . . . A 540 GLU CA . 17638 1
321 . 1 1 34 34 GLU CB C 13 29.460 0.087 . 1 . . . A 540 GLU CB . 17638 1
322 . 1 1 34 34 GLU CG C 13 35.548 0.000 . 1 . . . A 540 GLU CG . 17638 1
323 . 1 1 34 34 GLU N N 15 117.055 0.327 . 1 . . . A 540 GLU N . 17638 1
324 . 1 1 35 35 GLY H H 1 8.142 0.027 . 1 . . . A 541 GLY H . 17638 1
325 . 1 1 35 35 GLY HA2 H 1 3.914 0.034 . 2 . . . . 541 Gly QA . 17638 1
326 . 1 1 35 35 GLY HA3 H 1 3.914 0.034 . 2 . . . . 541 Gly QA . 17638 1
327 . 1 1 35 35 GLY CA C 13 46.338 0.024 . 1 . . . A 541 GLY CA . 17638 1
328 . 1 1 35 35 GLY N N 15 106.976 0.288 . 1 . . . A 541 GLY N . 17638 1
329 . 1 1 36 36 ILE H H 1 7.787 0.026 . 1 . . . A 542 ILE H . 17638 1
330 . 1 1 36 36 ILE HA H 1 3.965 0.003 . 1 . . . A 542 ILE HA . 17638 1
331 . 1 1 36 36 ILE HB H 1 1.849 0.009 . 1 . . . A 542 ILE HB . 17638 1
332 . 1 1 36 36 ILE HG12 H 1 1.526 0.000 . 2 . . . . 542 Ile HG12 . 17638 1
333 . 1 1 36 36 ILE HG13 H 1 1.362 0.002 . 2 . . . . 542 Ile HG13 . 17638 1
334 . 1 1 36 36 ILE HG21 H 1 1.083 0.000 . 1 . . . . 542 Ile QG2 . 17638 1
335 . 1 1 36 36 ILE HG22 H 1 1.083 0.000 . 1 . . . . 542 Ile QG2 . 17638 1
336 . 1 1 36 36 ILE HG23 H 1 1.083 0.000 . 1 . . . . 542 Ile QG2 . 17638 1
337 . 1 1 36 36 ILE HD11 H 1 0.813 0.015 . 1 . . . . 542 Ile QD1 . 17638 1
338 . 1 1 36 36 ILE HD12 H 1 0.813 0.015 . 1 . . . . 542 Ile QD1 . 17638 1
339 . 1 1 36 36 ILE HD13 H 1 0.813 0.015 . 1 . . . . 542 Ile QD1 . 17638 1
340 . 1 1 36 36 ILE CA C 13 62.756 0.254 . 1 . . . A 542 ILE CA . 17638 1
341 . 1 1 36 36 ILE CB C 13 38.501 0.031 . 1 . . . A 542 ILE CB . 17638 1
342 . 1 1 36 36 ILE N N 15 119.923 0.273 . 1 . . . A 542 ILE N . 17638 1
343 . 1 1 37 37 TYR H H 1 8.102 0.036 . 1 . . . A 543 TYR H . 17638 1
344 . 1 1 37 37 TYR HA H 1 4.361 0.057 . 1 . . . A 543 TYR HA . 17638 1
345 . 1 1 37 37 TYR HB2 H 1 3.061 0.035 . 2 . . . . 543 Tyr HB2 . 17638 1
346 . 1 1 37 37 TYR HD1 H 1 7.044 0.015 . 3 . . . . 543 Tyr HD# . 17638 1
347 . 1 1 37 37 TYR HD2 H 1 7.044 0.015 . 3 . . . . 543 Tyr HD# . 17638 1
348 . 1 1 37 37 TYR HE1 H 1 6.774 0.014 . 3 . . . . 543 Tyr QE . 17638 1
349 . 1 1 37 37 TYR HE2 H 1 6.774 0.014 . 3 . . . . 543 Tyr QE . 17638 1
350 . 1 1 37 37 TYR CA C 13 59.915 0.074 . 1 . . . A 543 TYR CA . 17638 1
351 . 1 1 37 37 TYR CB C 13 38.681 0.116 . 1 . . . A 543 TYR CB . 17638 1
352 . 1 1 37 37 TYR CD2 C 13 132.997 0.119 . 3 . . . A 543 TYR CD2 . 17638 1
353 . 1 1 37 37 TYR CE2 C 13 118.361 0.141 . 3 . . . A 543 TYR CE2 . 17638 1
354 . 1 1 37 37 TYR N N 15 122.099 0.335 . 1 . . . A 543 TYR N . 17638 1
355 . 1 1 38 38 ILE H H 1 8.135 0.036 . 1 . . . A 544 ILE H . 17638 1
356 . 1 1 38 38 ILE HA H 1 3.915 0.217 . 1 . . . A 544 ILE HA . 17638 1
357 . 1 1 38 38 ILE HB H 1 1.915 0.006 . 1 . . . A 544 ILE HB . 17638 1
358 . 1 1 38 38 ILE HG12 H 1 1.594 0.017 . 2 . . . . 544 Ile HG12 . 17638 1
359 . 1 1 38 38 ILE HG13 H 1 1.256 0.016 . 2 . . . . 544 Ile HG13 . 17638 1
360 . 1 1 38 38 ILE HD11 H 1 0.849 0.016 . 1 . . . . 544 Ile QD1 . 17638 1
361 . 1 1 38 38 ILE HD12 H 1 0.849 0.016 . 1 . . . . 544 Ile QD1 . 17638 1
362 . 1 1 38 38 ILE HD13 H 1 0.849 0.016 . 1 . . . . 544 Ile QD1 . 17638 1
363 . 1 1 38 38 ILE CA C 13 63.016 0.043 . 1 . . . A 544 ILE CA . 17638 1
364 . 1 1 38 38 ILE CB C 13 37.894 0.060 . 1 . . . A 544 ILE CB . 17638 1
365 . 1 1 38 38 ILE CG1 C 13 28.216 0.020 . 1 . . . A 544 ILE CG1 . 17638 1
366 . 1 1 38 38 ILE N N 15 119.747 0.293 . 1 . . . A 544 ILE N . 17638 1
367 . 1 1 39 39 GLU H H 1 8.253 0.046 . 1 . . . A 545 GLU H . 17638 1
368 . 1 1 39 39 GLU HA H 1 4.042 0.010 . 1 . . . A 545 GLU HA . 17638 1
369 . 1 1 39 39 GLU HB2 H 1 2.037 0.029 . 2 . . . . 545 Glu HB2 . 17638 1
370 . 1 1 39 39 GLU HG2 H 1 2.322 0.020 . 2 . . . . 545 Glu QG . 17638 1
371 . 1 1 39 39 GLU HG3 H 1 2.322 0.020 . 2 . . . . 545 Glu QG . 17638 1
372 . 1 1 39 39 GLU CA C 13 58.666 0.062 . 1 . . . A 545 GLU CA . 17638 1
373 . 1 1 39 39 GLU CB C 13 29.338 0.061 . 1 . . . A 545 GLU CB . 17638 1
374 . 1 1 39 39 GLU CG C 13 35.535 0.065 . 1 . . . A 545 GLU CG . 17638 1
375 . 1 1 39 39 GLU N N 15 120.770 0.310 . 1 . . . A 545 GLU N . 17638 1
376 . 1 1 40 40 GLY H H 1 8.041 0.029 . 1 . . . A 546 GLY H . 17638 1
377 . 1 1 40 40 GLY HA2 H 1 3.833 0.011 . 2 . . . . 546 Gly QA . 17638 1
378 . 1 1 40 40 GLY HA3 H 1 3.833 0.011 . 2 . . . . 546 Gly QA . 17638 1
379 . 1 1 40 40 GLY CA C 13 46.273 0.024 . 1 . . . A 546 GLY CA . 17638 1
380 . 1 1 40 40 GLY N N 15 107.062 0.264 . 1 . . . A 546 GLY N . 17638 1
381 . 1 1 41 41 LEU H H 1 7.830 0.031 . 1 . . . A 547 LEU H . 17638 1
382 . 1 1 41 41 LEU HA H 1 4.256 0.031 . 1 . . . A 547 LEU HA . 17638 1
383 . 1 1 41 41 LEU HB2 H 1 1.586 0.019 . 2 . . . . 547 Leu HB2 . 17638 1
384 . 1 1 41 41 LEU HG H 1 1.588 0.000 . 1 . . . A 547 LEU HG . 17638 1
385 . 1 1 41 41 LEU HD11 H 1 0.843 0.021 . 2 . . . . 547 Leu QQD . 17638 1
386 . 1 1 41 41 LEU HD12 H 1 0.843 0.021 . 2 . . . . 547 Leu QQD . 17638 1
387 . 1 1 41 41 LEU HD13 H 1 0.843 0.021 . 2 . . . . 547 Leu QQD . 17638 1
388 . 1 1 41 41 LEU HD21 H 1 0.843 0.021 . 2 . . . . 547 Leu QQD . 17638 1
389 . 1 1 41 41 LEU HD22 H 1 0.843 0.021 . 2 . . . . 547 Leu QQD . 17638 1
390 . 1 1 41 41 LEU HD23 H 1 0.843 0.021 . 2 . . . . 547 Leu QQD . 17638 1
391 . 1 1 41 41 LEU CA C 13 56.456 0.008 . 1 . . . A 547 LEU CA . 17638 1
392 . 1 1 41 41 LEU CB C 13 42.692 0.029 . 1 . . . A 547 LEU CB . 17638 1
393 . 1 1 41 41 LEU N N 15 120.564 0.307 . 1 . . . A 547 LEU N . 17638 1
394 . 1 1 42 42 MET H H 1 7.945 0.032 . 1 . . . A 548 MET H . 17638 1
395 . 1 1 42 42 MET HA H 1 4.280 0.021 . 1 . . . A 548 MET HA . 17638 1
396 . 1 1 42 42 MET HB2 H 1 1.967 0.015 . 2 . . . . 548 Met HB2 . 17638 1
397 . 1 1 42 42 MET HG2 H 1 2.492 0.046 . 2 . . . . 548 Met HG2 . 17638 1
398 . 1 1 42 42 MET HG3 H 1 2.413 0.010 . 2 . . . . 548 Met HG3 . 17638 1
399 . 1 1 42 42 MET HE1 H 1 2.003 0.007 . 1 . . . . 548 Met QE . 17638 1
400 . 1 1 42 42 MET HE2 H 1 2.003 0.007 . 1 . . . . 548 Met QE . 17638 1
401 . 1 1 42 42 MET HE3 H 1 2.003 0.007 . 1 . . . . 548 Met QE . 17638 1
402 . 1 1 42 42 MET CA C 13 56.185 0.014 . 1 . . . A 548 MET CA . 17638 1
403 . 1 1 42 42 MET CB C 13 32.407 0.127 . 1 . . . A 548 MET CB . 17638 1
404 . 1 1 42 42 MET CG C 13 32.562 0.060 . 1 . . . A 548 MET CG . 17638 1
405 . 1 1 42 42 MET CE C 13 17.202 0.035 . 1 . . . A 548 MET CE . 17638 1
406 . 1 1 42 42 MET N N 15 115.645 0.321 . 1 . . . A 548 MET N . 17638 1
407 . 1 1 43 43 HIS H H 1 8.056 0.033 . 1 . . . A 549 HIS H . 17638 1
408 . 1 1 43 43 HIS HA H 1 4.299 0.000 . 1 . . . A 549 HIS HA . 17638 1
409 . 1 1 43 43 HIS HB2 H 1 3.179 0.054 . 2 . . . . 549 His HB2 . 17638 1
410 . 1 1 43 43 HIS HB3 H 1 3.162 0.002 . 2 . . . . 549 His HB3 . 17638 1
411 . 1 1 43 43 HIS HD2 H 1 7.295 0.004 . 1 . . . . 549 His HD2 . 17638 1
412 . 1 1 43 43 HIS HE1 H 1 7.916 0.635 . 1 . . . . 549 His HE1 . 17638 1
413 . 1 1 43 43 HIS CA C 13 55.951 0.003 . 1 . . . A 549 HIS CA . 17638 1
414 . 1 1 43 43 HIS CB C 13 29.265 0.092 . 1 . . . A 549 HIS CB . 17638 1
415 . 1 1 43 43 HIS CD2 C 13 120.171 0.108 . 1 . . . A 549 HIS CD2 . 17638 1
416 . 1 1 43 43 HIS CE1 C 13 136.274 0.278 . 1 . . . A 549 HIS CE1 . 17638 1
417 . 1 1 43 43 HIS N N 15 116.850 0.288 . 1 . . . A 549 HIS N . 17638 1
418 . 1 1 44 44 ASN H H 1 8.251 0.033 . 1 . . . A 550 ASN H . 17638 1
419 . 1 1 44 44 ASN HA H 1 4.686 0.025 . 1 . . . A 550 ASN HA . 17638 1
420 . 1 1 44 44 ASN HB2 H 1 2.820 0.013 . 2 . . . . 550 Asn HB2 . 17638 1
421 . 1 1 44 44 ASN HD21 H 1 7.654 0.000 . 2 . . . . 550 Asn HD21 . 17638 1
422 . 1 1 44 44 ASN HD22 H 1 6.957 0.003 . 2 . . . . 550 Asn HD22 . 17638 1
423 . 1 1 44 44 ASN CA C 13 53.703 0.020 . 1 . . . A 550 ASN CA . 17638 1
424 . 1 1 44 44 ASN CB C 13 39.012 0.087 . 1 . . . A 550 ASN CB . 17638 1
425 . 1 1 44 44 ASN N N 15 118.729 0.311 . 1 . . . A 550 ASN N . 17638 1
426 . 1 1 45 45 GLN H H 1 8.404 0.033 . 1 . . . A 551 GLN H . 17638 1
427 . 1 1 45 45 GLN HA H 1 4.305 0.009 . 1 . . . A 551 GLN HA . 17638 1
428 . 1 1 45 45 GLN HB2 H 1 1.947 0.000 . 2 . . . . 551 Gln HB2 . 17638 1
429 . 1 1 45 45 GLN HB3 H 1 2.021 0.000 . 2 . . . . 551 Gln HB3 . 17638 1
430 . 1 1 45 45 GLN HG2 H 1 2.331 0.020 . 2 . . . . 551 Gln QG . 17638 1
431 . 1 1 45 45 GLN HG3 H 1 2.331 0.020 . 2 . . . . 551 Gln QG . 17638 1
432 . 1 1 45 45 GLN HE21 H 1 7.479 0.000 . 2 . . . . 551 Gln HE21 . 17638 1
433 . 1 1 45 45 GLN HE22 H 1 6.784 0.000 . 2 . . . . 551 Gln HE22 . 17638 1
434 . 1 1 45 45 GLN CA C 13 56.486 0.071 . 1 . . . A 551 GLN CA . 17638 1
435 . 1 1 45 45 GLN CB C 13 29.224 0.070 . 1 . . . A 551 GLN CB . 17638 1
436 . 1 1 45 45 GLN CG C 13 33.794 0.110 . 1 . . . A 551 GLN CG . 17638 1
437 . 1 1 45 45 GLN N N 15 120.189 0.325 . 1 . . . A 551 GLN N . 17638 1
438 . 1 1 46 46 ASP H H 1 8.255 0.033 . 1 . . . A 552 ASP H . 17638 1
439 . 1 1 46 46 ASP HA H 1 4.537 0.008 . 1 . . . A 552 ASP HA . 17638 1
440 . 1 1 46 46 ASP HB2 H 1 2.186 0.364 . 2 . . . . 552 Asp HB2 . 17638 1
441 . 1 1 46 46 ASP CA C 13 55.230 0.017 . 1 . . . A 552 ASP CA . 17638 1
442 . 1 1 46 46 ASP CB C 13 41.088 0.066 . 1 . . . A 552 ASP CB . 17638 1
443 . 1 1 46 46 ASP N N 15 119.802 0.325 . 1 . . . A 552 ASP N . 17638 1
444 . 1 1 47 47 GLY H H 1 8.196 0.027 . 1 . . . A 553 GLY H . 17638 1
445 . 1 1 47 47 GLY HA2 H 1 3.911 0.001 . 2 . . . . 553 Gly QA . 17638 1
446 . 1 1 47 47 GLY HA3 H 1 3.911 0.001 . 2 . . . . 553 Gly QA . 17638 1
447 . 1 1 47 47 GLY CA C 13 45.821 0.007 . 1 . . . A 553 GLY CA . 17638 1
448 . 1 1 47 47 GLY N N 15 108.145 0.275 . 1 . . . A 553 GLY N . 17638 1
449 . 1 1 48 48 LEU H H 1 8.162 0.029 . 1 . . . A 554 LEU H . 17638 1
450 . 1 1 48 48 LEU HA H 1 4.254 0.019 . 1 . . . A 554 LEU HA . 17638 1
451 . 1 1 48 48 LEU HB2 H 1 1.686 0.030 . 2 . . . . 554 Leu HB2 . 17638 1
452 . 1 1 48 48 LEU HG H 1 1.606 0.010 . 1 . . . A 554 LEU HG . 17638 1
453 . 1 1 48 48 LEU HD11 H 1 0.855 0.011 . 2 . . . . 554 Leu QQD . 17638 1
454 . 1 1 48 48 LEU HD12 H 1 0.855 0.011 . 2 . . . . 554 Leu QQD . 17638 1
455 . 1 1 48 48 LEU HD13 H 1 0.855 0.011 . 2 . . . . 554 Leu QQD . 17638 1
456 . 1 1 48 48 LEU HD21 H 1 0.855 0.011 . 2 . . . . 554 Leu QQD . 17638 1
457 . 1 1 48 48 LEU HD22 H 1 0.855 0.011 . 2 . . . . 554 Leu QQD . 17638 1
458 . 1 1 48 48 LEU HD23 H 1 0.855 0.011 . 2 . . . . 554 Leu QQD . 17638 1
459 . 1 1 48 48 LEU CA C 13 56.388 0.117 . 1 . . . A 554 LEU CA . 17638 1
460 . 1 1 48 48 LEU CB C 13 42.671 0.116 . 1 . . . A 554 LEU CB . 17638 1
461 . 1 1 48 48 LEU N N 15 121.767 0.275 . 1 . . . A 554 LEU N . 17638 1
462 . 1 1 49 49 ILE H H 1 8.049 0.041 . 1 . . . A 555 ILE H . 17638 1
463 . 1 1 49 49 ILE HA H 1 4.027 0.019 . 1 . . . A 555 ILE HA . 17638 1
464 . 1 1 49 49 ILE HB H 1 1.894 0.010 . 1 . . . A 555 ILE HB . 17638 1
465 . 1 1 49 49 ILE HG12 H 1 1.537 0.000 . 2 . . . . 555 Ile HG12 . 17638 1
466 . 1 1 49 49 ILE HG13 H 1 1.150 0.017 . 2 . . . . 555 Ile HG13 . 17638 1
467 . 1 1 49 49 ILE HD11 H 1 0.845 0.013 . 1 . . . . 555 Ile QD1 . 17638 1
468 . 1 1 49 49 ILE HD12 H 1 0.845 0.013 . 1 . . . . 555 Ile QD1 . 17638 1
469 . 1 1 49 49 ILE HD13 H 1 0.845 0.013 . 1 . . . . 555 Ile QD1 . 17638 1
470 . 1 1 49 49 ILE CA C 13 62.043 0.097 . 1 . . . A 555 ILE CA . 17638 1
471 . 1 1 49 49 ILE CB C 13 38.210 0.088 . 1 . . . A 555 ILE CB . 17638 1
472 . 1 1 49 49 ILE N N 15 117.672 0.379 . 1 . . . A 555 ILE N . 17638 1
473 . 1 1 50 50 CYS H H 1 8.285 0.043 . 1 . . . A 556 CYS H . 17638 1
474 . 1 1 50 50 CYS HA H 1 4.539 0.004 . 1 . . . A 556 CYS HA . 17638 1
475 . 1 1 50 50 CYS HB2 H 1 2.930 0.016 . 2 . . . . 556 Cys HB2 . 17638 1
476 . 1 1 50 50 CYS HB3 H 1 3.144 0.011 . 2 . . . . 556 Cys HB3 . 17638 1
477 . 1 1 50 50 CYS CA C 13 56.069 0.198 . 1 . . . A 556 CYS CA . 17638 1
478 . 1 1 50 50 CYS CB C 13 41.071 0.017 . 1 . . . A 556 CYS CB . 17638 1
479 . 1 1 50 50 CYS N N 15 119.628 0.289 . 1 . . . A 556 CYS N . 17638 1
480 . 1 1 51 51 GLY H H 1 8.196 0.033 . 1 . . . A 557 GLY H . 17638 1
481 . 1 1 51 51 GLY HA2 H 1 3.894 0.020 . 2 . . . . 557 Gly QA . 17638 1
482 . 1 1 51 51 GLY HA3 H 1 3.894 0.020 . 2 . . . . 557 Gly QA . 17638 1
483 . 1 1 51 51 GLY CA C 13 45.823 0.139 . 1 . . . A 557 GLY CA . 17638 1
484 . 1 1 51 51 GLY N N 15 108.767 0.299 . 1 . . . A 557 GLY N . 17638 1
485 . 1 1 52 52 LEU H H 1 7.902 0.025 . 1 . . . A 558 LEU H . 17638 1
486 . 1 1 52 52 LEU HA H 1 4.325 0.013 . 1 . . . A 558 LEU HA . 17638 1
487 . 1 1 52 52 LEU HB2 H 1 1.683 0.019 . 2 . . . . 558 Leu HB2 . 17638 1
488 . 1 1 52 52 LEU HG H 1 1.573 0.008 . 1 . . . A 558 LEU HG . 17638 1
489 . 1 1 52 52 LEU HD11 H 1 0.845 0.014 . 2 . . . . 558 Leu QQD . 17638 1
490 . 1 1 52 52 LEU HD12 H 1 0.845 0.014 . 2 . . . . 558 Leu QQD . 17638 1
491 . 1 1 52 52 LEU HD13 H 1 0.845 0.014 . 2 . . . . 558 Leu QQD . 17638 1
492 . 1 1 52 52 LEU HD21 H 1 0.845 0.014 . 2 . . . . 558 Leu QQD . 17638 1
493 . 1 1 52 52 LEU HD22 H 1 0.845 0.014 . 2 . . . . 558 Leu QQD . 17638 1
494 . 1 1 52 52 LEU HD23 H 1 0.845 0.014 . 2 . . . . 558 Leu QQD . 17638 1
495 . 1 1 52 52 LEU CA C 13 55.658 0.183 . 1 . . . A 558 LEU CA . 17638 1
496 . 1 1 52 52 LEU CB C 13 42.719 0.036 . 1 . . . A 558 LEU CB . 17638 1
497 . 1 1 52 52 LEU N N 15 120.550 0.276 . 1 . . . A 558 LEU N . 17638 1
498 . 1 1 53 53 ARG H H 1 8.073 0.031 . 1 . . . A 559 ARG H . 17638 1
499 . 1 1 53 53 ARG HA H 1 4.339 0.011 . 1 . . . A 559 ARG HA . 17638 1
500 . 1 1 53 53 ARG HB2 H 1 1.897 0.018 . 2 . . . . 559 Arg HB2 . 17638 1
501 . 1 1 53 53 ARG HG2 H 1 1.669 0.009 . 2 . . . . 559 Arg HG2 . 17638 1
502 . 1 1 53 53 ARG HG3 H 1 1.639 0.011 . 2 . . . . 559 Arg HG3 . 17638 1
503 . 1 1 53 53 ARG HD2 H 1 3.157 0.011 . 2 . . . . 559 Arg HD# . 17638 1
504 . 1 1 53 53 ARG HD3 H 1 3.157 0.011 . 2 . . . . 559 Arg HD# . 17638 1
505 . 1 1 53 53 ARG HH11 H 1 7.360 0.000 . 2 . . . . 559 Arg HH11 . 17638 1
506 . 1 1 53 53 ARG HH21 H 1 6.778 0.000 . 2 . . . . 559 Arg HH21 . 17638 1
507 . 1 1 53 53 ARG CA C 13 55.843 0.093 . 1 . . . A 559 ARG CA . 17638 1
508 . 1 1 53 53 ARG CB C 13 31.135 0.177 . 1 . . . A 559 ARG CB . 17638 1
509 . 1 1 53 53 ARG CG C 13 27.147 0.048 . 1 . . . A 559 ARG CG . 17638 1
510 . 1 1 53 53 ARG CD C 13 43.504 0.071 . 1 . . . A 559 ARG CD . 17638 1
511 . 1 1 53 53 ARG N N 15 119.963 0.305 . 1 . . . A 559 ARG N . 17638 1
512 . 1 1 54 54 GLN H H 1 7.906 0.025 . 1 . . . A 560 GLN H . 17638 1
513 . 1 1 54 54 GLN HA H 1 4.120 0.019 . 1 . . . A 560 GLN HA . 17638 1
514 . 1 1 54 54 GLN HB2 H 1 2.053 0.004 . 2 . . . . 560 Gln HB2 . 17638 1
515 . 1 1 54 54 GLN HB3 H 1 1.909 0.007 . 2 . . . . 560 Gln HB3 . 17638 1
516 . 1 1 54 54 GLN HG2 H 1 2.272 0.011 . 2 . . . . 560 Gln QG . 17638 1
517 . 1 1 54 54 GLN HG3 H 1 2.272 0.011 . 2 . . . . 560 Gln QG . 17638 1
518 . 1 1 54 54 GLN HE21 H 1 7.465 0.000 . 2 . . . . 560 Gln HE21 . 17638 1
519 . 1 1 54 54 GLN HE22 H 1 6.789 0.000 . 2 . . . . 560 Gln HE22 . 17638 1
520 . 1 1 54 54 GLN CA C 13 57.460 0.036 . 1 . . . A 560 GLN CA . 17638 1
521 . 1 1 54 54 GLN CB C 13 30.490 0.131 . 1 . . . A 560 GLN CB . 17638 1
522 . 1 1 54 54 GLN CG C 13 34.236 0.186 . 1 . . . A 560 GLN CG . 17638 1
523 . 1 1 54 54 GLN N N 15 126.021 0.263 . 1 . . . A 560 GLN N . 17638 1
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