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 17113
_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' . . . 17113 1
2 '2D 1H-13C HSQC' . . . 17113 1
3 '3D CBCA(CO)NH' . . . 17113 1
4 '3D HNCO' . . . 17113 1
5 '3D HNCACB' . . . 17113 1
6 '3D HN(CO)CA' . . . 17113 1
7 '3D C(CO)NH' . . . 17113 1
11 '3D HCCH-TOCSY' . . . 17113 1
12 '3D 1H-15N TOCSY' . . . 17113 1
13 '2D (HB)CB(CGCDCE)HE' . . . 17113 1
14 '2D (HB)CB(CGCD)HD' . . . 17113 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 3 3 PRO HA H 1 4.43885 0.01248 . 1 . . . . 151 Pro HA . 17113 1
2 . 1 1 3 3 PRO HB2 H 1 1.78883 0.01282 . 2 . . . . 151 Pro HB2 . 17113 1
3 . 1 1 3 3 PRO HB3 H 1 2.25042 0.00331 . 2 . . . . 151 Pro HB3 . 17113 1
4 . 1 1 3 3 PRO HD2 H 1 3.72967 0.00182 . 2 . . . . 151 Pro HD2 . 17113 1
5 . 1 1 3 3 PRO HD3 H 1 3.85084 0.00173 . 2 . . . . 151 Pro HD3 . 17113 1
6 . 1 1 3 3 PRO HG2 H 1 1.98331 0.00462 . 2 . . . . 151 Pro HG2 . 17113 1
7 . 1 1 3 3 PRO HG3 H 1 1.99813 0.00644 . 2 . . . . 151 Pro HG3 . 17113 1
8 . 1 1 3 3 PRO C C 13 176.31907 0.01216 . 1 . . . . 151 Pro C . 17113 1
9 . 1 1 3 3 PRO CA C 13 63.21305 0.13528 . 1 . . . . 151 Pro CA . 17113 1
10 . 1 1 3 3 PRO CB C 13 32.2103 0.0864 . 1 . . . . 151 Pro CB . 17113 1
11 . 1 1 3 3 PRO CD C 13 50.74186 0.0376 . 1 . . . . 151 Pro CD . 17113 1
12 . 1 1 3 3 PRO CG C 13 27.36232 0.02403 . 1 . . . . 151 Pro CG . 17113 1
13 . 1 1 4 4 GLU H H 1 8.44411 0.0024 . 1 . . . . 152 Glu H . 17113 1
14 . 1 1 4 4 GLU HA H 1 4.1865 0.00502 . 1 . . . . 152 Glu HA . 17113 1
15 . 1 1 4 4 GLU HB2 H 1 1.89239 0.01553 . 2 . . . . 152 Glu HB2 . 17113 1
16 . 1 1 4 4 GLU HB3 H 1 1.95472 0.0059 . 2 . . . . 152 Glu HB3 . 17113 1
17 . 1 1 4 4 GLU HG2 H 1 2.07086 0.0056 . 2 . . . . 152 Glu HG2 . 17113 1
18 . 1 1 4 4 GLU HG3 H 1 2.24626 0.00316 . 2 . . . . 152 Glu HG3 . 17113 1
19 . 1 1 4 4 GLU C C 13 175.20743 0.03799 . 1 . . . . 152 Glu C . 17113 1
20 . 1 1 4 4 GLU CA C 13 56.80879 0.05973 . 1 . . . . 152 Glu CA . 17113 1
21 . 1 1 4 4 GLU CB C 13 30.55172 0.08942 . 1 . . . . 152 Glu CB . 17113 1
22 . 1 1 4 4 GLU CG C 13 36.3322 0.05801 . 1 . . . . 152 Glu CG . 17113 1
23 . 1 1 4 4 GLU N N 15 121.58483 0.03379 . 1 . . . . 152 Glu N . 17113 1
24 . 1 1 5 5 PHE H H 1 7.69847 0.00549 . 1 . . . . 153 Phe H . 17113 1
25 . 1 1 5 5 PHE HA H 1 5.23251 0.01409 . 1 . . . . 153 Phe HA . 17113 1
26 . 1 1 5 5 PHE HB2 H 1 2.60651 0.00285 . 2 . . . . 153 Phe HB2 . 17113 1
27 . 1 1 5 5 PHE HB3 H 1 2.72329 0.00264 . 2 . . . . 153 Phe HB3 . 17113 1
28 . 1 1 5 5 PHE HD1 H 1 7.03022 0.00654 . 3 . . . . 153 Phe HD* . 17113 1
29 . 1 1 5 5 PHE HD2 H 1 7.03022 0.00654 . 3 . . . . 153 Phe HD* . 17113 1
30 . 1 1 5 5 PHE HE1 H 1 7.20369 0.00575 . 3 . . . . 153 Phe HE* . 17113 1
31 . 1 1 5 5 PHE HE2 H 1 7.20369 0.00575 . 3 . . . . 153 Phe HE* . 17113 1
32 . 1 1 5 5 PHE HZ H 1 7.13082 0.00731 . 1 . . . . 153 Phe HZ . 17113 1
33 . 1 1 5 5 PHE C C 13 174.66686 0.00796 . 1 . . . . 153 Phe C . 17113 1
34 . 1 1 5 5 PHE CA C 13 55.68396 0.10194 . 1 . . . . 153 Phe CA . 17113 1
35 . 1 1 5 5 PHE CB C 13 41.81702 0.08667 . 1 . . . . 153 Phe CB . 17113 1
36 . 1 1 5 5 PHE CD1 C 13 131.88984 0.04322 . 3 . . . . 153 Phe CD . 17113 1
37 . 1 1 5 5 PHE CD2 C 13 131.88984 0.04322 . 3 . . . . 153 Phe CD . 17113 1
38 . 1 1 5 5 PHE CE1 C 13 131.12886 0.04386 . 3 . . . . 153 Phe CE . 17113 1
39 . 1 1 5 5 PHE CE2 C 13 131.12886 0.04386 . 3 . . . . 153 Phe CE . 17113 1
40 . 1 1 5 5 PHE CZ C 13 130.08186 0.08591 . 1 . . . . 153 Phe CZ . 17113 1
41 . 1 1 5 5 PHE N N 15 119.1607 0.05629 . 1 . . . . 153 Phe N . 17113 1
42 . 1 1 6 6 HIS H H 1 8.98901 0.01239 . 1 . . . . 154 His H . 17113 1
43 . 1 1 6 6 HIS HD2 H 1 6.47709 0.03281 . 1 . . . . 154 His HD2 . 17113 1
44 . 1 1 6 6 HIS CA C 13 55.5661 0.3 . 1 . . . . 154 His CA . 17113 1
45 . 1 1 6 6 HIS CB C 13 32.44008 0.11113 . 1 . . . . 154 His CB . 17113 1
46 . 1 1 6 6 HIS CD2 C 13 119.18024 0.0229 . 1 . . . . 154 His CD2 . 17113 1
47 . 1 1 6 6 HIS N N 15 120.68581 0.03246 . 1 . . . . 154 His N . 17113 1
48 . 1 1 7 7 TYR HA H 1 5.51179 0.01124 . 1 . . . . 155 Tyr HA . 17113 1
49 . 1 1 7 7 TYR HB2 H 1 2.93792 0.00431 . 2 . . . . 155 Tyr HB2 . 17113 1
50 . 1 1 7 7 TYR HB3 H 1 3.15313 0.01571 . 2 . . . . 155 Tyr HB3 . 17113 1
51 . 1 1 7 7 TYR HD1 H 1 7.23718 0.00437 . 3 . . . . 155 Tyr HD* . 17113 1
52 . 1 1 7 7 TYR HD2 H 1 7.23718 0.00437 . 3 . . . . 155 Tyr HD* . 17113 1
53 . 1 1 7 7 TYR HE1 H 1 6.79186 0.00513 . 3 . . . . 155 Tyr HE* . 17113 1
54 . 1 1 7 7 TYR HE2 H 1 6.79186 0.00513 . 3 . . . . 155 Tyr HE* . 17113 1
55 . 1 1 7 7 TYR CA C 13 56.64951 0.07001 . 1 . . . . 155 Tyr CA . 17113 1
56 . 1 1 7 7 TYR CB C 13 38.24639 0.07682 . 1 . . . . 155 Tyr CB . 17113 1
57 . 1 1 7 7 TYR CD1 C 13 133.44929 0.06052 . 3 . . . . 155 Tyr CD* . 17113 1
58 . 1 1 7 7 TYR CD2 C 13 133.44929 0.06052 . 3 . . . . 155 Tyr CD* . 17113 1
59 . 1 1 7 7 TYR CE1 C 13 118.12332 0.05948 . 3 . . . . 155 Tyr CE* . 17113 1
60 . 1 1 7 7 TYR CE2 C 13 118.12332 0.05948 . 3 . . . . 155 Tyr CE* . 17113 1
61 . 1 1 8 8 ILE H H 1 7.52331 0.00628 . 1 . . . . 156 Ile H . 17113 1
62 . 1 1 8 8 ILE HA H 1 4.46216 0.0061 . 1 . . . . 156 Ile HA . 17113 1
63 . 1 1 8 8 ILE HB H 1 1.98465 0.01166 . 1 . . . . 156 Ile HB . 17113 1
64 . 1 1 8 8 ILE HD11 H 1 0.91023 0.00565 . 2 . . . . 156 Ile HD1* . 17113 1
65 . 1 1 8 8 ILE HD12 H 1 0.91023 0.00565 . 2 . . . . 156 Ile HD1* . 17113 1
66 . 1 1 8 8 ILE HD13 H 1 0.91023 0.00565 . 2 . . . . 156 Ile HD1* . 17113 1
67 . 1 1 8 8 ILE HG12 H 1 1.21685 0.00493 . 2 . . . . 156 Ile HG12 . 17113 1
68 . 1 1 8 8 ILE HG13 H 1 1.47028 0.00417 . 2 . . . . 156 Ile HG13 . 17113 1
69 . 1 1 8 8 ILE HG21 H 1 1.05224 0.00467 . 2 . . . . 156 Ile HG2* . 17113 1
70 . 1 1 8 8 ILE HG22 H 1 1.05224 0.00467 . 2 . . . . 156 Ile HG2* . 17113 1
71 . 1 1 8 8 ILE HG23 H 1 1.05224 0.00467 . 2 . . . . 156 Ile HG2* . 17113 1
72 . 1 1 8 8 ILE CA C 13 59.37993 0.10262 . 1 . . . . 156 Ile CA . 17113 1
73 . 1 1 8 8 ILE CB C 13 40.84164 0.06902 . 1 . . . . 156 Ile CB . 17113 1
74 . 1 1 8 8 ILE CD1 C 13 13.10604 0.03586 . 1 . . . . 156 Ile CD1 . 17113 1
75 . 1 1 8 8 ILE CG1 C 13 27.84711 0.05644 . 1 . . . . 156 Ile CG1 . 17113 1
76 . 1 1 8 8 ILE CG2 C 13 17.27409 0.10124 . 1 . . . . 156 Ile CG2 . 17113 1
77 . 1 1 8 8 ILE N N 15 123.80463 0.05942 . 1 . . . . 156 Ile N . 17113 1
78 . 1 1 10 10 ASN HA H 1 4.0637 0.00643 . 1 . . . . 158 Asn HA . 17113 1
79 . 1 1 10 10 ASN HB2 H 1 2.93574 0.00435 . 2 . . . . 158 Asn HB2 . 17113 1
80 . 1 1 10 10 ASN HB3 H 1 2.9465 0.00304 . 2 . . . . 158 Asn HB3 . 17113 1
81 . 1 1 10 10 ASN HD21 H 1 6.85841 0.00432 . 2 . . . . 158 Asn HD21 . 17113 1
82 . 1 1 10 10 ASN HD22 H 1 7.48918 0.00435 . 2 . . . . 158 Asn HD22 . 17113 1
83 . 1 1 10 10 ASN C C 13 174.2138 0.1 . 1 . . . . 158 Asn C . 17113 1
84 . 1 1 10 10 ASN CA C 13 55.54954 0.06661 . 1 . . . . 158 Asn CA . 17113 1
85 . 1 1 10 10 ASN CB C 13 38.09063 0.05565 . 1 . . . . 158 Asn CB . 17113 1
86 . 1 1 10 10 ASN ND2 N 15 111.18664 0.14803 . 1 . . . . 158 Asn ND2 . 17113 1
87 . 1 1 11 11 HIS H H 1 8.38867 0.00407 . 1 . . . . 159 His H . 17113 1
88 . 1 1 11 11 HIS HA H 1 4.68276 0.01293 . 1 . . . . 159 His HA . 17113 1
89 . 1 1 11 11 HIS HB2 H 1 2.13067 0.0126 . 2 . . . . 159 His HB2 . 17113 1
90 . 1 1 11 11 HIS HB3 H 1 2.97008 0.01851 . 2 . . . . 159 His HB3 . 17113 1
91 . 1 1 11 11 HIS HD2 H 1 7.35853 0.00524 . 1 . . . . 159 His HD2 . 17113 1
92 . 1 1 11 11 HIS HE1 H 1 8.00057 0.00428 . 1 . . . . 159 His HE1 . 17113 1
93 . 1 1 11 11 HIS C C 13 174.47846 0.01326 . 1 . . . . 159 His C . 17113 1
94 . 1 1 11 11 HIS CA C 13 56.17904 0.06376 . 1 . . . . 159 His CA . 17113 1
95 . 1 1 11 11 HIS CB C 13 31.66874 0.08322 . 1 . . . . 159 His CB . 17113 1
96 . 1 1 11 11 HIS CD2 C 13 121.26578 0.09866 . 1 . . . . 159 His CD2 . 17113 1
97 . 1 1 11 11 HIS CE1 C 13 140.14142 0.01082 . 1 . . . . 159 His CE1 . 17113 1
98 . 1 1 11 11 HIS N N 15 120.37209 0.03537 . 1 . . . . 159 His N . 17113 1
99 . 1 1 12 12 GLU H H 1 8.45745 0.00421 . 1 . . . . 160 Glu H . 17113 1
100 . 1 1 12 12 GLU HA H 1 4.47141 0.00722 . 1 . . . . 160 Glu HA . 17113 1
101 . 1 1 12 12 GLU HB2 H 1 1.72951 0.00233 . 2 . . . . 160 Glu HB2 . 17113 1
102 . 1 1 12 12 GLU HB3 H 1 1.84524 0.00434 . 2 . . . . 160 Glu HB3 . 17113 1
103 . 1 1 12 12 GLU HG2 H 1 1.91083 0.02302 . 2 . . . . 160 Glu HG2 . 17113 1
104 . 1 1 12 12 GLU HG3 H 1 2.01699 0.00506 . 2 . . . . 160 Glu HG3 . 17113 1
105 . 1 1 12 12 GLU C C 13 174.57475 0.01863 . 1 . . . . 160 Glu C . 17113 1
106 . 1 1 12 12 GLU CA C 13 53.82012 0.09913 . 1 . . . . 160 Glu CA . 17113 1
107 . 1 1 12 12 GLU CB C 13 31.69486 0.08836 . 1 . . . . 160 Glu CB . 17113 1
108 . 1 1 12 12 GLU CG C 13 36.08414 0.10411 . 1 . . . . 160 Glu CG . 17113 1
109 . 1 1 12 12 GLU N N 15 124.18596 0.05236 . 1 . . . . 160 Glu N . 17113 1
110 . 1 1 13 13 PHE H H 1 8.59526 0.00438 . 1 . . . . 161 Phe H . 17113 1
111 . 1 1 13 13 PHE HA H 1 4.81752 0.00815 . 1 . . . . 161 Phe HA . 17113 1
112 . 1 1 13 13 PHE HB2 H 1 2.67633 0.01106 . 2 . . . . 161 Phe HB2 . 17113 1
113 . 1 1 13 13 PHE HB3 H 1 3.05122 0.01176 . 2 . . . . 161 Phe HB3 . 17113 1
114 . 1 1 13 13 PHE HD1 H 1 6.92559 0.00622 . 3 . . . . 161 Phe HD* . 17113 1
115 . 1 1 13 13 PHE HD2 H 1 6.92559 0.00622 . 3 . . . . 161 Phe HD* . 17113 1
116 . 1 1 13 13 PHE HE1 H 1 6.94118 0.00514 . 3 . . . . 161 Phe HE* . 17113 1
117 . 1 1 13 13 PHE HE2 H 1 6.94118 0.00514 . 3 . . . . 161 Phe HE* . 17113 1
118 . 1 1 13 13 PHE HZ H 1 6.28037 0.00586 . 1 . . . . 161 Phe HZ . 17113 1
119 . 1 1 13 13 PHE C C 13 175.60321 0.01735 . 1 . . . . 161 Phe C . 17113 1
120 . 1 1 13 13 PHE CA C 13 59.99871 0.09091 . 1 . . . . 161 Phe CA . 17113 1
121 . 1 1 13 13 PHE CB C 13 40.191 0.11024 . 1 . . . . 161 Phe CB . 17113 1
122 . 1 1 13 13 PHE CD1 C 13 131.24037 0.18325 . 3 . . . . 161 Phe CD* . 17113 1
123 . 1 1 13 13 PHE CD2 C 13 131.24037 0.18325 . 3 . . . . 161 Phe CD* . 17113 1
124 . 1 1 13 13 PHE CE1 C 13 131.83311 0.18506 . 3 . . . . 161 Phe CE* . 17113 1
125 . 1 1 13 13 PHE CE2 C 13 131.83311 0.18506 . 3 . . . . 161 Phe CE* . 17113 1
126 . 1 1 13 13 PHE CZ C 13 128.59063 0.04094 . 1 . . . . 161 Phe CZ . 17113 1
127 . 1 1 13 13 PHE N N 15 121.45731 0.03557 . 1 . . . . 161 Phe N . 17113 1
128 . 1 1 14 14 ILE H H 1 8.86223 0.0064 . 1 . . . . 162 Ile H . 17113 1
129 . 1 1 14 14 ILE HA H 1 4.97946 0.01084 . 1 . . . . 162 Ile HA . 17113 1
130 . 1 1 14 14 ILE HB H 1 1.91089 0.01059 . 1 . . . . 162 Ile HB . 17113 1
131 . 1 1 14 14 ILE HD11 H 1 0.86477 0.00459 . 2 . . . . 162 Ile HD1* . 17113 1
132 . 1 1 14 14 ILE HD12 H 1 0.86477 0.00459 . 2 . . . . 162 Ile HD1* . 17113 1
133 . 1 1 14 14 ILE HD13 H 1 0.86477 0.00459 . 2 . . . . 162 Ile HD1* . 17113 1
134 . 1 1 14 14 ILE HG12 H 1 1.33325 0.00575 . 2 . . . . 162 Ile HG12 . 17113 1
135 . 1 1 14 14 ILE HG13 H 1 1.58871 0.01499 . 2 . . . . 162 Ile HG13 . 17113 1
136 . 1 1 14 14 ILE HG21 H 1 1.04545 0.00537 . 2 . . . . 162 Ile HG2* . 17113 1
137 . 1 1 14 14 ILE HG22 H 1 1.04545 0.00537 . 2 . . . . 162 Ile HG2* . 17113 1
138 . 1 1 14 14 ILE HG23 H 1 1.04545 0.00537 . 2 . . . . 162 Ile HG2* . 17113 1
139 . 1 1 14 14 ILE C C 13 176.56434 0.02959 . 1 . . . . 162 Ile C . 17113 1
140 . 1 1 14 14 ILE CA C 13 58.87133 0.11325 . 1 . . . . 162 Ile CA . 17113 1
141 . 1 1 14 14 ILE CB C 13 41.39511 0.06467 . 1 . . . . 162 Ile CB . 17113 1
142 . 1 1 14 14 ILE CD1 C 13 13.61999 0.11185 . 1 . . . . 162 Ile CD1 . 17113 1
143 . 1 1 14 14 ILE CG1 C 13 27.34655 0.1063 . 1 . . . . 162 Ile CG1 . 17113 1
144 . 1 1 14 14 ILE CG2 C 13 17.41253 0.05917 . 1 . . . . 162 Ile CG2 . 17113 1
145 . 1 1 14 14 ILE N N 15 120.14861 0.05702 . 1 . . . . 162 Ile N . 17113 1
146 . 1 1 15 15 ALA H H 1 9.10183 0.00673 . 1 . . . . 163 Ala H . 17113 1
147 . 1 1 15 15 ALA HA H 1 4.31166 0.00396 . 1 . . . . 163 Ala HA . 17113 1
148 . 1 1 15 15 ALA HB1 H 1 1.29611 0.00475 . 2 . . . . 163 Ala HB* . 17113 1
149 . 1 1 15 15 ALA HB2 H 1 1.29611 0.00475 . 2 . . . . 163 Ala HB* . 17113 1
150 . 1 1 15 15 ALA HB3 H 1 1.29611 0.00475 . 2 . . . . 163 Ala HB* . 17113 1
151 . 1 1 15 15 ALA C C 13 176.97085 0.01589 . 1 . . . . 163 Ala C . 17113 1
152 . 1 1 15 15 ALA CA C 13 53.20306 0.09171 . 1 . . . . 163 Ala CA . 17113 1
153 . 1 1 15 15 ALA CB C 13 18.55138 0.06372 . 1 . . . . 163 Ala CB . 17113 1
154 . 1 1 15 15 ALA N N 15 132.15914 0.09403 . 1 . . . . 163 Ala N . 17113 1
155 . 1 1 16 16 THR H H 1 8.18747 0.00346 . 1 . . . . 164 Thr H . 17113 1
156 . 1 1 16 16 THR HA H 1 4.3387 0.00585 . 1 . . . . 164 Thr HA . 17113 1
157 . 1 1 16 16 THR HB H 1 3.38573 0.00318 . 1 . . . . 164 Thr HB . 17113 1
158 . 1 1 16 16 THR HG21 H 1 0.39293 0.0082 . 2 . . . . 164 Thr HG2* . 17113 1
159 . 1 1 16 16 THR HG22 H 1 0.39293 0.0082 . 2 . . . . 164 Thr HG2* . 17113 1
160 . 1 1 16 16 THR HG23 H 1 0.39293 0.0082 . 2 . . . . 164 Thr HG2* . 17113 1
161 . 1 1 16 16 THR C C 13 170.86233 0.01174 . 1 . . . . 164 Thr C . 17113 1
162 . 1 1 16 16 THR CA C 13 61.32736 0.0593 . 1 . . . . 164 Thr CA . 17113 1
163 . 1 1 16 16 THR CB C 13 72.13507 0.01917 . 1 . . . . 164 Thr CB . 17113 1
164 . 1 1 16 16 THR CG2 C 13 19.73606 0.11319 . 1 . . . . 164 Thr CG2 . 17113 1
165 . 1 1 16 16 THR N N 15 118.93864 0.04312 . 1 . . . . 164 Thr N . 17113 1
166 . 1 1 17 17 PHE H H 1 8.22813 0.00506 . 1 . . . . 165 Phe H . 17113 1
167 . 1 1 17 17 PHE HA H 1 4.67496 0.01616 . 1 . . . . 165 Phe HA . 17113 1
168 . 1 1 17 17 PHE HB2 H 1 2.83345 9.56E-04 . 2 . . . . 165 Phe HB2 . 17113 1
169 . 1 1 17 17 PHE HB3 H 1 2.90676 0.01519 . 2 . . . . 165 Phe HB3 . 17113 1
170 . 1 1 17 17 PHE HD1 H 1 7.1507 0.00659 . 3 . . . . 165 Phe HD* . 17113 1
171 . 1 1 17 17 PHE HD2 H 1 7.1507 0.00659 . 3 . . . . 165 Phe HD* . 17113 1
172 . 1 1 17 17 PHE HE1 H 1 7.2611 0.00446 . 3 . . . . 165 Phe HE* . 17113 1
173 . 1 1 17 17 PHE HE2 H 1 7.2611 0.00446 . 3 . . . . 165 Phe HE* . 17113 1
174 . 1 1 17 17 PHE HZ H 1 7.25721 0.00553 . 1 . . . . 165 Phe HZ . 17113 1
175 . 1 1 17 17 PHE C C 13 175.19246 0.01412 . 1 . . . . 165 Phe C . 17113 1
176 . 1 1 17 17 PHE CA C 13 56.77268 0.0787 . 1 . . . . 165 Phe CA . 17113 1
177 . 1 1 17 17 PHE CB C 13 39.96268 0.08062 . 1 . . . . 165 Phe CB . 17113 1
178 . 1 1 17 17 PHE CD1 C 13 131.98209 0.02265 . 3 . . . . 165 Phe CD* . 17113 1
179 . 1 1 17 17 PHE CD2 C 13 131.98209 0.02265 . 3 . . . . 165 Phe CD* . 17113 1
180 . 1 1 17 17 PHE CE1 C 13 131.55326 0.09096 . 3 . . . . 165 Phe CE* . 17113 1
181 . 1 1 17 17 PHE CE2 C 13 131.55326 0.09096 . 3 . . . . 165 Phe CE* . 17113 1
182 . 1 1 17 17 PHE CZ C 13 129.86743 0.03272 . 1 . . . . 165 Phe CZ . 17113 1
183 . 1 1 17 17 PHE N N 15 124.09505 0.05611 . 1 . . . . 165 Phe N . 17113 1
184 . 1 1 18 18 PHE H H 1 8.54435 0.00498 . 1 . . . . 166 Phe H . 17113 1
185 . 1 1 18 18 PHE HA H 1 4.62294 0.00438 . 1 . . . . 166 Phe HA . 17113 1
186 . 1 1 18 18 PHE HB2 H 1 2.8817 0.00499 . 2 . . . . 166 Phe HB2 . 17113 1
187 . 1 1 18 18 PHE HB3 H 1 3.26274 0.01533 . 2 . . . . 166 Phe HB3 . 17113 1
188 . 1 1 18 18 PHE HD1 H 1 7.2473 0.00582 . 3 . . . . 166 Phe HD1 . 17113 1
189 . 1 1 18 18 PHE HD2 H 1 7.03896 0.00454 . 3 . . . . 166 Phe HD2 . 17113 1
190 . 1 1 18 18 PHE HZ H 1 7.1339 0.00331 . 1 . . . . 166 Phe HZ . 17113 1
191 . 1 1 18 18 PHE C C 13 175.77575 0.03184 . 1 . . . . 166 Phe C . 17113 1
192 . 1 1 18 18 PHE CA C 13 58.00944 0.06245 . 1 . . . . 166 Phe CA . 17113 1
193 . 1 1 18 18 PHE CB C 13 39.37656 0.06288 . 1 . . . . 166 Phe CB . 17113 1
194 . 1 1 18 18 PHE CD1 C 13 132.42449 0.05304 . 3 . . . . 166 Phe CD* . 17113 1
195 . 1 1 18 18 PHE CD2 C 13 132.42449 0.05304 . 3 . . . . 166 Phe CD* . 17113 1
196 . 1 1 18 18 PHE CE1 C 13 130.57757 0.03661 . 3 . . . . 166 Phe CE* . 17113 1
197 . 1 1 18 18 PHE CE2 C 13 130.57757 0.03661 . 3 . . . . 166 Phe CE* . 17113 1
198 . 1 1 18 18 PHE CZ C 13 129.12085 0.03032 . 1 . . . . 166 Phe CZ . 17113 1
199 . 1 1 18 18 PHE N N 15 124.64804 0.08991 . 1 . . . . 166 Phe N . 17113 1
200 . 1 1 19 19 GLY H H 1 8.71453 0.00829 . 1 . . . . 167 Gly H . 17113 1
201 . 1 1 19 19 GLY HA2 H 1 3.84901 0.00478 . 2 . . . . 167 Gly HA2 . 17113 1
202 . 1 1 19 19 GLY HA3 H 1 4.14268 0.00362 . 2 . . . . 167 Gly HA3 . 17113 1
203 . 1 1 19 19 GLY C C 13 173.68431 0.02707 . 1 . . . . 167 Gly C . 17113 1
204 . 1 1 19 19 GLY CA C 13 45.57519 0.08848 . 1 . . . . 167 Gly CA . 17113 1
205 . 1 1 19 19 GLY N N 15 110.43748 0.11448 . 1 . . . . 167 Gly N . 17113 1
206 . 1 1 20 20 GLN H H 1 7.71009 0.0075 . 1 . . . . 168 Gln H . 17113 1
207 . 1 1 20 20 GLN HA H 1 4.54988 0.00377 . 1 . . . . 168 Gln HA . 17113 1
208 . 1 1 20 20 GLN HB2 H 1 1.77561 0.01128 . 2 . . . . 168 Gln HB2 . 17113 1
209 . 1 1 20 20 GLN HB3 H 1 1.99178 0.00355 . 2 . . . . 168 Gln HB3 . 17113 1
210 . 1 1 20 20 GLN HE21 H 1 6.85853 0.00378 . 2 . . . . 168 Gln HE21 . 17113 1
211 . 1 1 20 20 GLN HE22 H 1 7.52265 0.00849 . 2 . . . . 168 Gln HE22 . 17113 1
212 . 1 1 20 20 GLN HG2 H 1 2.20052 0.0067 . 2 . . . . 168 Gln HG2 . 17113 1
213 . 1 1 20 20 GLN HG3 H 1 2.23679 0.01377 . 2 . . . . 168 Gln HG3 . 17113 1
214 . 1 1 20 20 GLN C C 13 172.58155 0.1 . 1 . . . . 168 Gln C . 17113 1
215 . 1 1 20 20 GLN CA C 13 52.59522 0.10427 . 1 . . . . 168 Gln CA . 17113 1
216 . 1 1 20 20 GLN CB C 13 29.44514 0.06264 . 1 . . . . 168 Gln CB . 17113 1
217 . 1 1 20 20 GLN CG C 13 32.91264 0.10778 . 1 . . . . 168 Gln CG . 17113 1
218 . 1 1 20 20 GLN N N 15 117.49152 0.03673 . 1 . . . . 168 Gln N . 17113 1
219 . 1 1 20 20 GLN NE2 N 15 112.20879 0.18351 . 1 . . . . 168 Gln NE2 . 17113 1
220 . 1 1 21 21 PRO HA H 1 3.9084 0.01775 . 1 . . . . 169 Pro HA . 17113 1
221 . 1 1 21 21 PRO HB2 H 1 1.13353 0.00706 . 2 . . . . 169 Pro HB2 . 17113 1
222 . 1 1 21 21 PRO HB3 H 1 1.1748 0.00138 . 2 . . . . 169 Pro HB3 . 17113 1
223 . 1 1 21 21 PRO HD2 H 1 2.82015 0.0186 . 2 . . . . 169 Pro HD2 . 17113 1
224 . 1 1 21 21 PRO HD3 H 1 3.18657 0.00754 . 2 . . . . 169 Pro HD3 . 17113 1
225 . 1 1 21 21 PRO HG2 H 1 0.67336 0.00656 . 2 . . . . 169 Pro HG2 . 17113 1
226 . 1 1 21 21 PRO HG3 H 1 1.48658 0.00941 . 2 . . . . 169 Pro HG3 . 17113 1
227 . 1 1 21 21 PRO C C 13 176.4237 0.01774 . 1 . . . . 169 Pro C . 17113 1
228 . 1 1 21 21 PRO CA C 13 63.6883 0.0633 . 1 . . . . 169 Pro CA . 17113 1
229 . 1 1 21 21 PRO CB C 13 31.00911 0.06984 . 1 . . . . 169 Pro CB . 17113 1
230 . 1 1 21 21 PRO CD C 13 49.9733 0.06281 . 1 . . . . 169 Pro CD . 17113 1
231 . 1 1 21 21 PRO CG C 13 26.79454 0.3 . 1 . . . . 169 Pro CG . 17113 1
232 . 1 1 22 22 THR H H 1 7.69554 0.00569 . 1 . . . . 170 Thr H . 17113 1
233 . 1 1 22 22 THR HA H 1 4.38128 0.00896 . 1 . . . . 170 Thr HA . 17113 1
234 . 1 1 22 22 THR HB H 1 3.31902 0.00466 . 1 . . . . 170 Thr HB . 17113 1
235 . 1 1 22 22 THR HG21 H 1 0.58415 0.00527 . 2 . . . . 170 Thr HG2* . 17113 1
236 . 1 1 22 22 THR HG22 H 1 0.58415 0.00527 . 2 . . . . 170 Thr HG2* . 17113 1
237 . 1 1 22 22 THR HG23 H 1 0.58415 0.00527 . 2 . . . . 170 Thr HG2* . 17113 1
238 . 1 1 22 22 THR C C 13 172.10631 0.01313 . 1 . . . . 170 Thr C . 17113 1
239 . 1 1 22 22 THR CA C 13 61.33277 0.08985 . 1 . . . . 170 Thr CA . 17113 1
240 . 1 1 22 22 THR CB C 13 71.94377 0.11059 . 1 . . . . 170 Thr CB . 17113 1
241 . 1 1 22 22 THR CG2 C 13 19.50009 0.08338 . 1 . . . . 170 Thr CG2 . 17113 1
242 . 1 1 22 22 THR N N 15 121.29745 0.05473 . 1 . . . . 170 Thr N . 17113 1
243 . 1 1 23 23 PHE H H 1 8.77298 0.00525 . 1 . . . . 171 Phe H . 17113 1
244 . 1 1 23 23 PHE HA H 1 3.98295 0.00957 . 1 . . . . 171 Phe HA . 17113 1
245 . 1 1 23 23 PHE HB2 H 1 2.55632 0.00446 . 2 . . . . 171 Phe HB2 . 17113 1
246 . 1 1 23 23 PHE HB3 H 1 2.60613 0.01717 . 2 . . . . 171 Phe HB3 . 17113 1
247 . 1 1 23 23 PHE HD1 H 1 6.75338 0.0057 . 3 . . . . 171 Phe HD* . 17113 1
248 . 1 1 23 23 PHE HD2 H 1 6.75338 0.0057 . 3 . . . . 171 Phe HD* . 17113 1
249 . 1 1 23 23 PHE HE1 H 1 7.07102 0.0048 . 3 . . . . 171 Phe HE* . 17113 1
250 . 1 1 23 23 PHE HE2 H 1 7.07102 0.0048 . 3 . . . . 171 Phe HE* . 17113 1
251 . 1 1 23 23 PHE C C 13 173.9367 0.02943 . 1 . . . . 171 Phe C . 17113 1
252 . 1 1 23 23 PHE CA C 13 58.56627 0.06921 . 1 . . . . 171 Phe CA . 17113 1
253 . 1 1 23 23 PHE CB C 13 40.11675 0.07108 . 1 . . . . 171 Phe CB . 17113 1
254 . 1 1 23 23 PHE CD1 C 13 131.41163 0.02371 . 3 . . . . 171 Phe CD* . 17113 1
255 . 1 1 23 23 PHE CD2 C 13 131.41163 0.02371 . 3 . . . . 171 Phe CD* . 17113 1
256 . 1 1 23 23 PHE CE1 C 13 131.35186 0.07518 . 3 . . . . 171 Phe CE* . 17113 1
257 . 1 1 23 23 PHE CE2 C 13 131.35186 0.07518 . 3 . . . . 171 Phe CE* . 17113 1
258 . 1 1 23 23 PHE N N 15 127.08293 0.05294 . 1 . . . . 171 Phe N . 17113 1
259 . 1 1 24 24 CYS H H 1 8.15641 0.00315 . 1 . . . . 172 CYS H . 17113 1
260 . 1 1 24 24 CYS HA H 1 4.33892 0.00527 . 1 . . . . 172 CYS HA . 17113 1
261 . 1 1 24 24 CYS HB2 H 1 2.12449 0.00585 . 2 . . . . 172 CYS HB2 . 17113 1
262 . 1 1 24 24 CYS HB3 H 1 3.34611 0.0041 . 2 . . . . 172 CYS HB3 . 17113 1
263 . 1 1 24 24 CYS C C 13 177.35764 0.00585 . 1 . . . . 172 CYS C . 17113 1
264 . 1 1 24 24 CYS CA C 13 58.04048 0.0676 . 1 . . . . 172 CYS CA . 17113 1
265 . 1 1 24 24 CYS CB C 13 30.78655 0.11261 . 1 . . . . 172 CYS CB . 17113 1
266 . 1 1 24 24 CYS N N 15 125.09868 0.0698 . 1 . . . . 172 CYS N . 17113 1
267 . 1 1 25 25 SER H H 1 9.20821 0.00428 . 1 . . . . 173 Ser H . 17113 1
268 . 1 1 25 25 SER HA H 1 4.19171 0.00412 . 1 . . . . 173 Ser HA . 17113 1
269 . 1 1 25 25 SER HB2 H 1 3.9252 0.0082 . 2 . . . . 173 Ser HB2 . 17113 1
270 . 1 1 25 25 SER HB3 H 1 4.12163 0.00909 . 2 . . . . 173 Ser HB3 . 17113 1
271 . 1 1 25 25 SER C C 13 174.49967 0.02159 . 1 . . . . 173 Ser C . 17113 1
272 . 1 1 25 25 SER CA C 13 61.67405 0.05728 . 1 . . . . 173 Ser CA . 17113 1
273 . 1 1 25 25 SER CB C 13 63.90294 0.1567 . 1 . . . . 173 Ser CB . 17113 1
274 . 1 1 25 25 SER N N 15 124.43344 0.04257 . 1 . . . . 173 Ser N . 17113 1
275 . 1 1 26 26 VAL H H 1 8.95379 0.00705 . 1 . . . . 174 Val H . 17113 1
276 . 1 1 26 26 VAL HA H 1 4.04515 0.00465 . 1 . . . . 174 Val HA . 17113 1
277 . 1 1 26 26 VAL HB H 1 2.09588 0.00471 . 1 . . . . 174 Val HB . 17113 1
278 . 1 1 26 26 VAL HG11 H 1 0.95106 0.00322 . 2 . . . . 174 Val HG1* . 17113 1
279 . 1 1 26 26 VAL HG12 H 1 0.95106 0.00322 . 2 . . . . 174 Val HG1* . 17113 1
280 . 1 1 26 26 VAL HG13 H 1 0.95106 0.00322 . 2 . . . . 174 Val HG1* . 17113 1
281 . 1 1 26 26 VAL HG21 H 1 0.95212 9.98E-04 . 2 . . . . 174 Val HG2* . 17113 1
282 . 1 1 26 26 VAL HG22 H 1 0.95212 9.98E-04 . 2 . . . . 174 Val HG2* . 17113 1
283 . 1 1 26 26 VAL HG23 H 1 0.95212 9.98E-04 . 2 . . . . 174 Val HG2* . 17113 1
284 . 1 1 26 26 VAL C C 13 176.72193 0.02948 . 1 . . . . 174 Val C . 17113 1
285 . 1 1 26 26 VAL CA C 13 65.13856 0.15145 . 1 . . . . 174 Val CA . 17113 1
286 . 1 1 26 26 VAL CB C 13 33.18447 0.04226 . 1 . . . . 174 Val CB . 17113 1
287 . 1 1 26 26 VAL CG1 C 13 21.15271 0.10451 . 2 . . . . 174 Val CG1 . 17113 1
288 . 1 1 26 26 VAL CG2 C 13 22.40533 0.12162 . 2 . . . . 174 Val CG2 . 17113 1
289 . 1 1 26 26 VAL N N 15 123.24347 0.03345 . 1 . . . . 174 Val N . 17113 1
290 . 1 1 27 27 CYS H H 1 8.10486 0.00551 . 1 . . . . 175 CYS H . 17113 1
291 . 1 1 27 27 CYS HA H 1 4.78852 0.00388 . 1 . . . . 175 CYS HA . 17113 1
292 . 1 1 27 27 CYS HB2 H 1 2.89736 0.01021 . 2 . . . . 175 CYS HB2 . 17113 1
293 . 1 1 27 27 CYS HB3 H 1 3.26471 0.00614 . 2 . . . . 175 CYS HB3 . 17113 1
294 . 1 1 27 27 CYS C C 13 175.76833 0.00914 . 1 . . . . 175 CYS C . 17113 1
295 . 1 1 27 27 CYS CA C 13 59.16109 0.04641 . 1 . . . . 175 CYS CA . 17113 1
296 . 1 1 27 27 CYS CB C 13 31.15602 0.05206 . 1 . . . . 175 CYS CB . 17113 1
297 . 1 1 27 27 CYS N N 15 118.01161 0.04627 . 1 . . . . 175 CYS N . 17113 1
298 . 1 1 28 28 LYS H H 1 7.81267 0.00674 . 1 . . . . 176 Lys H . 17113 1
299 . 1 1 28 28 LYS HA H 1 3.78099 0.01329 . 1 . . . . 176 Lys HA . 17113 1
300 . 1 1 28 28 LYS HB2 H 1 1.91991 0.00302 . 2 . . . . 176 Lys HB2 . 17113 1
301 . 1 1 28 28 LYS HB3 H 1 2.15216 0.00927 . 2 . . . . 176 Lys HB3 . 17113 1
302 . 1 1 28 28 LYS HD2 H 1 1.56085 0.00703 . 2 . . . . 176 Lys HD2 . 17113 1
303 . 1 1 28 28 LYS HD3 H 1 1.57773 0.01 . 2 . . . . 176 Lys HD3 . 17113 1
304 . 1 1 28 28 LYS HE2 H 1 2.93089 0.0118 . 2 . . . . 176 Lys HE2 . 17113 1
305 . 1 1 28 28 LYS HE3 H 1 2.96002 0.00422 . 2 . . . . 176 Lys HE3 . 17113 1
306 . 1 1 28 28 LYS HG2 H 1 1.20119 0.0152 . 2 . . . . 176 Lys HG2 . 17113 1
307 . 1 1 28 28 LYS HG3 H 1 1.28083 0.00643 . 2 . . . . 176 Lys HG3 . 17113 1
308 . 1 1 28 28 LYS C C 13 174.70301 0.02264 . 1 . . . . 176 Lys C . 17113 1
309 . 1 1 28 28 LYS CA C 13 57.66807 0.10159 . 1 . . . . 176 Lys CA . 17113 1
310 . 1 1 28 28 LYS CB C 13 28.68118 0.03595 . 1 . . . . 176 Lys CB . 17113 1
311 . 1 1 28 28 LYS CE C 13 42.29046 0.13325 . 1 . . . . 176 Lys CE . 17113 1
312 . 1 1 28 28 LYS CG C 13 25.03165 0.02567 . 1 . . . . 176 Lys CG . 17113 1
313 . 1 1 28 28 LYS N N 15 116.42604 0.03668 . 1 . . . . 176 Lys N . 17113 1
314 . 1 1 29 29 GLU H H 1 7.94965 0.00504 . 1 . . . . 177 Glu H . 17113 1
315 . 1 1 29 29 GLU HA H 1 4.66403 0.00838 . 1 . . . . 177 Glu Ha . 17113 1
316 . 1 1 29 29 GLU HB2 H 1 2.13657 0.01 . 2 . . . . 177 Glu HB2 . 17113 1
317 . 1 1 29 29 GLU HB3 H 1 2.28731 0.00569 . 2 . . . . 177 Glu HB3 . 17113 1
318 . 1 1 29 29 GLU HG2 H 1 2.30014 0.00627 . 2 . . . . 177 Glu HG2 . 17113 1
319 . 1 1 29 29 GLU HG3 H 1 2.4158 0.01463 . 2 . . . . 177 Glu HG3 . 17113 1
320 . 1 1 29 29 GLU C C 13 176.78284 0.014 . 1 . . . . 177 Glu C . 17113 1
321 . 1 1 29 29 GLU CA C 13 54.92285 0.02547 . 1 . . . . 177 Glu CA . 17113 1
322 . 1 1 29 29 GLU CB C 13 31.88889 0.0266 . 1 . . . . 177 Glu CB . 17113 1
323 . 1 1 29 29 GLU CG C 13 36.32708 0.05531 . 1 . . . . 177 Glu CG . 17113 1
324 . 1 1 29 29 GLU N N 15 118.05908 0.05709 . 1 . . . . 177 Glu N . 17113 1
325 . 1 1 30 30 PHE H H 1 8.85525 0.00437 . 1 . . . . 178 Phe H . 17113 1
326 . 1 1 30 30 PHE HA H 1 4.40922 0.00737 . 1 . . . . 178 Phe HA . 17113 1
327 . 1 1 30 30 PHE HB2 H 1 2.5355 0.00814 . 2 . . . . 178 Phe HB2 . 17113 1
328 . 1 1 30 30 PHE HB3 H 1 2.80629 0.00714 . 2 . . . . 178 Phe HB3 . 17113 1
329 . 1 1 30 30 PHE HD1 H 1 6.82444 0.00402 . 3 . . . . 178 Phe HD* . 17113 1
330 . 1 1 30 30 PHE HD2 H 1 6.82444 0.00402 . 3 . . . . 178 Phe HD* . 17113 1
331 . 1 1 30 30 PHE HE1 H 1 7.05384 2.48E-04 . 3 . . . . 178 Phe HE* . 17113 1
332 . 1 1 30 30 PHE HE2 H 1 7.05384 2.48E-04 . 3 . . . . 178 Phe HE* . 17113 1
333 . 1 1 30 30 PHE C C 13 176.99825 0.1 . 1 . . . . 178 Phe C . 17113 1
334 . 1 1 30 30 PHE CA C 13 58.81302 0.13277 . 1 . . . . 178 Phe CA . 17113 1
335 . 1 1 30 30 PHE CB C 13 39.71876 0.04958 . 1 . . . . 178 Phe CB . 17113 1
336 . 1 1 30 30 PHE CD1 C 13 130.77594 0.16664 . 3 . . . . 178 Phe CD* . 17113 1
337 . 1 1 30 30 PHE CD2 C 13 130.77594 0.16664 . 3 . . . . 178 Phe CD* . 17113 1
338 . 1 1 30 30 PHE N N 15 119.27043 0.02775 . 1 . . . . 178 Phe N . 17113 1
339 . 1 1 31 31 VAL HA H 1 4.07445 0.00789 . 1 . . . . 179 Val HA . 17113 1
340 . 1 1 31 31 VAL HB H 1 1.54815 0.00683 . 1 . . . . 179 Val HB . 17113 1
341 . 1 1 31 31 VAL HG11 H 1 0.04389 0.00617 . 2 . . . . 179 Val HG1* . 17113 1
342 . 1 1 31 31 VAL HG12 H 1 0.04389 0.00617 . 2 . . . . 179 Val HG1* . 17113 1
343 . 1 1 31 31 VAL HG13 H 1 0.04389 0.00617 . 2 . . . . 179 Val HG1* . 17113 1
344 . 1 1 31 31 VAL HG21 H 1 0.59555 0.00695 . 2 . . . . 179 Val HG2* . 17113 1
345 . 1 1 31 31 VAL HG22 H 1 0.59555 0.00695 . 2 . . . . 179 Val HG2* . 17113 1
346 . 1 1 31 31 VAL HG23 H 1 0.59555 0.00695 . 2 . . . . 179 Val HG2* . 17113 1
347 . 1 1 31 31 VAL C C 13 174.29653 0.0825 . 1 . . . . 179 Val C . 17113 1
348 . 1 1 31 31 VAL CA C 13 61.4976 0.05769 . 1 . . . . 179 Val CA . 17113 1
349 . 1 1 31 31 VAL CB C 13 31.15414 0.08229 . 1 . . . . 179 Val CB . 17113 1
350 . 1 1 31 31 VAL CG1 C 13 19.25426 0.06384 . 2 . . . . 179 Val CG1 . 17113 1
351 . 1 1 32 32 TRP H H 1 8.11626 0.00801 . 1 . . . . 180 Trp H . 17113 1
352 . 1 1 32 32 TRP HA H 1 4.83533 0.00751 . 1 . . . . 180 Trp HA . 17113 1
353 . 1 1 32 32 TRP HB2 H 1 3.14078 0.01277 . 2 . . . . 180 Trp HB2 . 17113 1
354 . 1 1 32 32 TRP HB3 H 1 3.23294 0.01091 . 2 . . . . 180 Trp HB3 . 17113 1
355 . 1 1 32 32 TRP HD1 H 1 7.19845 0.01008 . 1 . . . . 180 Trp HD1 . 17113 1
356 . 1 1 32 32 TRP HE1 H 1 10.04723 0.00412 . 1 . . . . 180 Trp HE1 . 17113 1
357 . 1 1 32 32 TRP HE3 H 1 7.63025 0.00583 . 1 . . . . 180 Trp HE3 . 17113 1
358 . 1 1 32 32 TRP HH2 H 1 7.13792 0.00297 . 1 . . . . 180 Trp HH2 . 17113 1
359 . 1 1 32 32 TRP HZ2 H 1 7.46652 0.00647 . 1 . . . . 180 Trp HZ2 . 17113 1
360 . 1 1 32 32 TRP HZ3 H 1 6.95928 0.00424 . 1 . . . . 180 Trp HZ3 . 17113 1
361 . 1 1 32 32 TRP C C 13 175.18883 0.01122 . 1 . . . . 180 Trp C . 17113 1
362 . 1 1 32 32 TRP CA C 13 56.38495 0.15285 . 1 . . . . 180 Trp CA . 17113 1
363 . 1 1 32 32 TRP CB C 13 31.06318 0.07526 . 1 . . . . 180 Trp CB . 17113 1
364 . 1 1 32 32 TRP CD1 C 13 126.66497 0.07944 . 1 . . . . 180 Trp CD1 . 17113 1
365 . 1 1 32 32 TRP CE3 C 13 120.96517 0.02002 . 1 . . . . 180 Trp CE3 . 17113 1
366 . 1 1 32 32 TRP CH2 C 13 124.73892 0.04236 . 1 . . . . 180 Trp CH2 . 17113 1
367 . 1 1 32 32 TRP CZ2 C 13 114.69099 0.01781 . 1 . . . . 180 Trp CZ2 . 17113 1
368 . 1 1 32 32 TRP CZ3 C 13 122.26294 0.03332 . 1 . . . . 180 Trp CZ3 . 17113 1
369 . 1 1 32 32 TRP N N 15 123.81949 0.0439 . 1 . . . . 180 Trp N . 17113 1
370 . 1 1 32 32 TRP NE1 N 15 129.61661 0.04491 . 1 . . . . 180 Trp NE1 . 17113 1
371 . 1 1 33 33 GLY H H 1 7.83523 0.00669 . 1 . . . . 181 Gly H . 17113 1
372 . 1 1 33 33 GLY HA2 H 1 3.52983 0.00518 . 2 . . . . 181 Gly HA2 . 17113 1
373 . 1 1 33 33 GLY HA3 H 1 3.97477 0.0073 . 2 . . . . 181 Gly HA3 . 17113 1
374 . 1 1 33 33 GLY C C 13 174.27708 0.01086 . 1 . . . . 181 Gly C . 17113 1
375 . 1 1 33 33 GLY CA C 13 45.31095 0.11952 . 1 . . . . 181 Gly CA . 17113 1
376 . 1 1 33 33 GLY N N 15 110.09961 0.0891 . 1 . . . . 181 Gly N . 17113 1
377 . 1 1 34 34 LEU H H 1 8.39462 0.00865 . 1 . . . . 182 Leu H . 17113 1
378 . 1 1 34 34 LEU HA H 1 4.09644 0.00257 . 1 . . . . 182 Leu HA . 17113 1
379 . 1 1 34 34 LEU HB2 H 1 1.55151 0.02068 . 2 . . . . 182 Leu HB2 . 17113 1
380 . 1 1 34 34 LEU HB3 H 1 1.59328 0.0052 . 2 . . . . 182 Leu HB3 . 17113 1
381 . 1 1 34 34 LEU HD11 H 1 0.82259 0.00489 . 2 . . . . 182 Leu HD1* . 17113 1
382 . 1 1 34 34 LEU HD12 H 1 0.82259 0.00489 . 2 . . . . 182 Leu HD1* . 17113 1
383 . 1 1 34 34 LEU HD13 H 1 0.82259 0.00489 . 2 . . . . 182 Leu HD1* . 17113 1
384 . 1 1 34 34 LEU HD21 H 1 0.88251 0.0032 . 2 . . . . 182 Leu HD2* . 17113 1
385 . 1 1 34 34 LEU HD22 H 1 0.88251 0.0032 . 2 . . . . 182 Leu HD2* . 17113 1
386 . 1 1 34 34 LEU HD23 H 1 0.88251 0.0032 . 2 . . . . 182 Leu HD2* . 17113 1
387 . 1 1 34 34 LEU HG H 1 1.60817 0.00624 . 1 . . . . 182 Leu HG . 17113 1
388 . 1 1 34 34 LEU C C 13 177.3294 0.00935 . 1 . . . . 182 Leu C . 17113 1
389 . 1 1 34 34 LEU CA C 13 56.42553 0.12897 . 1 . . . . 182 Leu CA . 17113 1
390 . 1 1 34 34 LEU CB C 13 41.94237 0.04612 . 1 . . . . 182 Leu CB . 17113 1
391 . 1 1 34 34 LEU CD1 C 13 23.46677 0.07181 . 2 . . . . 182 Leu CD1 . 17113 1
392 . 1 1 34 34 LEU CD2 C 13 24.69442 0.10015 . 2 . . . . 182 Leu CD2 . 17113 1
393 . 1 1 34 34 LEU CG C 13 27.04202 0.02021 . 1 . . . . 182 Leu CG . 17113 1
394 . 1 1 34 34 LEU N N 15 122.98532 0.1651 . 1 . . . . 182 Leu N . 17113 1
395 . 1 1 35 35 ASN H H 1 8.2862 0.00261 . 1 . . . . 183 Asn H . 17113 1
396 . 1 1 35 35 ASN HA H 1 4.78083 0.01247 . 1 . . . . 183 Asn HA . 17113 1
397 . 1 1 35 35 ASN HB2 H 1 2.78415 1.09E-04 . 2 . . . . 183 Asn HB2 . 17113 1
398 . 1 1 35 35 ASN HB3 H 1 2.82708 0.01581 . 2 . . . . 183 Asn HB3 . 17113 1
399 . 1 1 35 35 ASN HD21 H 1 6.90281 0.01669 . 2 . . . . 183 Asn HD21 . 17113 1
400 . 1 1 35 35 ASN HD22 H 1 7.61385 0.00603 . 2 . . . . 183 Asn HD22 . 17113 1
401 . 1 1 35 35 ASN C C 13 174.61025 0.1 . 1 . . . . 183 Asn C . 17113 1
402 . 1 1 35 35 ASN CA C 13 52.86859 0.0746 . 1 . . . . 183 Asn CA . 17113 1
403 . 1 1 35 35 ASN CB C 13 38.81969 0.13106 . 1 . . . . 183 Asn CB . 17113 1
404 . 1 1 35 35 ASN N N 15 116.00762 0.04872 . 1 . . . . 183 Asn N . 17113 1
405 . 1 1 35 35 ASN ND2 N 15 112.87053 0.0411 . 1 . . . . 183 Asn ND2 . 17113 1
406 . 1 1 36 36 LYS H H 1 7.85189 0.01561 . 1 . . . . 184 Lys H . 17113 1
407 . 1 1 36 36 LYS HA H 1 4.25509 0.01282 . 1 . . . . 184 Lys HA . 17113 1
408 . 1 1 36 36 LYS HB2 H 1 1.67154 0.00644 . 2 . . . . 184 Lys HB1 . 17113 1
409 . 1 1 36 36 LYS HB3 H 1 1.92716 0.01932 . 2 . . . . 184 Lys HB2 . 17113 1
410 . 1 1 36 36 LYS HD2 H 1 1.48573 0.00719 . 2 . . . . 184 Lys HD2 . 17113 1
411 . 1 1 36 36 LYS HD3 H 1 1.5459 0.00618 . 2 . . . . 184 Lys HD3 . 17113 1
412 . 1 1 36 36 LYS HE2 H 1 2.57381 0.00437 . 2 . . . . 184 Lys HE2 . 17113 1
413 . 1 1 36 36 LYS HE3 H 1 2.58173 0.00761 . 2 . . . . 184 Lys HE3 . 17113 1
414 . 1 1 36 36 LYS HG2 H 1 1.0499 0.0107 . 2 . . . . 184 Lys HG2 . 17113 1
415 . 1 1 36 36 LYS HG3 H 1 1.25613 0.01305 . 2 . . . . 184 Lys HG3 . 17113 1
416 . 1 1 36 36 LYS C C 13 175.07167 0.05274 . 1 . . . . 184 Lys C . 17113 1
417 . 1 1 36 36 LYS CA C 13 56.12452 0.03466 . 1 . . . . 184 Lys CA . 17113 1
418 . 1 1 36 36 LYS CB C 13 32.36985 0.07041 . 1 . . . . 184 Lys CB . 17113 1
419 . 1 1 36 36 LYS CD C 13 29.26115 0.07982 . 1 . . . . 184 Lys CD . 17113 1
420 . 1 1 36 36 LYS CE C 13 41.84126 0.07497 . 1 . . . . 184 Lys CE . 17113 1
421 . 1 1 36 36 LYS CG C 13 25.0007 0.06269 . 1 . . . . 184 Lys CG . 17113 1
422 . 1 1 36 36 LYS N N 15 119.04943 0.03175 . 1 . . . . 184 Lys N . 17113 1
423 . 1 1 37 37 GLN H H 1 8.0959 0.00918 . 1 . . . . 185 Gln H . 17113 1
424 . 1 1 37 37 GLN HA H 1 4.30615 0.01517 . 1 . . . . 185 Gln HA . 17113 1
425 . 1 1 37 37 GLN HB2 H 1 1.793 0.01 . 2 . . . . 185 Gln HB2 . 17113 1
426 . 1 1 37 37 GLN HB3 H 1 1.80647 0.01 . 2 . . . . 185 Gln HB3 . 17113 1
427 . 1 1 37 37 GLN HE21 H 1 6.84795 0.00964 . 2 . . . . 185 Gln HE21 . 17113 1
428 . 1 1 37 37 GLN HE22 H 1 7.10672 0.00389 . 2 . . . . 185 Gln HE22 . 17113 1
429 . 1 1 37 37 GLN HG2 H 1 1.95722 0.00593 . 2 . . . . 185 Gln HG2 . 17113 1
430 . 1 1 37 37 GLN HG3 H 1 1.96231 0.00149 . 2 . . . . 185 Gln HG3 . 17113 1
431 . 1 1 37 37 GLN C C 13 176.39709 0.01603 . 1 . . . . 185 Gln C . 17113 1
432 . 1 1 37 37 GLN CA C 13 55.70821 0.02509 . 1 . . . . 185 Gln CA . 17113 1
433 . 1 1 37 37 GLN CB C 13 29.99036 0.08422 . 1 . . . . 185 Gln CB . 17113 1
434 . 1 1 37 37 GLN CG C 13 34.114 0.11766 . 1 . . . . 185 Gln CG . 17113 1
435 . 1 1 37 37 GLN N N 15 119.00073 0.06309 . 1 . . . . 185 Gln N . 17113 1
436 . 1 1 37 37 GLN NE2 N 15 112.29621 0.15462 . 1 . . . . 185 Gln NE2 . 17113 1
437 . 1 1 38 38 GLY H H 1 8.21876 0.00265 . 1 . . . . 186 Gly H . 17113 1
438 . 1 1 38 38 GLY HA2 H 1 3.99796 0.01233 . 2 . . . . 186 Gly HA2 . 17113 1
439 . 1 1 38 38 GLY HA3 H 1 4.22597 0.00455 . 2 . . . . 186 Gly HA3 . 17113 1
440 . 1 1 38 38 GLY C C 13 171.62641 0.01391 . 1 . . . . 186 Gly C . 17113 1
441 . 1 1 38 38 GLY CA C 13 45.21064 0.09425 . 1 . . . . 186 Gly CA . 17113 1
442 . 1 1 38 38 GLY N N 15 111.41862 0.03534 . 1 . . . . 186 Gly N . 17113 1
443 . 1 1 39 39 TYR H H 1 8.90982 0.00679 . 1 . . . . 187 Tyr H . 17113 1
444 . 1 1 39 39 TYR HA H 1 5.48604 0.00919 . 1 . . . . 187 Tyr HA . 17113 1
445 . 1 1 39 39 TYR HB2 H 1 2.33662 0.00601 . 2 . . . . 187 Tyr HB2 . 17113 1
446 . 1 1 39 39 TYR HB3 H 1 2.72904 0.00756 . 2 . . . . 187 Tyr HB3 . 17113 1
447 . 1 1 39 39 TYR HD1 H 1 6.63021 0.0034 . 3 . . . . 187 Tyr HD* . 17113 1
448 . 1 1 39 39 TYR HD2 H 1 6.63021 0.0034 . 3 . . . . 187 Tyr HD* . 17113 1
449 . 1 1 39 39 TYR HE1 H 1 6.68796 0.00261 . 3 . . . . 187 Tyr HE* . 17113 1
450 . 1 1 39 39 TYR HE2 H 1 6.68796 0.00261 . 3 . . . . 187 Tyr HE* . 17113 1
451 . 1 1 39 39 TYR C C 13 174.20664 0.01608 . 1 . . . . 187 Tyr C . 17113 1
452 . 1 1 39 39 TYR CA C 13 56.16414 0.03193 . 1 . . . . 187 Tyr CA . 17113 1
453 . 1 1 39 39 TYR CB C 13 43.01385 0.04808 . 1 . . . . 187 Tyr CB . 17113 1
454 . 1 1 39 39 TYR CD1 C 13 132.31324 0.05229 . 3 . . . . 187 Tyr CD* . 17113 1
455 . 1 1 39 39 TYR CD2 C 13 132.31324 0.05229 . 3 . . . . 187 Tyr CD* . 17113 1
456 . 1 1 39 39 TYR CE1 C 13 118.29953 0.07992 . 3 . . . . 187 Tyr CE* . 17113 1
457 . 1 1 39 39 TYR CE2 C 13 118.29953 0.07992 . 3 . . . . 187 Tyr CE* . 17113 1
458 . 1 1 39 39 TYR N N 15 119.0903 0.05901 . 1 . . . . 187 Tyr N . 17113 1
459 . 1 1 40 40 LYS H H 1 8.90612 0.00544 . 1 . . . . 188 Lys H . 17113 1
460 . 1 1 40 40 LYS HA H 1 5.88215 0.00906 . 1 . . . . 188 Lys HA . 17113 1
461 . 1 1 40 40 LYS HB2 H 1 1.72593 0.00338 . 2 . . . . 188 Lys HB2 . 17113 1
462 . 1 1 40 40 LYS HB3 H 1 1.93002 0.00445 . 2 . . . . 188 Lys HB3 . 17113 1
463 . 1 1 40 40 LYS HD2 H 1 1.69418 0.00688 . 2 . . . . 188 Lys HD2 . 17113 1
464 . 1 1 40 40 LYS HD3 H 1 1.77176 0.00252 . 2 . . . . 188 Lys HD3 . 17113 1
465 . 1 1 40 40 LYS HE2 H 1 2.96306 0.01577 . 2 . . . . 188 Lys HE2 . 17113 1
466 . 1 1 40 40 LYS HE3 H 1 2.99767 0.00509 . 2 . . . . 188 Lys HE3 . 17113 1
467 . 1 1 40 40 LYS HG2 H 1 1.32298 0.01815 . 2 . . . . 188 Lys HG2 . 17113 1
468 . 1 1 40 40 LYS HG3 H 1 1.3754 1.76E-04 . 2 . . . . 188 Lys HG3 . 17113 1
469 . 1 1 40 40 LYS C C 13 176.31129 0.01823 . 1 . . . . 188 Lys C . 17113 1
470 . 1 1 40 40 LYS CA C 13 54.45351 0.08501 . 1 . . . . 188 Lys CA . 17113 1
471 . 1 1 40 40 LYS CB C 13 37.34823 0.07293 . 1 . . . . 188 Lys CB . 17113 1
472 . 1 1 40 40 LYS CD C 13 29.83609 0.05426 . 1 . . . . 188 Lys CD . 17113 1
473 . 1 1 40 40 LYS CE C 13 41.80872 0.06534 . 1 . . . . 188 Lys CE . 17113 1
474 . 1 1 40 40 LYS CG C 13 24.91139 0.01051 . 1 . . . . 188 Lys CG . 17113 1
475 . 1 1 40 40 LYS N N 15 119.75722 0.03891 . 1 . . . . 188 Lys N . 17113 1
476 . 1 1 41 41 CYS H H 1 9.46455 0.00335 . 1 . . . . 189 CYS H . 17113 1
477 . 1 1 41 41 CYS HA H 1 4.62027 0.00965 . 1 . . . . 189 CYS HA . 17113 1
478 . 1 1 41 41 CYS HB2 H 1 2.18116 0.009 . 2 . . . . 189 CYS HB2 . 17113 1
479 . 1 1 41 41 CYS HB3 H 1 3.19547 0.00617 . 2 . . . . 189 CYS HB3 . 17113 1
480 . 1 1 41 41 CYS C C 13 177.18629 0.01207 . 1 . . . . 189 CYS C . 17113 1
481 . 1 1 41 41 CYS CA C 13 58.15327 0.04209 . 1 . . . . 189 CYS CA . 17113 1
482 . 1 1 41 41 CYS CB C 13 30.02148 0.06614 . 1 . . . . 189 CYS CB . 17113 1
483 . 1 1 41 41 CYS N N 15 130.72446 0.0743 . 1 . . . . 189 CYS N . 17113 1
484 . 1 1 42 42 ARG H H 1 8.96328 0.00605 . 1 . . . . 190 Arg H . 17113 1
485 . 1 1 42 42 ARG HA H 1 4.31453 0.01255 . 1 . . . . 190 Arg HA . 17113 1
486 . 1 1 42 42 ARG HB2 H 1 1.87391 3.63E-04 . 2 . . . . 190 Arg HB2 . 17113 1
487 . 1 1 42 42 ARG HB3 H 1 1.90561 5.96E-05 . 2 . . . . 190 Arg HB3 . 17113 1
488 . 1 1 42 42 ARG HD2 H 1 3.16748 0.00426 . 2 . . . . 190 Arg HD2 . 17113 1
489 . 1 1 42 42 ARG HD3 H 1 3.17687 0.00481 . 2 . . . . 190 Arg HD3 . 17113 1
490 . 1 1 42 42 ARG HG2 H 1 1.76876 0.00381 . 2 . . . . 190 Arg HG2 . 17113 1
491 . 1 1 42 42 ARG HG3 H 1 1.90045 0.00112 . 2 . . . . 190 Arg HG3 . 17113 1
492 . 1 1 42 42 ARG C C 13 176.25946 0.01918 . 1 . . . . 190 Arg C . 17113 1
493 . 1 1 42 42 ARG CA C 13 58.50304 0.07357 . 1 . . . . 190 Arg CA . 17113 1
494 . 1 1 42 42 ARG CB C 13 30.91689 0.10811 . 1 . . . . 190 Arg CB . 17113 1
495 . 1 1 42 42 ARG CD C 13 43.36006 0.22154 . 1 . . . . 190 Arg CD . 17113 1
496 . 1 1 42 42 ARG CG C 13 26.84132 0.0603 . 1 . . . . 190 Arg CG . 17113 1
497 . 1 1 42 42 ARG N N 15 129.44945 0.06444 . 1 . . . . 190 Arg N . 17113 1
498 . 1 1 43 43 GLN H H 1 9.00731 0.00887 . 1 . . . . 191 Gln H . 17113 1
499 . 1 1 43 43 GLN HA H 1 4.47288 0.00952 . 1 . . . . 191 Gln HA . 17113 1
500 . 1 1 43 43 GLN HB2 H 1 1.89455 0.00433 . 2 . . . . 191 Gln HB2 . 17113 1
501 . 1 1 43 43 GLN HB3 H 1 2.0326 0.00508 . 2 . . . . 191 Gln HB3 . 17113 1
502 . 1 1 43 43 GLN HE21 H 1 6.75666 0.00663 . 2 . . . . 191 Gln HE21 . 17113 1
503 . 1 1 43 43 GLN HE22 H 1 7.63211 0.00513 . 2 . . . . 191 Gln HE22 . 17113 1
504 . 1 1 43 43 GLN HG2 H 1 2.18295 0.00648 . 2 . . . . 191 Gln HG2 . 17113 1
505 . 1 1 43 43 GLN HG3 H 1 2.39676 0.00611 . 2 . . . . 191 Gln HG3 . 17113 1
506 . 1 1 43 43 GLN C C 13 176.21947 0.01179 . 1 . . . . 191 Gln C . 17113 1
507 . 1 1 43 43 GLN CA C 13 56.92442 0.08663 . 1 . . . . 191 Gln CA . 17113 1
508 . 1 1 43 43 GLN CB C 13 30.36776 0.06177 . 1 . . . . 191 Gln CB . 17113 1
509 . 1 1 43 43 GLN CG C 13 32.94139 0.0474 . 1 . . . . 191 Gln CG . 17113 1
510 . 1 1 43 43 GLN N N 15 118.2403 0.04501 . 1 . . . . 191 Gln N . 17113 1
511 . 1 1 43 43 GLN NE2 N 15 112.10537 0.21553 . 1 . . . . 191 Gln NE2 . 17113 1
512 . 1 1 44 44 CYS H H 1 8.14021 0.00851 . 1 . . . . 192 CYS H . 17113 1
513 . 1 1 44 44 CYS HA H 1 4.92775 0.00874 . 1 . . . . 192 CYS HA . 17113 1
514 . 1 1 44 44 CYS HB2 H 1 2.77117 0.00738 . 2 . . . . 192 CYS HB2 . 17113 1
515 . 1 1 44 44 CYS HB3 H 1 3.37594 0.0049 . 2 . . . . 192 CYS HB3 . 17113 1
516 . 1 1 44 44 CYS C C 13 176.0928 0.03977 . 1 . . . . 192 CYS C . 17113 1
517 . 1 1 44 44 CYS CA C 13 58.43616 0.06836 . 1 . . . . 192 CYS CA . 17113 1
518 . 1 1 44 44 CYS CB C 13 33.09997 0.04106 . 1 . . . . 192 CYS CB . 17113 1
519 . 1 1 44 44 CYS N N 15 117.16463 0.03572 . 1 . . . . 192 CYS N . 17113 1
520 . 1 1 45 45 ASN H H 1 7.91362 0.00648 . 1 . . . . 193 Asn H . 17113 1
521 . 1 1 45 45 ASN HA H 1 4.59403 0.00514 . 1 . . . . 193 Asn HA . 17113 1
522 . 1 1 45 45 ASN HB2 H 1 3.11501 0.01201 . 2 . . . . 193 Asn HB2 . 17113 1
523 . 1 1 45 45 ASN HB3 H 1 3.15052 0.01642 . 2 . . . . 193 Asn HB3 . 17113 1
524 . 1 1 45 45 ASN HD21 H 1 6.8733 0.00385 . 2 . . . . 193 Asn HD21 . 17113 1
525 . 1 1 45 45 ASN HD22 H 1 7.49249 0.00717 . 2 . . . . 193 Asn HD22 . 17113 1
526 . 1 1 45 45 ASN C C 13 173.90573 0.1 . 1 . . . . 193 Asn C . 17113 1
527 . 1 1 45 45 ASN CA C 13 55.5591 0.05026 . 1 . . . . 193 Asn CA . 17113 1
528 . 1 1 45 45 ASN CB C 13 37.88117 0.05028 . 1 . . . . 193 Asn CB . 17113 1
529 . 1 1 45 45 ASN N N 15 116.87435 0.03129 . 1 . . . . 193 Asn N . 17113 1
530 . 1 1 45 45 ASN ND2 N 15 113.01175 0.16097 . 1 . . . . 193 Asn ND2 . 17113 1
531 . 1 1 46 46 ALA H H 1 8.64152 0.0033 . 1 . . . . 194 Ala H . 17113 1
532 . 1 1 46 46 ALA HA H 1 4.24081 0.00373 . 1 . . . . 194 Ala HA . 17113 1
533 . 1 1 46 46 ALA HB1 H 1 1.42869 0.00625 . 2 . . . . 194 Ala HB* . 17113 1
534 . 1 1 46 46 ALA HB2 H 1 1.42869 0.00625 . 2 . . . . 194 Ala HB* . 17113 1
535 . 1 1 46 46 ALA HB3 H 1 1.42869 0.00625 . 2 . . . . 194 Ala HB* . 17113 1
536 . 1 1 46 46 ALA C C 13 175.80234 0.01901 . 1 . . . . 194 Ala C . 17113 1
537 . 1 1 46 46 ALA CA C 13 54.36282 0.10456 . 1 . . . . 194 Ala CA . 17113 1
538 . 1 1 46 46 ALA CB C 13 19.27153 0.04138 . 1 . . . . 194 Ala CB . 17113 1
539 . 1 1 46 46 ALA N N 15 124.33004 0.03142 . 1 . . . . 194 Ala N . 17113 1
540 . 1 1 47 47 ALA H H 1 8.53758 0.00449 . 1 . . . . 195 Ala H . 17113 1
541 . 1 1 47 47 ALA HA H 1 5.58227 0.00812 . 1 . . . . 195 Ala HA . 17113 1
542 . 1 1 47 47 ALA HB1 H 1 1.23212 0.00613 . 2 . . . . 195 Ala HB* . 17113 1
543 . 1 1 47 47 ALA HB2 H 1 1.23212 0.00613 . 2 . . . . 195 Ala HB* . 17113 1
544 . 1 1 47 47 ALA HB3 H 1 1.23212 0.00613 . 2 . . . . 195 Ala HB* . 17113 1
545 . 1 1 47 47 ALA C C 13 177.01148 0.02121 . 1 . . . . 195 Ala C . 17113 1
546 . 1 1 47 47 ALA CA C 13 50.23631 0.08802 . 1 . . . . 195 Ala CA . 17113 1
547 . 1 1 47 47 ALA CB C 13 22.89944 0.09785 . 1 . . . . 195 Ala CB . 17113 1
548 . 1 1 47 47 ALA N N 15 124.95206 0.03392 . 1 . . . . 195 Ala N . 17113 1
549 . 1 1 48 48 ILE H H 1 8.92451 0.0036 . 1 . . . . 196 Ile H . 17113 1
550 . 1 1 48 48 ILE HA H 1 5.82662 0.00773 . 1 . . . . 196 Ile HA . 17113 1
551 . 1 1 48 48 ILE HB H 1 1.65257 0.00697 . 1 . . . . 196 Ile HB . 17113 1
552 . 1 1 48 48 ILE HD11 H 1 0.00839 0.00745 . 2 . . . . 196 Ile HD1* . 17113 1
553 . 1 1 48 48 ILE HD12 H 1 0.00839 0.00745 . 2 . . . . 196 Ile HD1* . 17113 1
554 . 1 1 48 48 ILE HD13 H 1 0.00839 0.00745 . 2 . . . . 196 Ile HD1* . 17113 1
555 . 1 1 48 48 ILE HG12 H 1 0.63171 0.01745 . 2 . . . . 196 Ile HG12 . 17113 1
556 . 1 1 48 48 ILE HG13 H 1 1.26591 0.0068 . 2 . . . . 196 Ile HG13 . 17113 1
557 . 1 1 48 48 ILE HG21 H 1 0.58935 0.0091 . 2 . . . . 196 Ile HG2* . 17113 1
558 . 1 1 48 48 ILE HG22 H 1 0.58935 0.0091 . 2 . . . . 196 Ile HG2* . 17113 1
559 . 1 1 48 48 ILE HG23 H 1 0.58935 0.0091 . 2 . . . . 196 Ile HG2* . 17113 1
560 . 1 1 48 48 ILE C C 13 175.9498 0.01849 . 1 . . . . 196 Ile C . 17113 1
561 . 1 1 48 48 ILE CA C 13 58.64216 0.06598 . 1 . . . . 196 Ile CA . 17113 1
562 . 1 1 48 48 ILE CB C 13 43.92902 0.14142 . 1 . . . . 196 Ile CB . 17113 1
563 . 1 1 48 48 ILE CD1 C 13 13.90235 0.10328 . 1 . . . . 196 Ile CD1 . 17113 1
564 . 1 1 48 48 ILE CG1 C 13 26.80958 0.04514 . 1 . . . . 196 Ile CG1 . 17113 1
565 . 1 1 48 48 ILE CG2 C 13 18.82066 0.08781 . 1 . . . . 196 Ile CG2 . 17113 1
566 . 1 1 48 48 ILE N N 15 114.47028 0.08148 . 1 . . . . 196 Ile N . 17113 1
567 . 1 1 49 49 HIS H H 1 8.13613 0.00577 . 1 . . . . 197 His H . 17113 1
568 . 1 1 49 49 HIS HA H 1 4.61074 0.00691 . 1 . . . . 197 His HA . 17113 1
569 . 1 1 49 49 HIS HB2 H 1 3.64939 0.00859 . 2 . . . . 197 His HB2 . 17113 1
570 . 1 1 49 49 HIS HB3 H 1 3.68516 0.01266 . 2 . . . . 197 His HB3 . 17113 1
571 . 1 1 49 49 HIS HD2 H 1 7.56542 0.01499 . 1 . . . . 197 His HD2 . 17113 1
572 . 1 1 49 49 HIS HE1 H 1 7.28831 0.00224 . 1 . . . . 197 His HE1 . 17113 1
573 . 1 1 49 49 HIS C C 13 177.88851 0.02317 . 1 . . . . 197 His C . 17113 1
574 . 1 1 49 49 HIS CA C 13 58.81949 0.06789 . 1 . . . . 197 His CA . 17113 1
575 . 1 1 49 49 HIS CB C 13 31.80312 0.07339 . 1 . . . . 197 His CB . 17113 1
576 . 1 1 49 49 HIS CD2 C 13 119.12366 0.0503 . 1 . . . . 197 His CD2 . 17113 1
577 . 1 1 49 49 HIS CE1 C 13 139.03448 0.04708 . 1 . . . . 197 His CE1 . 17113 1
578 . 1 1 49 49 HIS N N 15 119.78949 0.0381 . 1 . . . . 197 His N . 17113 1
579 . 1 1 50 50 LYS H H 1 8.82864 0.0085 . 1 . . . . 198 Lys H . 17113 1
580 . 1 1 50 50 LYS HA H 1 3.92004 0.01484 . 1 . . . . 198 Lys Ha . 17113 1
581 . 1 1 50 50 LYS HB2 H 1 1.73563 0.01476 . 2 . . . . 198 Lys HB2 . 17113 1
582 . 1 1 50 50 LYS HB3 H 1 1.83211 0.00492 . 2 . . . . 198 Lys HB3 . 17113 1
583 . 1 1 50 50 LYS HD2 H 1 1.53705 0.00454 . 2 . . . . 198 Lys HD2 . 17113 1
584 . 1 1 50 50 LYS HD3 H 1 1.54916 0.00142 . 2 . . . . 198 Lys HD3 . 17113 1
585 . 1 1 50 50 LYS HE2 H 1 2.77913 0.01301 . 2 . . . . 198 Lys HE2 . 17113 1
586 . 1 1 50 50 LYS HE3 H 1 2.79951 0.00313 . 2 . . . . 198 Lys HE3 . 17113 1
587 . 1 1 50 50 LYS HG2 H 1 1.02969 0.00907 . 2 . . . . 198 Lys HG2 . 17113 1
588 . 1 1 50 50 LYS HG3 H 1 1.27319 0.00604 . 2 . . . . 198 Lys HG3 . 17113 1
589 . 1 1 50 50 LYS C C 13 179.79884 0.01928 . 1 . . . . 198 Lys C . 17113 1
590 . 1 1 50 50 LYS CA C 13 60.36439 0.08261 . 1 . . . . 198 Lys CA . 17113 1
591 . 1 1 50 50 LYS CB C 13 31.97994 0.07138 . 1 . . . . 198 Lys CB . 17113 1
592 . 1 1 50 50 LYS CD C 13 29.5286 0.3 . 1 . . . . 198 Lys CD . 17113 1
593 . 1 1 50 50 LYS CE C 13 41.83253 0.07741 . 1 . . . . 198 Lys CE . 17113 1
594 . 1 1 50 50 LYS CG C 13 25.10292 0.09224 . 1 . . . . 198 Lys CG . 17113 1
595 . 1 1 50 50 LYS N N 15 123.88613 0.02625 . 1 . . . . 198 Lys N . 17113 1
596 . 1 1 51 51 LYS H H 1 8.4026 0.00963 . 1 . . . . 199 Lys H . 17113 1
597 . 1 1 51 51 LYS HA H 1 4.26067 0.00968 . 1 . . . . 199 Lys Ha . 17113 1
598 . 1 1 51 51 LYS HB2 H 1 1.88112 0.01329 . 2 . . . . 199 Lys HB2 . 17113 1
599 . 1 1 51 51 LYS HB3 H 1 1.88639 0.00133 . 2 . . . . 199 Lys HB3 . 17113 1
600 . 1 1 51 51 LYS HD2 H 1 1.55626 0.00801 . 2 . . . . 199 Lys HD2 . 17113 1
601 . 1 1 51 51 LYS HD3 H 1 1.5813 0.00231 . 2 . . . . 199 Lys HD3 . 17113 1
602 . 1 1 51 51 LYS HE2 H 1 2.488 0.00355 . 2 . . . . 199 Lys HE2 . 17113 1
603 . 1 1 51 51 LYS HE3 H 1 2.66465 0.00449 . 2 . . . . 199 Lys HE3 . 17113 1
604 . 1 1 51 51 LYS HG2 H 1 1.38276 0.01232 . 2 . . . . 199 Lys HG2 . 17113 1
605 . 1 1 51 51 LYS HG3 H 1 1.58791 0.00542 . 2 . . . . 199 Lys HG3 . 17113 1
606 . 1 1 51 51 LYS C C 13 177.08797 0.01817 . 1 . . . . 199 Lys C . 17113 1
607 . 1 1 51 51 LYS CA C 13 57.75423 0.08537 . 1 . . . . 199 Lys CA . 17113 1
608 . 1 1 51 51 LYS CB C 13 31.53406 0.10804 . 1 . . . . 199 Lys CB . 17113 1
609 . 1 1 51 51 LYS CD C 13 29.28987 0.04438 . 1 . . . . 199 Lys CD . 17113 1
610 . 1 1 51 51 LYS CE C 13 41.82735 0.06563 . 1 . . . . 199 Lys CE . 17113 1
611 . 1 1 51 51 LYS CG C 13 25.3723 0.15503 . 1 . . . . 199 Lys CG . 17113 1
612 . 1 1 51 51 LYS N N 15 113.58787 0.094 . 1 . . . . 199 Lys N . 17113 1
613 . 1 1 52 52 CYS H H 1 7.33218 0.00371 . 1 . . . . 200 CYS H . 17113 1
614 . 1 1 52 52 CYS HA H 1 4.19604 0.00702 . 1 . . . . 200 CYS HA . 17113 1
615 . 1 1 52 52 CYS HB2 H 1 2.81112 0.00503 . 2 . . . . 200 CYS HB2 . 17113 1
616 . 1 1 52 52 CYS HB3 H 1 3.04318 0.00519 . 2 . . . . 200 CYS HB3 . 17113 1
617 . 1 1 52 52 CYS C C 13 175.8496 0.02109 . 1 . . . . 200 CYS C . 17113 1
618 . 1 1 52 52 CYS CA C 13 61.77678 0.03674 . 1 . . . . 200 CYS CA . 17113 1
619 . 1 1 52 52 CYS CB C 13 30.12802 0.09189 . 1 . . . . 200 CYS CB . 17113 1
620 . 1 1 52 52 CYS N N 15 118.80635 0.04718 . 1 . . . . 200 CYS N . 17113 1
621 . 1 1 53 53 ILE H H 1 6.9278 0.00309 . 1 . . . . 201 Ile H . 17113 1
622 . 1 1 53 53 ILE HA H 1 3.44427 0.00622 . 1 . . . . 201 Ile HA . 17113 1
623 . 1 1 53 53 ILE HB H 1 1.44395 0.00936 . 1 . . . . 201 Ile HB . 17113 1
624 . 1 1 53 53 ILE HD11 H 1 -0.09562 0.00883 . 2 . . . . 201 Ile HD1* . 17113 1
625 . 1 1 53 53 ILE HD12 H 1 -0.09562 0.00883 . 2 . . . . 201 Ile HD1* . 17113 1
626 . 1 1 53 53 ILE HD13 H 1 -0.09562 0.00883 . 2 . . . . 201 Ile HD1* . 17113 1
627 . 1 1 53 53 ILE HG12 H 1 0.73554 0.00965 . 2 . . . . 201 Ile HG12 . 17113 1
628 . 1 1 53 53 ILE HG13 H 1 0.91144 0.0073 . 2 . . . . 201 Ile HG13 . 17113 1
629 . 1 1 53 53 ILE HG21 H 1 0.74558 0.00722 . 2 . . . . 201 Ile HG2* . 17113 1
630 . 1 1 53 53 ILE HG22 H 1 0.74558 0.00722 . 2 . . . . 201 Ile HG2* . 17113 1
631 . 1 1 53 53 ILE HG23 H 1 0.74558 0.00722 . 2 . . . . 201 Ile HG2* . 17113 1
632 . 1 1 53 53 ILE C C 13 174.71711 0.01346 . 1 . . . . 201 Ile C . 17113 1
633 . 1 1 53 53 ILE CA C 13 64.24247 0.05009 . 1 . . . . 201 Ile CA . 17113 1
634 . 1 1 53 53 ILE CB C 13 38.51375 0.08986 . 1 . . . . 201 Ile CB . 17113 1
635 . 1 1 53 53 ILE CD1 C 13 13.06542 0.08923 . 1 . . . . 201 Ile CD1 . 17113 1
636 . 1 1 53 53 ILE CG1 C 13 29.28762 0.06182 . 1 . . . . 201 Ile CG1 . 17113 1
637 . 1 1 53 53 ILE CG2 C 13 16.74851 0.07131 . 1 . . . . 201 Ile CG2 . 17113 1
638 . 1 1 53 53 ILE N N 15 119.65087 0.04933 . 1 . . . . 201 Ile N . 17113 1
639 . 1 1 54 54 ASP H H 1 7.67432 0.0052 . 1 . . . . 202 Asp H . 17113 1
640 . 1 1 54 54 ASP HA H 1 4.55301 0.00941 . 1 . . . . 202 Asp HA . 17113 1
641 . 1 1 54 54 ASP HB2 H 1 2.61879 0.00816 . 2 . . . . 202 Asp HB2 . 17113 1
642 . 1 1 54 54 ASP HB3 H 1 2.63768 0.01188 . 2 . . . . 202 Asp HB3 . 17113 1
643 . 1 1 54 54 ASP C C 13 176.81586 0.01318 . 1 . . . . 202 Asp C . 17113 1
644 . 1 1 54 54 ASP CA C 13 54.80879 0.03399 . 1 . . . . 202 Asp CA . 17113 1
645 . 1 1 54 54 ASP CB C 13 40.55994 0.0561 . 1 . . . . 202 Asp CB . 17113 1
646 . 1 1 54 54 ASP N N 15 116.65195 0.05487 . 1 . . . . 202 Asp N . 17113 1
647 . 1 1 55 55 LYS H H 1 7.51713 0.0049 . 1 . . . . 203 Lys H . 17113 1
648 . 1 1 55 55 LYS HA H 1 4.4132 0.00512 . 1 . . . . 203 Lys HA . 17113 1
649 . 1 1 55 55 LYS HB2 H 1 1.65703 0.0099 . 2 . . . . 203 Lys HB2 . 17113 1
650 . 1 1 55 55 LYS HB3 H 1 2.04811 0.01332 . 2 . . . . 203 Lys HB3 . 17113 1
651 . 1 1 55 55 LYS HD2 H 1 1.6321 0.01218 . 2 . . . . 203 Lys HD2 . 17113 1
652 . 1 1 55 55 LYS HD3 H 1 1.6491 0.00436 . 2 . . . . 203 Lys HD3 . 17113 1
653 . 1 1 55 55 LYS HE2 H 1 2.96141 0.00239 . 2 . . . . 203 Lys HE2 . 17113 1
654 . 1 1 55 55 LYS HE3 H 1 2.9687 0.00224 . 2 . . . . 203 Lys HE3 . 17113 1
655 . 1 1 55 55 LYS HG2 H 1 1.29423 0.00423 . 2 . . . . 203 Lys HG2 . 17113 1
656 . 1 1 55 55 LYS HG3 H 1 1.40024 0.00917 . 2 . . . . 203 Lys HG3 . 17113 1
657 . 1 1 55 55 LYS C C 13 175.48209 0.02341 . 1 . . . . 203 Lys C . 17113 1
658 . 1 1 55 55 LYS CA C 13 54.98419 0.11928 . 1 . . . . 203 Lys CA . 17113 1
659 . 1 1 55 55 LYS CB C 13 33.61745 0.07466 . 1 . . . . 203 Lys CB . 17113 1
660 . 1 1 55 55 LYS CD C 13 29.10762 0.08046 . 1 . . . . 203 Lys CD . 17113 1
661 . 1 1 55 55 LYS CE C 13 41.9772 0.11708 . 1 . . . . 203 Lys CE . 17113 1
662 . 1 1 55 55 LYS CG C 13 24.97527 0.02598 . 1 . . . . 203 Lys CG . 17113 1
663 . 1 1 55 55 LYS N N 15 118.08017 0.04106 . 1 . . . . 203 Lys N . 17113 1
664 . 1 1 56 56 ILE H H 1 7.00757 0.00488 . 1 . . . . 204 Ile H . 17113 1
665 . 1 1 56 56 ILE HA H 1 3.88154 0.01268 . 1 . . . . 204 Ile HA . 17113 1
666 . 1 1 56 56 ILE HB H 1 1.73792 0.00982 . 1 . . . . 204 Ile HB . 17113 1
667 . 1 1 56 56 ILE HD11 H 1 0.75969 0.00534 . 2 . . . . 204 Ile HD1* . 17113 1
668 . 1 1 56 56 ILE HD12 H 1 0.75969 0.00534 . 2 . . . . 204 Ile HD1* . 17113 1
669 . 1 1 56 56 ILE HD13 H 1 0.75969 0.00534 . 2 . . . . 204 Ile HD1* . 17113 1
670 . 1 1 56 56 ILE HG12 H 1 1.22337 0.0101 . 2 . . . . 204 Ile HG12 . 17113 1
671 . 1 1 56 56 ILE HG13 H 1 1.5682 0.0091 . 2 . . . . 204 Ile HG13 . 17113 1
672 . 1 1 56 56 ILE HG21 H 1 0.96597 0.00382 . 2 . . . . 204 Ile HG2* . 17113 1
673 . 1 1 56 56 ILE HG22 H 1 0.96597 0.00382 . 2 . . . . 204 Ile HG2* . 17113 1
674 . 1 1 56 56 ILE HG23 H 1 0.96597 0.00382 . 2 . . . . 204 Ile HG2* . 17113 1
675 . 1 1 56 56 ILE C C 13 175.25415 0.01764 . 1 . . . . 204 Ile C . 17113 1
676 . 1 1 56 56 ILE CA C 13 61.88867 0.11813 . 1 . . . . 204 Ile CA . 17113 1
677 . 1 1 56 56 ILE CB C 13 38.12379 0.09063 . 1 . . . . 204 Ile CB . 17113 1
678 . 1 1 56 56 ILE CD1 C 13 13.96698 0.09635 . 1 . . . . 204 Ile CD1 . 17113 1
679 . 1 1 56 56 ILE CG1 C 13 28.5201 0.07706 . 1 . . . . 204 Ile CG1 . 17113 1
680 . 1 1 56 56 ILE CG2 C 13 17.45404 0.04316 . 1 . . . . 204 Ile CG2 . 17113 1
681 . 1 1 56 56 ILE N N 15 119.51941 0.04403 . 1 . . . . 204 Ile N . 17113 1
682 . 1 1 57 57 ILE H H 1 8.50023 0.00761 . 1 . . . . 205 Ile H . 17113 1
683 . 1 1 57 57 ILE HA H 1 4.27604 0.00553 . 1 . . . . 205 Ile HA . 17113 1
684 . 1 1 57 57 ILE HB H 1 1.86371 0.00749 . 1 . . . . 205 Ile HB . 17113 1
685 . 1 1 57 57 ILE HD11 H 1 0.87954 0.01749 . 2 . . . . 205 Ile HD1* . 17113 1
686 . 1 1 57 57 ILE HD12 H 1 0.87954 0.01749 . 2 . . . . 205 Ile HD1* . 17113 1
687 . 1 1 57 57 ILE HD13 H 1 0.87954 0.01749 . 2 . . . . 205 Ile HD1* . 17113 1
688 . 1 1 57 57 ILE HG12 H 1 1.20774 0.00415 . 2 . . . . 205 Ile HG12 . 17113 1
689 . 1 1 57 57 ILE HG13 H 1 1.56996 0.01034 . 2 . . . . 205 Ile HG13 . 17113 1
690 . 1 1 57 57 ILE HG21 H 1 0.92242 0.00163 . 2 . . . . 205 Ile HG2* . 17113 1
691 . 1 1 57 57 ILE HG22 H 1 0.92242 0.00163 . 2 . . . . 205 Ile HG2* . 17113 1
692 . 1 1 57 57 ILE HG23 H 1 0.92242 0.00163 . 2 . . . . 205 Ile HG2* . 17113 1
693 . 1 1 57 57 ILE C C 13 176.64977 0.02101 . 1 . . . . 205 Ile C . 17113 1
694 . 1 1 57 57 ILE CA C 13 61.1607 0.07462 . 1 . . . . 205 Ile CA . 17113 1
695 . 1 1 57 57 ILE CB C 13 40.17472 0.08324 . 1 . . . . 205 Ile CB . 17113 1
696 . 1 1 57 57 ILE CD1 C 13 13.03928 0.09402 . 1 . . . . 205 Ile CD1 . 17113 1
697 . 1 1 57 57 ILE CG1 C 13 27.0486 0.0656 . 1 . . . . 205 Ile CG1 . 17113 1
698 . 1 1 57 57 ILE CG2 C 13 17.46828 0.02603 . 1 . . . . 205 Ile CG2 . 17113 1
699 . 1 1 57 57 ILE N N 15 126.17436 0.04227 . 1 . . . . 205 Ile N . 17113 1
700 . 1 1 58 58 GLY H H 1 8.40578 0.01266 . 1 . . . . 206 Gly H . 17113 1
701 . 1 1 58 58 GLY HA2 H 1 3.95818 0.00888 . 2 . . . . 206 Gly HA2 . 17113 1
702 . 1 1 58 58 GLY C C 13 173.04417 0.01214 . 1 . . . . 206 Gly C . 17113 1
703 . 1 1 58 58 GLY CA C 13 45.09248 0.06026 . 1 . . . . 206 Gly CA . 17113 1
704 . 1 1 58 58 GLY N N 15 111.64137 0.08097 . 1 . . . . 206 Gly N . 17113 1
705 . 1 1 59 59 ARG H H 1 8.21353 0.00434 . 1 . . . . 207 Arg H . 17113 1
706 . 1 1 59 59 ARG HA H 1 4.69841 0.01949 . 1 . . . . 207 Arg HA . 17113 1
707 . 1 1 59 59 ARG HB2 H 1 1.60536 0.00447 . 2 . . . . 207 Arg HB2 . 17113 1
708 . 1 1 59 59 ARG HB3 H 1 1.62058 0.00272 . 2 . . . . 207 Arg HB3 . 17113 1
709 . 1 1 59 59 ARG HD2 H 1 3.0736 0.00608 . 2 . . . . 207 Arg HD2 . 17113 1
710 . 1 1 59 59 ARG HD3 H 1 3.08412 0.0041 . 2 . . . . 207 Arg HD3 . 17113 1
711 . 1 1 59 59 ARG HG2 H 1 1.47569 0.00496 . 2 . . . . 207 Arg HG2 . 17113 1
712 . 1 1 59 59 ARG HG3 H 1 1.514 0.00887 . 2 . . . . 207 Arg HG3 . 17113 1
713 . 1 1 59 59 ARG C C 13 176.28585 0.01746 . 1 . . . . 207 Arg C . 17113 1
714 . 1 1 59 59 ARG CA C 13 54.90243 0.01836 . 1 . . . . 207 Arg CA . 17113 1
715 . 1 1 59 59 ARG CB C 13 31.82993 0.0417 . 1 . . . . 207 Arg CB . 17113 1
716 . 1 1 59 59 ARG CD C 13 43.2239 0.11473 . 1 . . . . 207 Arg CD . 17113 1
717 . 1 1 59 59 ARG CG C 13 27.39629 0.10045 . 1 . . . . 207 Arg CG . 17113 1
718 . 1 1 59 59 ARG N N 15 121.13744 0.02227 . 1 . . . . 207 Arg N . 17113 1
719 . 1 1 60 60 CYS H H 1 7.50585 0.00709 . 1 . . . . 208 CYS H . 17113 1
720 . 1 1 60 60 CYS HA H 1 3.46366 0.00353 . 1 . . . . 208 CYS HA . 17113 1
721 . 1 1 60 60 CYS HB2 H 1 1.17781 0.00935 . 2 . . . . 208 CYS HB2 . 17113 1
722 . 1 1 60 60 CYS HB3 H 1 2.18234 0.00642 . 2 . . . . 208 CYS HB3 . 17113 1
723 . 1 1 60 60 CYS C C 13 176.75408 0.03282 . 1 . . . . 208 CYS C . 17113 1
724 . 1 1 60 60 CYS CA C 13 62.28892 0.0504 . 1 . . . . 208 CYS CA . 17113 1
725 . 1 1 60 60 CYS CB C 13 29.23632 0.05863 . 1 . . . . 208 CYS CB . 17113 1
726 . 1 1 60 60 CYS N N 15 124.09838 0.10406 . 1 . . . . 208 CYS N . 17113 1
727 . 1 1 61 61 THR H H 1 8.46575 0.01896 . 1 . . . . 209 Thr H . 17113 1
728 . 1 1 61 61 THR HA H 1 4.29975 0.00379 . 1 . . . . 209 Thr HA . 17113 1
729 . 1 1 61 61 THR HB H 1 4.48214 0.00366 . 1 . . . . 209 Thr HB . 17113 1
730 . 1 1 61 61 THR HG21 H 1 1.26593 0.00604 . 2 . . . . 209 Thr HG2* . 17113 1
731 . 1 1 61 61 THR HG22 H 1 1.26593 0.00604 . 2 . . . . 209 Thr HG2* . 17113 1
732 . 1 1 61 61 THR HG23 H 1 1.26593 0.00604 . 2 . . . . 209 Thr HG2* . 17113 1
733 . 1 1 61 61 THR C C 13 175.75991 0.01445 . 1 . . . . 209 Thr C . 17113 1
734 . 1 1 61 61 THR CA C 13 62.13001 0.10058 . 1 . . . . 209 Thr CA . 17113 1
735 . 1 1 61 61 THR CB C 13 69.25931 0.06274 . 1 . . . . 209 Thr CB . 17113 1
736 . 1 1 61 61 THR CG2 C 13 21.75791 0.11483 . 1 . . . . 209 Thr CG2 . 17113 1
737 . 1 1 61 61 THR N N 15 119.89341 0.08219 . 1 . . . . 209 Thr N . 17113 1
738 . 1 1 62 62 GLY H H 1 8.95185 0.00854 . 1 . . . . 210 Gly H . 17113 1
739 . 1 1 62 62 GLY HA2 H 1 3.80641 0.00351 . 2 . . . . 210 Gly HA2 . 17113 1
740 . 1 1 62 62 GLY HA3 H 1 3.81331 0.0036 . 2 . . . . 210 Gly HA3 . 17113 1
741 . 1 1 62 62 GLY C C 13 173.13595 0.01534 . 1 . . . . 210 Gly C . 17113 1
742 . 1 1 62 62 GLY CA C 13 45.00059 0.05314 . 1 . . . . 210 Gly CA . 17113 1
743 . 1 1 62 62 GLY N N 15 113.5941 0.04935 . 1 . . . . 210 Gly N . 17113 1
744 . 1 1 63 63 THR H H 1 7.91427 0.01111 . 1 . . . . 211 Thr H . 17113 1
745 . 1 1 63 63 THR HA H 1 4.35367 0.01557 . 1 . . . . 211 Thr HA . 17113 1
746 . 1 1 63 63 THR HB H 1 4.20942 0.00748 . 1 . . . . 211 Thr HB . 17113 1
747 . 1 1 63 63 THR HG21 H 1 1.17634 0.00868 . 2 . . . . 211 Thr HG2* . 17113 1
748 . 1 1 63 63 THR HG22 H 1 1.17634 0.00868 . 2 . . . . 211 Thr HG2* . 17113 1
749 . 1 1 63 63 THR HG23 H 1 1.17634 0.00868 . 2 . . . . 211 Thr HG2* . 17113 1
750 . 1 1 63 63 THR C C 13 173.87061 0.00739 . 1 . . . . 211 Thr C . 17113 1
751 . 1 1 63 63 THR CA C 13 61.5091 0.07717 . 1 . . . . 211 Thr CA . 17113 1
752 . 1 1 63 63 THR CB C 13 70.02834 0.19023 . 1 . . . . 211 Thr CB . 17113 1
753 . 1 1 63 63 THR CG2 C 13 21.39745 0.14019 . 1 . . . . 211 Thr CG2 . 17113 1
754 . 1 1 63 63 THR N N 15 113.27468 0.06909 . 1 . . . . 211 Thr N . 17113 1
755 . 1 1 64 64 ALA H H 1 8.34988 0.00732 . 1 . . . . 212 Ala H . 17113 1
756 . 1 1 64 64 ALA HA H 1 4.39642 0.00709 . 1 . . . . 212 Ala HA . 17113 1
757 . 1 1 64 64 ALA HB1 H 1 1.39329 0.00403 . 2 . . . . 212 Ala HB* . 17113 1
758 . 1 1 64 64 ALA HB2 H 1 1.39329 0.00403 . 2 . . . . 212 Ala HB* . 17113 1
759 . 1 1 64 64 ALA HB3 H 1 1.39329 0.00403 . 2 . . . . 212 Ala HB* . 17113 1
760 . 1 1 64 64 ALA C C 13 177.90241 0.01604 . 1 . . . . 212 Ala C . 17113 1
761 . 1 1 64 64 ALA CA C 13 52.58366 0.07368 . 1 . . . . 212 Ala CA . 17113 1
762 . 1 1 64 64 ALA CB C 13 19.32598 0.07061 . 1 . . . . 212 Ala CB . 17113 1
763 . 1 1 64 64 ALA N N 15 126.98836 0.10679 . 1 . . . . 212 Ala N . 17113 1
764 . 1 1 65 65 THR H H 1 8.20366 0.01038 . 1 . . . . 213 Thr H . 17113 1
765 . 1 1 65 65 THR HA H 1 4.33239 0.00192 . 1 . . . . 213 Thr HA . 17113 1
766 . 1 1 65 65 THR HB H 1 4.28618 0.02306 . 1 . . . . 213 Thr HB . 17113 1
767 . 1 1 65 65 THR HG21 H 1 1.1833 0.00185 . 2 . . . . 213 Thr HG2* . 17113 1
768 . 1 1 65 65 THR HG22 H 1 1.1833 0.00185 . 2 . . . . 213 Thr HG2* . 17113 1
769 . 1 1 65 65 THR HG23 H 1 1.1833 0.00185 . 2 . . . . 213 Thr HG2* . 17113 1
770 . 1 1 65 65 THR C C 13 173.65326 0.1 . 1 . . . . 213 Thr C . 17113 1
771 . 1 1 65 65 THR CA C 13 61.61549 0.08895 . 1 . . . . 213 Thr CA . 17113 1
772 . 1 1 65 65 THR CB C 13 70.00271 0.12996 . 1 . . . . 213 Thr CB . 17113 1
773 . 1 1 65 65 THR CG2 C 13 21.75659 0.3 . 1 . . . . 213 Thr CG2 . 17113 1
774 . 1 1 65 65 THR N N 15 113.8238 0.15797 . 1 . . . . 213 Thr N . 17113 1
775 . 1 1 66 66 ASN H H 1 8.06322 0.00692 . 1 . . . . 214 Asn H . 17113 1
776 . 1 1 66 66 ASN HD21 H 1 6.7983 0.00123 . 2 . . . . 214 Asn HD21 . 17113 1
777 . 1 1 66 66 ASN HD22 H 1 7.48466 9.75E-04 . 2 . . . . 214 Asn HD22 . 17113 1
778 . 1 1 66 66 ASN CA C 13 54.88736 0.3 . 1 . . . . 214 Asn CA . 17113 1
779 . 1 1 66 66 ASN CB C 13 40.4325 0.01041 . 1 . . . . 214 Asn CB . 17113 1
780 . 1 1 66 66 ASN N N 15 126.39583 0.22323 . 1 . . . . 214 Asn N . 17113 1
781 . 1 1 66 66 ASN ND2 N 15 112.66242 0.21972 . 1 . . . . 214 Asn ND2 . 17113 1
782 . 1 1 69 69 ASP HB2 H 1 2.63608 0.01 . 2 . . . . 217 Asp HB2 . 17113 1
783 . 1 1 69 69 ASP HD2 H 1 4.65139 0.01 . 1 . . . . 217 Asp HD2 . 17113 1
784 . 1 1 69 69 ASP CA C 13 54.49107 0.03289 . 1 . . . . 217 Asp CA . 17113 1
785 . 1 1 69 69 ASP CB C 13 41.2482 0.04912 . 1 . . . . 217 Asp CB . 17113 1
786 . 1 1 70 70 THR H H 1 7.99789 0.00875 . 1 . . . . 218 Thr H . 17113 1
787 . 1 1 70 70 THR CA C 13 61.597 0.03364 . 1 . . . . 218 Thr CA . 17113 1
788 . 1 1 70 70 THR CB C 13 70.1306 0.05945 . 1 . . . . 218 Thr CB . 17113 1
789 . 1 1 70 70 THR N N 15 113.98008 0.04606 . 1 . . . . 218 Thr N . 17113 1
790 . 1 1 71 71 VAL H H 1 8.1704 0.00363 . 1 . . . . 219 Val H . 17113 1
791 . 1 1 71 71 VAL CA C 13 61.97685 0.07871 . 1 . . . . 219 Val CA . 17113 1
792 . 1 1 71 71 VAL CB C 13 32.97002 0.13112 . 1 . . . . 219 Val CB . 17113 1
793 . 1 1 71 71 VAL N N 15 121.74522 0.01523 . 1 . . . . 219 Val N . 17113 1
794 . 1 1 72 72 ASP H H 1 7.94756 0.00507 . 1 . . . . 220 Asp H . 17113 1
795 . 1 1 72 72 ASP CA C 13 55.9069 0.3 . 1 . . . . 220 Asp CA . 17113 1
796 . 1 1 72 72 ASP CB C 13 42.29259 0.3 . 1 . . . . 220 Asp CB . 17113 1
797 . 1 1 72 72 ASP N N 15 129.14912 0.08172 . 1 . . . . 220 Asp N . 17113 1
798 . 1 1 77 77 ILE H H 1 8.3092 0.01 . 1 . . . . 225 Ile H . 17113 1
799 . 1 1 77 77 ILE N N 15 123.5274 0.02 . 1 . . . . 225 Ile N . 17113 1
800 . 1 1 78 78 VAL H H 1 8.33929 0.00556 . 1 . . . . 226 Val H . 17113 1
801 . 1 1 78 78 VAL N N 15 125.87412 0.12339 . 1 . . . . 226 Val N . 17113 1
802 . 1 1 79 79 THR CA C 13 60.99191 0.12118 . 1 . . . . 227 Thr CA . 17113 1
803 . 1 1 79 79 THR CB C 13 69.96478 0.3 . 1 . . . . 227 Thr CB . 17113 1
804 . 1 1 79 79 THR CG2 C 13 17.06894 0.3 . 1 . . . . 227 Thr CG2 . 17113 1
805 . 1 1 80 80 ASP H H 1 7.92752 0.00567 . 1 . . . . 228 Asp H . 17113 1
806 . 1 1 80 80 ASP N N 15 128.17587 0.08526 . 1 . . . . 228 Asp N . 17113 1
stop_
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