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 19600
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $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' . . . 19600 1
2 '3D CBCA(CO)NH' . . . 19600 1
3 '3D HNCACB' . . . 19600 1
4 '3D HNCO' . . . 19600 1
5 '3D HNCA' . . . 19600 1
6 '3D HBHA(CO)NH' . . . 19600 1
7 '3D 1H-15N NOESY' . . . 19600 1
8 '3D HCCH-TOCSY' . . . 19600 1
9 '3D 1H-13C NOESY' . . . 19600 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 2 2 PRO HA H 1 4.234 0.006 . . . . . A 2 PRO HA . 19600 1
2 . 1 1 2 2 PRO HB2 H 1 1.667 0.007 . . . . . A 2 PRO HB2 . 19600 1
3 . 1 1 2 2 PRO HB3 H 1 2.067 0.005 . . . . . A 2 PRO HB3 . 19600 1
4 . 1 1 2 2 PRO HG2 H 1 1.758 0.007 . . . . . A 2 PRO HG2 . 19600 1
5 . 1 1 2 2 PRO HG3 H 1 1.759 0.008 . . . . . A 2 PRO HG3 . 19600 1
6 . 1 1 2 2 PRO HD2 H 1 3.336 0.005 . . . . . A 2 PRO HD2 . 19600 1
7 . 1 1 2 2 PRO HD3 H 1 3.337 0.005 . . . . . A 2 PRO HD3 . 19600 1
8 . 1 1 2 2 PRO CA C 13 63.216 0.113 . . . . . A 2 PRO CA . 19600 1
9 . 1 1 2 2 PRO CB C 13 32.566 0.087 . . . . . A 2 PRO CB . 19600 1
10 . 1 1 2 2 PRO CG C 13 27.325 0.098 . . . . . A 2 PRO CG . 19600 1
11 . 1 1 2 2 PRO CD C 13 49.854 0.074 . . . . . A 2 PRO CD . 19600 1
12 . 1 1 3 3 ARG H H 1 8.377 0.006 . . . . . A 3 ARG H . 19600 1
13 . 1 1 3 3 ARG HA H 1 4.051 0.005 . . . . . A 3 ARG HA . 19600 1
14 . 1 1 3 3 ARG HB2 H 1 1.585 0.004 . . . . . A 3 ARG HB2 . 19600 1
15 . 1 1 3 3 ARG HB3 H 1 1.530 0.003 . . . . . A 3 ARG HB3 . 19600 1
16 . 1 1 3 3 ARG HG2 H 1 1.386 0.004 . . . . . A 3 ARG HG2 . 19600 1
17 . 1 1 3 3 ARG HG3 H 1 1.382 0.000 . . . . . A 3 ARG HG3 . 19600 1
18 . 1 1 3 3 ARG HD2 H 1 2.961 0.007 . . . . . A 3 ARG HD2 . 19600 1
19 . 1 1 3 3 ARG HD3 H 1 2.961 0.007 . . . . . A 3 ARG HD3 . 19600 1
20 . 1 1 3 3 ARG CA C 13 56.508 0.089 . . . . . A 3 ARG CA . 19600 1
21 . 1 1 3 3 ARG CB C 13 30.742 0.064 . . . . . A 3 ARG CB . 19600 1
22 . 1 1 3 3 ARG CG C 13 27.435 0.083 . . . . . A 3 ARG CG . 19600 1
23 . 1 1 3 3 ARG CD C 13 43.684 0.095 . . . . . A 3 ARG CD . 19600 1
24 . 1 1 3 3 ARG N N 15 122.101 0.036 . . . . . A 3 ARG N . 19600 1
25 . 1 1 4 4 LYS H H 1 8.278 0.005 . . . . . A 4 LYS H . 19600 1
26 . 1 1 4 4 LYS HA H 1 4.020 0.005 . . . . . A 4 LYS HA . 19600 1
27 . 1 1 4 4 LYS HB2 H 1 2.129 0.003 . . . . . A 4 LYS HB2 . 19600 1
28 . 1 1 4 4 LYS HB3 H 1 1.527 0.011 . . . . . A 4 LYS HB3 . 19600 1
29 . 1 1 4 4 LYS HG2 H 1 1.187 0.003 . . . . . A 4 LYS HG2 . 19600 1
30 . 1 1 4 4 LYS HG3 H 1 1.153 0.004 . . . . . A 4 LYS HG3 . 19600 1
31 . 1 1 4 4 LYS HD2 H 1 1.435 0.003 . . . . . A 4 LYS HD2 . 19600 1
32 . 1 1 4 4 LYS CA C 13 56.582 0.028 . . . . . A 4 LYS CA . 19600 1
33 . 1 1 4 4 LYS CB C 13 33.202 0.131 . . . . . A 4 LYS CB . 19600 1
34 . 1 1 4 4 LYS CG C 13 25.010 0.000 . . . . . A 4 LYS CG . 19600 1
35 . 1 1 4 4 LYS CD C 13 29.341 0.010 . . . . . A 4 LYS CD . 19600 1
36 . 1 1 4 4 LYS N N 15 123.421 0.056 . . . . . A 4 LYS N . 19600 1
37 . 1 1 5 5 ASN H H 1 8.318 0.003 . . . . . A 5 ASN H . 19600 1
38 . 1 1 5 5 ASN HA H 1 4.420 0.007 . . . . . A 5 ASN HA . 19600 1
39 . 1 1 5 5 ASN HB2 H 1 2.567 0.014 . . . . . A 5 ASN HB2 . 19600 1
40 . 1 1 5 5 ASN HB3 H 1 2.526 0.014 . . . . . A 5 ASN HB3 . 19600 1
41 . 1 1 5 5 ASN CA C 13 53.372 0.115 . . . . . A 5 ASN CA . 19600 1
42 . 1 1 5 5 ASN CB C 13 38.896 0.034 . . . . . A 5 ASN CB . 19600 1
43 . 1 1 5 5 ASN N N 15 120.133 0.036 . . . . . A 5 ASN N . 19600 1
44 . 1 1 6 6 ARG H H 1 8.185 0.003 . . . . . A 6 ARG H . 19600 1
45 . 1 1 6 6 ARG HA H 1 4.039 0.004 . . . . . A 6 ARG HA . 19600 1
46 . 1 1 6 6 ARG HB2 H 1 1.572 0.004 . . . . . A 6 ARG HB2 . 19600 1
47 . 1 1 6 6 ARG HB3 H 1 1.595 0.000 . . . . . A 6 ARG HB3 . 19600 1
48 . 1 1 6 6 ARG HG2 H 1 1.383 0.002 . . . . . A 6 ARG HG2 . 19600 1
49 . 1 1 6 6 ARG HG3 H 1 1.383 0.002 . . . . . A 6 ARG HG3 . 19600 1
50 . 1 1 6 6 ARG HD2 H 1 2.962 0.005 . . . . . A 6 ARG HD2 . 19600 1
51 . 1 1 6 6 ARG HD3 H 1 2.962 0.005 . . . . . A 6 ARG HD3 . 19600 1
52 . 1 1 6 6 ARG CA C 13 56.539 0.078 . . . . . A 6 ARG CA . 19600 1
53 . 1 1 6 6 ARG CB C 13 30.729 0.000 . . . . . A 6 ARG CB . 19600 1
54 . 1 1 6 6 ARG CG C 13 27.364 0.000 . . . . . A 6 ARG CG . 19600 1
55 . 1 1 6 6 ARG CD C 13 43.597 0.009 . . . . . A 6 ARG CD . 19600 1
56 . 1 1 6 6 ARG N N 15 121.990 0.021 . . . . . A 6 ARG N . 19600 1
57 . 1 1 7 7 ARG H H 1 8.237 0.004 . . . . . A 7 ARG H . 19600 1
58 . 1 1 7 7 ARG HA H 1 4.010 0.008 . . . . . A 7 ARG HA . 19600 1
59 . 1 1 7 7 ARG HB2 H 1 1.592 0.003 . . . . . A 7 ARG HB2 . 19600 1
60 . 1 1 7 7 ARG HB3 H 1 1.592 0.003 . . . . . A 7 ARG HB3 . 19600 1
61 . 1 1 7 7 ARG HD2 H 1 2.960 0.000 . . . . . A 7 ARG HD2 . 19600 1
62 . 1 1 7 7 ARG HD3 H 1 2.960 0.000 . . . . . A 7 ARG HD3 . 19600 1
63 . 1 1 7 7 ARG CA C 13 56.473 0.077 . . . . . A 7 ARG CA . 19600 1
64 . 1 1 7 7 ARG CB C 13 30.901 0.042 . . . . . A 7 ARG CB . 19600 1
65 . 1 1 7 7 ARG N N 15 122.520 0.018 . . . . . A 7 ARG N . 19600 1
66 . 1 1 8 8 GLU H H 1 7.971 0.007 . . . . . A 8 GLU H . 19600 1
67 . 1 1 8 8 GLU HA H 1 4.019 0.007 . . . . . A 8 GLU HA . 19600 1
68 . 1 1 8 8 GLU HB2 H 1 1.777 0.005 . . . . . A 8 GLU HB2 . 19600 1
69 . 1 1 8 8 GLU HB3 H 1 1.682 0.004 . . . . . A 8 GLU HB3 . 19600 1
70 . 1 1 8 8 GLU HG2 H 1 2.000 0.003 . . . . . A 8 GLU HG2 . 19600 1
71 . 1 1 8 8 GLU HG3 H 1 1.998 0.004 . . . . . A 8 GLU HG3 . 19600 1
72 . 1 1 8 8 GLU CA C 13 56.546 0.090 . . . . . A 8 GLU CA . 19600 1
73 . 1 1 8 8 GLU CB C 13 30.559 0.045 . . . . . A 8 GLU CB . 19600 1
74 . 1 1 8 8 GLU CG C 13 34.307 0.011 . . . . . A 8 GLU CG . 19600 1
75 . 1 1 8 8 GLU N N 15 121.543 0.079 . . . . . A 8 GLU N . 19600 1
76 . 1 1 9 9 ARG H H 1 8.290 0.004 . . . . . A 9 ARG H . 19600 1
77 . 1 1 9 9 ARG HA H 1 4.151 0.005 . . . . . A 9 ARG HA . 19600 1
78 . 1 1 9 9 ARG HB2 H 1 1.535 0.006 . . . . . A 9 ARG HB2 . 19600 1
79 . 1 1 9 9 ARG HB3 H 1 1.606 0.007 . . . . . A 9 ARG HB3 . 19600 1
80 . 1 1 9 9 ARG HG2 H 1 1.368 0.010 . . . . . A 9 ARG HG2 . 19600 1
81 . 1 1 9 9 ARG HG3 H 1 1.410 0.011 . . . . . A 9 ARG HG3 . 19600 1
82 . 1 1 9 9 ARG HD2 H 1 2.960 0.007 . . . . . A 9 ARG HD2 . 19600 1
83 . 1 1 9 9 ARG HD3 H 1 2.960 0.007 . . . . . A 9 ARG HD3 . 19600 1
84 . 1 1 9 9 ARG CA C 13 56.395 0.121 . . . . . A 9 ARG CA . 19600 1
85 . 1 1 9 9 ARG CB C 13 30.953 0.123 . . . . . A 9 ARG CB . 19600 1
86 . 1 1 9 9 ARG CG C 13 27.330 0.000 . . . . . A 9 ARG CG . 19600 1
87 . 1 1 9 9 ARG CD C 13 43.685 0.109 . . . . . A 9 ARG CD . 19600 1
88 . 1 1 9 9 ARG N N 15 122.730 0.024 . . . . . A 9 ARG N . 19600 1
89 . 1 1 10 10 THR H H 1 8.132 0.004 . . . . . A 10 THR H . 19600 1
90 . 1 1 10 10 THR HA H 1 4.073 0.006 . . . . . A 10 THR HA . 19600 1
91 . 1 1 10 10 THR HB H 1 3.881 0.015 . . . . . A 10 THR HB . 19600 1
92 . 1 1 10 10 THR HG21 H 1 0.844 0.007 . . . . . A 10 THR HG21 . 19600 1
93 . 1 1 10 10 THR HG22 H 1 0.844 0.007 . . . . . A 10 THR HG22 . 19600 1
94 . 1 1 10 10 THR HG23 H 1 0.844 0.007 . . . . . A 10 THR HG23 . 19600 1
95 . 1 1 10 10 THR CA C 13 62.073 0.050 . . . . . A 10 THR CA . 19600 1
96 . 1 1 10 10 THR CB C 13 70.102 0.171 . . . . . A 10 THR CB . 19600 1
97 . 1 1 10 10 THR CG2 C 13 21.762 0.059 . . . . . A 10 THR CG2 . 19600 1
98 . 1 1 10 10 THR N N 15 116.410 0.026 . . . . . A 10 THR N . 19600 1
99 . 1 1 11 11 THR H H 1 7.868 0.005 . . . . . A 11 THR H . 19600 1
100 . 1 1 11 11 THR HA H 1 4.101 0.009 . . . . . A 11 THR HA . 19600 1
101 . 1 1 11 11 THR HB H 1 3.874 0.005 . . . . . A 11 THR HB . 19600 1
102 . 1 1 11 11 THR HG21 H 1 0.830 0.003 . . . . . A 11 THR HG21 . 19600 1
103 . 1 1 11 11 THR HG22 H 1 0.830 0.003 . . . . . A 11 THR HG22 . 19600 1
104 . 1 1 11 11 THR HG23 H 1 0.830 0.003 . . . . . A 11 THR HG23 . 19600 1
105 . 1 1 11 11 THR CA C 13 61.581 0.122 . . . . . A 11 THR CA . 19600 1
106 . 1 1 11 11 THR CB C 13 70.193 0.043 . . . . . A 11 THR CB . 19600 1
107 . 1 1 11 11 THR CG2 C 13 21.696 0.000 . . . . . A 11 THR CG2 . 19600 1
108 . 1 1 11 11 THR N N 15 117.607 0.066 . . . . . A 11 THR N . 19600 1
109 . 1 1 12 12 TYR H H 1 8.053 0.007 . . . . . A 12 TYR H . 19600 1
110 . 1 1 12 12 TYR HA H 1 4.598 0.011 . . . . . A 12 TYR HA . 19600 1
111 . 1 1 12 12 TYR HB2 H 1 2.721 0.004 . . . . . A 12 TYR HB2 . 19600 1
112 . 1 1 12 12 TYR HB3 H 1 2.419 0.009 . . . . . A 12 TYR HB3 . 19600 1
113 . 1 1 12 12 TYR HD1 H 1 8.064 0.000 . . . . . A 12 TYR HD1 . 19600 1
114 . 1 1 12 12 TYR HD2 H 1 8.064 0.000 . . . . . A 12 TYR HD2 . 19600 1
115 . 1 1 12 12 TYR HE2 H 1 6.722 0.007 . . . . . A 12 TYR HE2 . 19600 1
116 . 1 1 12 12 TYR CA C 13 57.101 0.115 . . . . . A 12 TYR CA . 19600 1
117 . 1 1 12 12 TYR CB C 13 40.517 0.154 . . . . . A 12 TYR CB . 19600 1
118 . 1 1 12 12 TYR N N 15 122.200 0.028 . . . . . A 12 TYR N . 19600 1
119 . 1 1 13 13 SER H H 1 8.976 0.003 . . . . . A 13 SER H . 19600 1
120 . 1 1 13 13 SER HA H 1 4.340 0.008 . . . . . A 13 SER HA . 19600 1
121 . 1 1 13 13 SER HB2 H 1 3.738 0.008 . . . . . A 13 SER HB2 . 19600 1
122 . 1 1 13 13 SER HB3 H 1 3.738 0.008 . . . . . A 13 SER HB3 . 19600 1
123 . 1 1 13 13 SER CA C 13 56.906 0.066 . . . . . A 13 SER CA . 19600 1
124 . 1 1 13 13 SER CB C 13 65.860 0.075 . . . . . A 13 SER CB . 19600 1
125 . 1 1 13 13 SER N N 15 119.084 0.036 . . . . . A 13 SER N . 19600 1
126 . 1 1 14 14 ARG H H 1 8.824 0.005 . . . . . A 14 ARG H . 19600 1
127 . 1 1 14 14 ARG HA H 1 3.750 0.005 . . . . . A 14 ARG HA . 19600 1
128 . 1 1 14 14 ARG HB2 H 1 1.591 0.004 . . . . . A 14 ARG HB2 . 19600 1
129 . 1 1 14 14 ARG HB3 H 1 1.490 0.004 . . . . . A 14 ARG HB3 . 19600 1
130 . 1 1 14 14 ARG HG2 H 1 1.372 0.004 . . . . . A 14 ARG HG2 . 19600 1
131 . 1 1 14 14 ARG HG3 H 1 1.167 0.002 . . . . . A 14 ARG HG3 . 19600 1
132 . 1 1 14 14 ARG HD2 H 1 2.994 0.003 . . . . . A 14 ARG HD2 . 19600 1
133 . 1 1 14 14 ARG HD3 H 1 2.990 0.006 . . . . . A 14 ARG HD3 . 19600 1
134 . 1 1 14 14 ARG CA C 13 59.978 0.052 . . . . . A 14 ARG CA . 19600 1
135 . 1 1 14 14 ARG CB C 13 29.445 0.051 . . . . . A 14 ARG CB . 19600 1
136 . 1 1 14 14 ARG CG C 13 27.453 0.019 . . . . . A 14 ARG CG . 19600 1
137 . 1 1 14 14 ARG CD C 13 43.221 0.134 . . . . . A 14 ARG CD . 19600 1
138 . 1 1 14 14 ARG N N 15 121.463 0.033 . . . . . A 14 ARG N . 19600 1
139 . 1 1 15 15 GLN H H 1 8.341 0.003 . . . . . A 15 GLN H . 19600 1
140 . 1 1 15 15 GLN HA H 1 3.817 0.003 . . . . . A 15 GLN HA . 19600 1
141 . 1 1 15 15 GLN HB2 H 1 1.874 0.095 . . . . . A 15 GLN HB2 . 19600 1
142 . 1 1 15 15 GLN HB3 H 1 1.726 0.003 . . . . . A 15 GLN HB3 . 19600 1
143 . 1 1 15 15 GLN HG2 H 1 2.186 0.005 . . . . . A 15 GLN HG2 . 19600 1
144 . 1 1 15 15 GLN HG3 H 1 2.188 0.006 . . . . . A 15 GLN HG3 . 19600 1
145 . 1 1 15 15 GLN CA C 13 59.606 0.082 . . . . . A 15 GLN CA . 19600 1
146 . 1 1 15 15 GLN CB C 13 28.230 0.041 . . . . . A 15 GLN CB . 19600 1
147 . 1 1 15 15 GLN CG C 13 34.424 0.041 . . . . . A 15 GLN CG . 19600 1
148 . 1 1 15 15 GLN N N 15 117.760 0.031 . . . . . A 15 GLN N . 19600 1
149 . 1 1 16 16 GLN H H 1 7.487 0.004 . . . . . A 16 GLN H . 19600 1
150 . 1 1 16 16 GLN HA H 1 3.502 0.007 . . . . . A 16 GLN HA . 19600 1
151 . 1 1 16 16 GLN HB2 H 1 2.363 0.006 . . . . . A 16 GLN HB2 . 19600 1
152 . 1 1 16 16 GLN HB3 H 1 1.322 0.010 . . . . . A 16 GLN HB3 . 19600 1
153 . 1 1 16 16 GLN CA C 13 59.533 0.138 . . . . . A 16 GLN CA . 19600 1
154 . 1 1 16 16 GLN CB C 13 28.430 0.077 . . . . . A 16 GLN CB . 19600 1
155 . 1 1 16 16 GLN N N 15 117.933 0.034 . . . . . A 16 GLN N . 19600 1
156 . 1 1 17 17 LEU H H 1 8.070 0.005 . . . . . A 17 LEU H . 19600 1
157 . 1 1 17 17 LEU HA H 1 3.372 0.007 . . . . . A 17 LEU HA . 19600 1
158 . 1 1 17 17 LEU HB2 H 1 1.261 0.009 . . . . . A 17 LEU HB2 . 19600 1
159 . 1 1 17 17 LEU HB3 H 1 1.561 0.006 . . . . . A 17 LEU HB3 . 19600 1
160 . 1 1 17 17 LEU HG H 1 1.444 0.005 . . . . . A 17 LEU HG . 19600 1
161 . 1 1 17 17 LEU HD11 H 1 0.648 0.005 . . . . . A 17 LEU HD11 . 19600 1
162 . 1 1 17 17 LEU HD12 H 1 0.648 0.005 . . . . . A 17 LEU HD12 . 19600 1
163 . 1 1 17 17 LEU HD13 H 1 0.648 0.005 . . . . . A 17 LEU HD13 . 19600 1
164 . 1 1 17 17 LEU HD21 H 1 0.540 0.006 . . . . . A 17 LEU HD21 . 19600 1
165 . 1 1 17 17 LEU HD22 H 1 0.540 0.006 . . . . . A 17 LEU HD22 . 19600 1
166 . 1 1 17 17 LEU HD23 H 1 0.540 0.006 . . . . . A 17 LEU HD23 . 19600 1
167 . 1 1 17 17 LEU CA C 13 57.761 0.072 . . . . . A 17 LEU CA . 19600 1
168 . 1 1 17 17 LEU CB C 13 41.492 0.059 . . . . . A 17 LEU CB . 19600 1
169 . 1 1 17 17 LEU CG C 13 26.949 0.079 . . . . . A 17 LEU CG . 19600 1
170 . 1 1 17 17 LEU CD1 C 13 24.938 0.000 . . . . . A 17 LEU CD1 . 19600 1
171 . 1 1 17 17 LEU CD2 C 13 23.583 0.078 . . . . . A 17 LEU CD2 . 19600 1
172 . 1 1 17 17 LEU N N 15 117.025 0.052 . . . . . A 17 LEU N . 19600 1
173 . 1 1 18 18 GLU H H 1 7.857 0.011 . . . . . A 18 GLU H . 19600 1
174 . 1 1 18 18 GLU HA H 1 3.730 0.004 . . . . . A 18 GLU HA . 19600 1
175 . 1 1 18 18 GLU HB2 H 1 1.855 0.008 . . . . . A 18 GLU HB2 . 19600 1
176 . 1 1 18 18 GLU HB3 H 1 1.731 0.005 . . . . . A 18 GLU HB3 . 19600 1
177 . 1 1 18 18 GLU HG2 H 1 2.133 0.005 . . . . . A 18 GLU HG2 . 19600 1
178 . 1 1 18 18 GLU HG3 H 1 2.143 0.014 . . . . . A 18 GLU HG3 . 19600 1
179 . 1 1 18 18 GLU CA C 13 59.767 0.093 . . . . . A 18 GLU CA . 19600 1
180 . 1 1 18 18 GLU CB C 13 29.551 0.104 . . . . . A 18 GLU CB . 19600 1
181 . 1 1 18 18 GLU CG C 13 34.071 0.059 . . . . . A 18 GLU CG . 19600 1
182 . 1 1 18 18 GLU N N 15 118.469 0.047 . . . . . A 18 GLU N . 19600 1
183 . 1 1 19 19 ILE H H 1 7.076 0.010 . . . . . A 19 ILE H . 19600 1
184 . 1 1 19 19 ILE HA H 1 3.420 0.006 . . . . . A 19 ILE HA . 19600 1
185 . 1 1 19 19 ILE HB H 1 1.596 0.004 . . . . . A 19 ILE HB . 19600 1
186 . 1 1 19 19 ILE HG12 H 1 1.019 0.005 . . . . . A 19 ILE HG12 . 19600 1
187 . 1 1 19 19 ILE HG13 H 1 1.352 0.003 . . . . . A 19 ILE HG13 . 19600 1
188 . 1 1 19 19 ILE HG21 H 1 0.662 0.007 . . . . . A 19 ILE HG21 . 19600 1
189 . 1 1 19 19 ILE HG22 H 1 0.662 0.007 . . . . . A 19 ILE HG22 . 19600 1
190 . 1 1 19 19 ILE HG23 H 1 0.662 0.007 . . . . . A 19 ILE HG23 . 19600 1
191 . 1 1 19 19 ILE HD11 H 1 0.519 0.009 . . . . . A 19 ILE HD11 . 19600 1
192 . 1 1 19 19 ILE HD12 H 1 0.519 0.009 . . . . . A 19 ILE HD12 . 19600 1
193 . 1 1 19 19 ILE HD13 H 1 0.519 0.009 . . . . . A 19 ILE HD13 . 19600 1
194 . 1 1 19 19 ILE CA C 13 64.537 0.081 . . . . . A 19 ILE CA . 19600 1
195 . 1 1 19 19 ILE CB C 13 37.691 0.129 . . . . . A 19 ILE CB . 19600 1
196 . 1 1 19 19 ILE CG1 C 13 27.460 0.000 . . . . . A 19 ILE CG1 . 19600 1
197 . 1 1 19 19 ILE CG2 C 13 17.472 0.000 . . . . . A 19 ILE CG2 . 19600 1
198 . 1 1 19 19 ILE CD1 C 13 12.890 0.087 . . . . . A 19 ILE CD1 . 19600 1
199 . 1 1 19 19 ILE N N 15 121.154 0.030 . . . . . A 19 ILE N . 19600 1
200 . 1 1 20 20 LEU H H 1 7.600 0.009 . . . . . A 20 LEU H . 19600 1
201 . 1 1 20 20 LEU HA H 1 3.324 0.006 . . . . . A 20 LEU HA . 19600 1
202 . 1 1 20 20 LEU HB2 H 1 0.834 0.008 . . . . . A 20 LEU HB2 . 19600 1
203 . 1 1 20 20 LEU HB3 H 1 0.750 0.002 . . . . . A 20 LEU HB3 . 19600 1
204 . 1 1 20 20 LEU HG H 1 0.566 0.000 . . . . . A 20 LEU HG . 19600 1
205 . 1 1 20 20 LEU HD11 H 1 0.333 0.002 . . . . . A 20 LEU HD11 . 19600 1
206 . 1 1 20 20 LEU HD12 H 1 0.333 0.002 . . . . . A 20 LEU HD12 . 19600 1
207 . 1 1 20 20 LEU HD13 H 1 0.333 0.002 . . . . . A 20 LEU HD13 . 19600 1
208 . 1 1 20 20 LEU HD21 H 1 0.220 0.004 . . . . . A 20 LEU HD21 . 19600 1
209 . 1 1 20 20 LEU HD22 H 1 0.220 0.004 . . . . . A 20 LEU HD22 . 19600 1
210 . 1 1 20 20 LEU HD23 H 1 0.220 0.004 . . . . . A 20 LEU HD23 . 19600 1
211 . 1 1 20 20 LEU CA C 13 58.717 0.069 . . . . . A 20 LEU CA . 19600 1
212 . 1 1 20 20 LEU CB C 13 38.562 0.046 . . . . . A 20 LEU CB . 19600 1
213 . 1 1 20 20 LEU CD2 C 13 23.004 0.127 . . . . . A 20 LEU CD2 . 19600 1
214 . 1 1 20 20 LEU N N 15 122.911 0.033 . . . . . A 20 LEU N . 19600 1
215 . 1 1 21 21 GLU H H 1 8.354 0.006 . . . . . A 21 GLU H . 19600 1
216 . 1 1 21 21 GLU HA H 1 4.012 0.010 . . . . . A 21 GLU HA . 19600 1
217 . 1 1 21 21 GLU HB2 H 1 1.734 0.007 . . . . . A 21 GLU HB2 . 19600 1
218 . 1 1 21 21 GLU HB3 H 1 1.844 0.007 . . . . . A 21 GLU HB3 . 19600 1
219 . 1 1 21 21 GLU HG2 H 1 2.153 0.009 . . . . . A 21 GLU HG2 . 19600 1
220 . 1 1 21 21 GLU HG3 H 1 2.156 0.003 . . . . . A 21 GLU HG3 . 19600 1
221 . 1 1 21 21 GLU CA C 13 58.928 0.092 . . . . . A 21 GLU CA . 19600 1
222 . 1 1 21 21 GLU CB C 13 29.141 0.019 . . . . . A 21 GLU CB . 19600 1
223 . 1 1 21 21 GLU CG C 13 34.114 0.040 . . . . . A 21 GLU CG . 19600 1
224 . 1 1 21 21 GLU N N 15 118.448 0.023 . . . . . A 21 GLU N . 19600 1
225 . 1 1 22 22 THR H H 1 7.703 0.005 . . . . . A 22 THR H . 19600 1
226 . 1 1 22 22 THR HA H 1 3.745 0.008 . . . . . A 22 THR HA . 19600 1
227 . 1 1 22 22 THR HB H 1 4.066 0.005 . . . . . A 22 THR HB . 19600 1
228 . 1 1 22 22 THR HG21 H 1 1.024 0.007 . . . . . A 22 THR HG21 . 19600 1
229 . 1 1 22 22 THR HG22 H 1 1.024 0.007 . . . . . A 22 THR HG22 . 19600 1
230 . 1 1 22 22 THR HG23 H 1 1.024 0.007 . . . . . A 22 THR HG23 . 19600 1
231 . 1 1 22 22 THR CA C 13 67.433 0.088 . . . . . A 22 THR CA . 19600 1
232 . 1 1 22 22 THR CB C 13 68.490 0.030 . . . . . A 22 THR CB . 19600 1
233 . 1 1 22 22 THR N N 15 116.336 0.040 . . . . . A 22 THR N . 19600 1
234 . 1 1 23 23 LEU H H 1 7.501 0.006 . . . . . A 23 LEU H . 19600 1
235 . 1 1 23 23 LEU HA H 1 4.199 0.007 . . . . . A 23 LEU HA . 19600 1
236 . 1 1 23 23 LEU HB2 H 1 1.365 0.011 . . . . . A 23 LEU HB2 . 19600 1
237 . 1 1 23 23 LEU HB3 H 1 2.087 0.006 . . . . . A 23 LEU HB3 . 19600 1
238 . 1 1 23 23 LEU HG H 1 1.546 0.003 . . . . . A 23 LEU HG . 19600 1
239 . 1 1 23 23 LEU HD11 H 1 0.790 0.005 . . . . . A 23 LEU HD11 . 19600 1
240 . 1 1 23 23 LEU HD12 H 1 0.790 0.005 . . . . . A 23 LEU HD12 . 19600 1
241 . 1 1 23 23 LEU HD13 H 1 0.790 0.005 . . . . . A 23 LEU HD13 . 19600 1
242 . 1 1 23 23 LEU HD21 H 1 0.610 0.007 . . . . . A 23 LEU HD21 . 19600 1
243 . 1 1 23 23 LEU HD22 H 1 0.610 0.007 . . . . . A 23 LEU HD22 . 19600 1
244 . 1 1 23 23 LEU HD23 H 1 0.610 0.007 . . . . . A 23 LEU HD23 . 19600 1
245 . 1 1 23 23 LEU CA C 13 58.295 0.067 . . . . . A 23 LEU CA . 19600 1
246 . 1 1 23 23 LEU CB C 13 40.837 0.114 . . . . . A 23 LEU CB . 19600 1
247 . 1 1 23 23 LEU CG C 13 27.209 0.047 . . . . . A 23 LEU CG . 19600 1
248 . 1 1 23 23 LEU CD1 C 13 23.033 0.188 . . . . . A 23 LEU CD1 . 19600 1
249 . 1 1 23 23 LEU CD2 C 13 23.882 0.000 . . . . . A 23 LEU CD2 . 19600 1
250 . 1 1 23 23 LEU N N 15 123.532 0.046 . . . . . A 23 LEU N . 19600 1
251 . 1 1 24 24 PHE H H 1 8.708 0.005 . . . . . A 24 PHE H . 19600 1
252 . 1 1 24 24 PHE HA H 1 4.435 0.005 . . . . . A 24 PHE HA . 19600 1
253 . 1 1 24 24 PHE HB2 H 1 3.045 0.005 . . . . . A 24 PHE HB2 . 19600 1
254 . 1 1 24 24 PHE HB3 H 1 2.949 0.010 . . . . . A 24 PHE HB3 . 19600 1
255 . 1 1 24 24 PHE CA C 13 61.332 0.059 . . . . . A 24 PHE CA . 19600 1
256 . 1 1 24 24 PHE CB C 13 38.978 0.061 . . . . . A 24 PHE CB . 19600 1
257 . 1 1 24 24 PHE N N 15 120.756 0.032 . . . . . A 24 PHE N . 19600 1
258 . 1 1 25 25 ASN H H 1 7.827 0.004 . . . . . A 25 ASN H . 19600 1
259 . 1 1 25 25 ASN HA H 1 4.074 0.003 . . . . . A 25 ASN HA . 19600 1
260 . 1 1 25 25 ASN HB2 H 1 2.690 0.004 . . . . . A 25 ASN HB2 . 19600 1
261 . 1 1 25 25 ASN HB3 H 1 2.620 0.004 . . . . . A 25 ASN HB3 . 19600 1
262 . 1 1 25 25 ASN HD21 H 1 7.824 0.001 . . . . . A 25 ASN HD21 . 19600 1
263 . 1 1 25 25 ASN HD22 H 1 7.526 0.003 . . . . . A 25 ASN HD22 . 19600 1
264 . 1 1 25 25 ASN CA C 13 55.349 0.048 . . . . . A 25 ASN CA . 19600 1
265 . 1 1 25 25 ASN CB C 13 38.800 0.091 . . . . . A 25 ASN CB . 19600 1
266 . 1 1 25 25 ASN N N 15 113.604 0.037 . . . . . A 25 ASN N . 19600 1
267 . 1 1 26 26 GLU H H 1 7.532 0.006 . . . . . A 26 GLU H . 19600 1
268 . 1 1 26 26 GLU HA H 1 3.971 0.008 . . . . . A 26 GLU HA . 19600 1
269 . 1 1 26 26 GLU HB2 H 1 2.068 0.007 . . . . . A 26 GLU HB2 . 19600 1
270 . 1 1 26 26 GLU HB3 H 1 2.003 0.011 . . . . . A 26 GLU HB3 . 19600 1
271 . 1 1 26 26 GLU HG2 H 1 2.181 0.002 . . . . . A 26 GLU HG2 . 19600 1
272 . 1 1 26 26 GLU HG3 H 1 2.178 0.003 . . . . . A 26 GLU HG3 . 19600 1
273 . 1 1 26 26 GLU CA C 13 58.501 0.072 . . . . . A 26 GLU CA . 19600 1
274 . 1 1 26 26 GLU CB C 13 30.088 0.063 . . . . . A 26 GLU CB . 19600 1
275 . 1 1 26 26 GLU CG C 13 33.137 0.000 . . . . . A 26 GLU CG . 19600 1
276 . 1 1 26 26 GLU N N 15 120.985 0.024 . . . . . A 26 GLU N . 19600 1
277 . 1 1 27 27 THR H H 1 8.719 0.007 . . . . . A 27 THR H . 19600 1
278 . 1 1 27 27 THR HA H 1 4.085 0.007 . . . . . A 27 THR HA . 19600 1
279 . 1 1 27 27 THR HB H 1 3.951 0.006 . . . . . A 27 THR HB . 19600 1
280 . 1 1 27 27 THR CA C 13 59.365 0.104 . . . . . A 27 THR CA . 19600 1
281 . 1 1 27 27 THR CB C 13 69.151 0.081 . . . . . A 27 THR CB . 19600 1
282 . 1 1 27 27 THR N N 15 115.986 0.026 . . . . . A 27 THR N . 19600 1
283 . 1 1 28 28 GLN H H 1 7.963 0.003 . . . . . A 28 GLN H . 19600 1
284 . 1 1 28 28 GLN HA H 1 3.654 0.014 . . . . . A 28 GLN HA . 19600 1
285 . 1 1 28 28 GLN HB2 H 1 1.435 0.003 . . . . . A 28 GLN HB2 . 19600 1
286 . 1 1 28 28 GLN HB3 H 1 1.195 0.004 . . . . . A 28 GLN HB3 . 19600 1
287 . 1 1 28 28 GLN CA C 13 57.220 0.078 . . . . . A 28 GLN CA . 19600 1
288 . 1 1 28 28 GLN CB C 13 27.060 0.117 . . . . . A 28 GLN CB . 19600 1
289 . 1 1 28 28 GLN N N 15 122.144 0.041 . . . . . A 28 GLN N . 19600 1
290 . 1 1 29 29 TYR H H 1 7.680 0.003 . . . . . A 29 TYR H . 19600 1
291 . 1 1 29 29 TYR HA H 1 4.429 0.005 . . . . . A 29 TYR HA . 19600 1
292 . 1 1 29 29 TYR HB2 H 1 2.721 0.002 . . . . . A 29 TYR HB2 . 19600 1
293 . 1 1 29 29 TYR HB3 H 1 2.239 0.010 . . . . . A 29 TYR HB3 . 19600 1
294 . 1 1 29 29 TYR HD1 H 1 7.696 0.003 . . . . . A 29 TYR HD1 . 19600 1
295 . 1 1 29 29 TYR HD2 H 1 7.696 0.003 . . . . . A 29 TYR HD2 . 19600 1
296 . 1 1 29 29 TYR HE1 H 1 6.773 0.009 . . . . . A 29 TYR HE1 . 19600 1
297 . 1 1 29 29 TYR HE2 H 1 6.773 0.009 . . . . . A 29 TYR HE2 . 19600 1
298 . 1 1 29 29 TYR CA C 13 55.457 0.081 . . . . . A 29 TYR CA . 19600 1
299 . 1 1 29 29 TYR CB C 13 38.997 0.107 . . . . . A 29 TYR CB . 19600 1
300 . 1 1 29 29 TYR N N 15 114.355 0.101 . . . . . A 29 TYR N . 19600 1
301 . 1 1 30 30 PRO HA H 1 4.074 0.007 . . . . . A 30 PRO HA . 19600 1
302 . 1 1 30 30 PRO HB2 H 1 1.341 0.006 . . . . . A 30 PRO HB2 . 19600 1
303 . 1 1 30 30 PRO HB3 H 1 1.552 0.004 . . . . . A 30 PRO HB3 . 19600 1
304 . 1 1 30 30 PRO HD2 H 1 2.954 0.004 . . . . . A 30 PRO HD2 . 19600 1
305 . 1 1 30 30 PRO HD3 H 1 2.952 0.005 . . . . . A 30 PRO HD3 . 19600 1
306 . 1 1 30 30 PRO CA C 13 62.403 0.115 . . . . . A 30 PRO CA . 19600 1
307 . 1 1 30 30 PRO CB C 13 31.686 0.057 . . . . . A 30 PRO CB . 19600 1
308 . 1 1 30 30 PRO CD C 13 50.787 0.000 . . . . . A 30 PRO CD . 19600 1
309 . 1 1 31 31 ASP H H 1 8.496 0.008 . . . . . A 31 ASP H . 19600 1
310 . 1 1 31 31 ASP HA H 1 4.191 0.006 . . . . . A 31 ASP HA . 19600 1
311 . 1 1 31 31 ASP HB2 H 1 3.001 0.005 . . . . . A 31 ASP HB2 . 19600 1
312 . 1 1 31 31 ASP HB3 H 1 2.576 0.005 . . . . . A 31 ASP HB3 . 19600 1
313 . 1 1 31 31 ASP CA C 13 52.813 0.077 . . . . . A 31 ASP CA . 19600 1
314 . 1 1 31 31 ASP CB C 13 41.087 0.070 . . . . . A 31 ASP CB . 19600 1
315 . 1 1 31 31 ASP N N 15 123.957 0.032 . . . . . A 31 ASP N . 19600 1
316 . 1 1 32 32 VAL H H 1 8.162 0.004 . . . . . A 32 VAL H . 19600 1
317 . 1 1 32 32 VAL HA H 1 3.198 0.006 . . . . . A 32 VAL HA . 19600 1
318 . 1 1 32 32 VAL HB H 1 1.612 0.006 . . . . . A 32 VAL HB . 19600 1
319 . 1 1 32 32 VAL HG11 H 1 0.541 0.006 . . . . . A 32 VAL HG11 . 19600 1
320 . 1 1 32 32 VAL HG12 H 1 0.541 0.006 . . . . . A 32 VAL HG12 . 19600 1
321 . 1 1 32 32 VAL HG13 H 1 0.541 0.006 . . . . . A 32 VAL HG13 . 19600 1
322 . 1 1 32 32 VAL HG21 H 1 0.155 0.005 . . . . . A 32 VAL HG21 . 19600 1
323 . 1 1 32 32 VAL HG22 H 1 0.155 0.005 . . . . . A 32 VAL HG22 . 19600 1
324 . 1 1 32 32 VAL HG23 H 1 0.155 0.005 . . . . . A 32 VAL HG23 . 19600 1
325 . 1 1 32 32 VAL CA C 13 66.250 0.098 . . . . . A 32 VAL CA . 19600 1
326 . 1 1 32 32 VAL CB C 13 31.493 0.066 . . . . . A 32 VAL CB . 19600 1
327 . 1 1 32 32 VAL CG1 C 13 21.806 0.125 . . . . . A 32 VAL CG1 . 19600 1
328 . 1 1 32 32 VAL CG2 C 13 19.153 0.115 . . . . . A 32 VAL CG2 . 19600 1
329 . 1 1 32 32 VAL N N 15 117.950 0.039 . . . . . A 32 VAL N . 19600 1
330 . 1 1 33 33 PHE H H 1 6.841 0.008 . . . . . A 33 PHE H . 19600 1
331 . 1 1 33 33 PHE HA H 1 4.036 0.005 . . . . . A 33 PHE HA . 19600 1
332 . 1 1 33 33 PHE HB2 H 1 2.963 0.006 . . . . . A 33 PHE HB2 . 19600 1
333 . 1 1 33 33 PHE HB3 H 1 2.849 0.005 . . . . . A 33 PHE HB3 . 19600 1
334 . 1 1 33 33 PHE CA C 13 60.514 0.099 . . . . . A 33 PHE CA . 19600 1
335 . 1 1 33 33 PHE CB C 13 37.933 0.072 . . . . . A 33 PHE CB . 19600 1
336 . 1 1 33 33 PHE N N 15 120.199 0.024 . . . . . A 33 PHE N . 19600 1
337 . 1 1 34 34 ALA H H 1 8.139 0.006 . . . . . A 34 ALA H . 19600 1
338 . 1 1 34 34 ALA HA H 1 3.882 0.004 . . . . . A 34 ALA HA . 19600 1
339 . 1 1 34 34 ALA HB1 H 1 1.249 0.009 . . . . . A 34 ALA HB1 . 19600 1
340 . 1 1 34 34 ALA HB2 H 1 1.249 0.009 . . . . . A 34 ALA HB2 . 19600 1
341 . 1 1 34 34 ALA HB3 H 1 1.249 0.009 . . . . . A 34 ALA HB3 . 19600 1
342 . 1 1 34 34 ALA CA C 13 55.142 0.119 . . . . . A 34 ALA CA . 19600 1
343 . 1 1 34 34 ALA CB C 13 18.559 0.034 . . . . . A 34 ALA CB . 19600 1
344 . 1 1 34 34 ALA N N 15 123.742 0.016 . . . . . A 34 ALA N . 19600 1
345 . 1 1 35 35 ARG H H 1 8.281 0.004 . . . . . A 35 ARG H . 19600 1
346 . 1 1 35 35 ARG HA H 1 3.554 0.006 . . . . . A 35 ARG HA . 19600 1
347 . 1 1 35 35 ARG HB2 H 1 1.867 0.008 . . . . . A 35 ARG HB2 . 19600 1
348 . 1 1 35 35 ARG HB3 H 1 1.333 0.006 . . . . . A 35 ARG HB3 . 19600 1
349 . 1 1 35 35 ARG HG2 H 1 1.730 0.007 . . . . . A 35 ARG HG2 . 19600 1
350 . 1 1 35 35 ARG HG3 H 1 1.730 0.007 . . . . . A 35 ARG HG3 . 19600 1
351 . 1 1 35 35 ARG HD2 H 1 2.956 0.004 . . . . . A 35 ARG HD2 . 19600 1
352 . 1 1 35 35 ARG HD3 H 1 2.956 0.004 . . . . . A 35 ARG HD3 . 19600 1
353 . 1 1 35 35 ARG CA C 13 60.747 0.043 . . . . . A 35 ARG CA . 19600 1
354 . 1 1 35 35 ARG CB C 13 31.170 0.036 . . . . . A 35 ARG CB . 19600 1
355 . 1 1 35 35 ARG CG C 13 27.364 0.000 . . . . . A 35 ARG CG . 19600 1
356 . 1 1 35 35 ARG N N 15 116.197 0.025 . . . . . A 35 ARG N . 19600 1
357 . 1 1 36 36 GLU H H 1 8.382 0.007 . . . . . A 36 GLU H . 19600 1
358 . 1 1 36 36 GLU HA H 1 3.697 0.004 . . . . . A 36 GLU HA . 19600 1
359 . 1 1 36 36 GLU HB2 H 1 1.937 0.008 . . . . . A 36 GLU HB2 . 19600 1
360 . 1 1 36 36 GLU HB3 H 1 1.851 0.004 . . . . . A 36 GLU HB3 . 19600 1
361 . 1 1 36 36 GLU HG2 H 1 2.298 0.000 . . . . . A 36 GLU HG2 . 19600 1
362 . 1 1 36 36 GLU HG3 H 1 2.150 0.000 . . . . . A 36 GLU HG3 . 19600 1
363 . 1 1 36 36 GLU CA C 13 59.710 0.036 . . . . . A 36 GLU CA . 19600 1
364 . 1 1 36 36 GLU CB C 13 29.450 0.007 . . . . . A 36 GLU CB . 19600 1
365 . 1 1 36 36 GLU N N 15 119.133 0.034 . . . . . A 36 GLU N . 19600 1
366 . 1 1 37 37 ARG H H 1 7.707 0.006 . . . . . A 37 ARG H . 19600 1
367 . 1 1 37 37 ARG HA H 1 3.912 0.011 . . . . . A 37 ARG HA . 19600 1
368 . 1 1 37 37 ARG HB2 H 1 1.716 0.008 . . . . . A 37 ARG HB2 . 19600 1
369 . 1 1 37 37 ARG HB3 H 1 1.716 0.008 . . . . . A 37 ARG HB3 . 19600 1
370 . 1 1 37 37 ARG HG2 H 1 1.518 0.004 . . . . . A 37 ARG HG2 . 19600 1
371 . 1 1 37 37 ARG HG3 H 1 1.518 0.004 . . . . . A 37 ARG HG3 . 19600 1
372 . 1 1 37 37 ARG HD2 H 1 2.979 0.007 . . . . . A 37 ARG HD2 . 19600 1
373 . 1 1 37 37 ARG HD3 H 1 2.979 0.007 . . . . . A 37 ARG HD3 . 19600 1
374 . 1 1 37 37 ARG CA C 13 59.693 0.102 . . . . . A 37 ARG CA . 19600 1
375 . 1 1 37 37 ARG CB C 13 30.003 0.099 . . . . . A 37 ARG CB . 19600 1
376 . 1 1 37 37 ARG CG C 13 27.343 0.008 . . . . . A 37 ARG CG . 19600 1
377 . 1 1 37 37 ARG CD C 13 43.621 0.050 . . . . . A 37 ARG CD . 19600 1
378 . 1 1 37 37 ARG N N 15 119.597 0.057 . . . . . A 37 ARG N . 19600 1
379 . 1 1 38 38 VAL H H 1 7.630 0.004 . . . . . A 38 VAL H . 19600 1
380 . 1 1 38 38 VAL HA H 1 3.775 0.004 . . . . . A 38 VAL HA . 19600 1
381 . 1 1 38 38 VAL HB H 1 1.844 0.006 . . . . . A 38 VAL HB . 19600 1
382 . 1 1 38 38 VAL HG11 H 1 0.817 0.007 . . . . . A 38 VAL HG11 . 19600 1
383 . 1 1 38 38 VAL HG12 H 1 0.817 0.007 . . . . . A 38 VAL HG12 . 19600 1
384 . 1 1 38 38 VAL HG13 H 1 0.817 0.007 . . . . . A 38 VAL HG13 . 19600 1
385 . 1 1 38 38 VAL HG21 H 1 0.734 0.019 . . . . . A 38 VAL HG21 . 19600 1
386 . 1 1 38 38 VAL HG22 H 1 0.734 0.019 . . . . . A 38 VAL HG22 . 19600 1
387 . 1 1 38 38 VAL HG23 H 1 0.734 0.019 . . . . . A 38 VAL HG23 . 19600 1
388 . 1 1 38 38 VAL CA C 13 65.819 0.100 . . . . . A 38 VAL CA . 19600 1
389 . 1 1 38 38 VAL CB C 13 31.643 0.173 . . . . . A 38 VAL CB . 19600 1
390 . 1 1 38 38 VAL CG1 C 13 24.194 0.093 . . . . . A 38 VAL CG1 . 19600 1
391 . 1 1 38 38 VAL CG2 C 13 22.465 0.079 . . . . . A 38 VAL CG2 . 19600 1
392 . 1 1 38 38 VAL N N 15 119.099 0.022 . . . . . A 38 VAL N . 19600 1
393 . 1 1 39 39 ALA H H 1 8.196 0.008 . . . . . A 39 ALA H . 19600 1
394 . 1 1 39 39 ALA HA H 1 3.691 0.007 . . . . . A 39 ALA HA . 19600 1
395 . 1 1 39 39 ALA HB1 H 1 1.326 0.005 . . . . . A 39 ALA HB1 . 19600 1
396 . 1 1 39 39 ALA HB2 H 1 1.326 0.005 . . . . . A 39 ALA HB2 . 19600 1
397 . 1 1 39 39 ALA HB3 H 1 1.326 0.005 . . . . . A 39 ALA HB3 . 19600 1
398 . 1 1 39 39 ALA CA C 13 56.414 0.030 . . . . . A 39 ALA CA . 19600 1
399 . 1 1 39 39 ALA CB C 13 18.250 0.182 . . . . . A 39 ALA CB . 19600 1
400 . 1 1 39 39 ALA N N 15 124.624 0.033 . . . . . A 39 ALA N . 19600 1
401 . 1 1 40 40 ASP H H 1 7.510 0.006 . . . . . A 40 ASP H . 19600 1
402 . 1 1 40 40 ASP HA H 1 4.197 0.005 . . . . . A 40 ASP HA . 19600 1
403 . 1 1 40 40 ASP HB2 H 1 2.486 0.007 . . . . . A 40 ASP HB2 . 19600 1
404 . 1 1 40 40 ASP HB3 H 1 2.561 0.006 . . . . . A 40 ASP HB3 . 19600 1
405 . 1 1 40 40 ASP CA C 13 56.815 0.067 . . . . . A 40 ASP CA . 19600 1
406 . 1 1 40 40 ASP CB C 13 41.307 0.063 . . . . . A 40 ASP CB . 19600 1
407 . 1 1 40 40 ASP N N 15 115.786 0.057 . . . . . A 40 ASP N . 19600 1
408 . 1 1 41 41 GLN H H 1 7.643 0.007 . . . . . A 41 GLN H . 19600 1
409 . 1 1 41 41 GLN HA H 1 3.835 0.007 . . . . . A 41 GLN HA . 19600 1
410 . 1 1 41 41 GLN HB2 H 1 2.059 0.025 . . . . . A 41 GLN HB2 . 19600 1
411 . 1 1 41 41 GLN HB3 H 1 1.946 0.005 . . . . . A 41 GLN HB3 . 19600 1
412 . 1 1 41 41 GLN HG2 H 1 2.326 0.007 . . . . . A 41 GLN HG2 . 19600 1
413 . 1 1 41 41 GLN HG3 H 1 2.326 0.007 . . . . . A 41 GLN HG3 . 19600 1
414 . 1 1 41 41 GLN CA C 13 59.319 0.108 . . . . . A 41 GLN CA . 19600 1
415 . 1 1 41 41 GLN CB C 13 29.565 0.061 . . . . . A 41 GLN CB . 19600 1
416 . 1 1 41 41 GLN CG C 13 34.679 0.043 . . . . . A 41 GLN CG . 19600 1
417 . 1 1 41 41 GLN N N 15 118.952 0.046 . . . . . A 41 GLN N . 19600 1
418 . 1 1 42 42 ILE H H 1 8.076 0.006 . . . . . A 42 ILE H . 19600 1
419 . 1 1 42 42 ILE HA H 1 4.392 0.008 . . . . . A 42 ILE HA . 19600 1
420 . 1 1 42 42 ILE HB H 1 2.004 0.005 . . . . . A 42 ILE HB . 19600 1
421 . 1 1 42 42 ILE HG12 H 1 1.439 0.004 . . . . . A 42 ILE HG12 . 19600 1
422 . 1 1 42 42 ILE HG13 H 1 1.322 0.009 . . . . . A 42 ILE HG13 . 19600 1
423 . 1 1 42 42 ILE HG21 H 1 0.663 0.005 . . . . . A 42 ILE HG21 . 19600 1
424 . 1 1 42 42 ILE HG22 H 1 0.663 0.005 . . . . . A 42 ILE HG22 . 19600 1
425 . 1 1 42 42 ILE HG23 H 1 0.663 0.005 . . . . . A 42 ILE HG23 . 19600 1
426 . 1 1 42 42 ILE HD11 H 1 0.364 0.006 . . . . . A 42 ILE HD11 . 19600 1
427 . 1 1 42 42 ILE HD12 H 1 0.364 0.006 . . . . . A 42 ILE HD12 . 19600 1
428 . 1 1 42 42 ILE HD13 H 1 0.364 0.006 . . . . . A 42 ILE HD13 . 19600 1
429 . 1 1 42 42 ILE CA C 13 60.792 0.101 . . . . . A 42 ILE CA . 19600 1
430 . 1 1 42 42 ILE CB C 13 38.442 0.121 . . . . . A 42 ILE CB . 19600 1
431 . 1 1 42 42 ILE CG1 C 13 27.151 0.088 . . . . . A 42 ILE CG1 . 19600 1
432 . 1 1 42 42 ILE CG2 C 13 17.472 0.000 . . . . . A 42 ILE CG2 . 19600 1
433 . 1 1 42 42 ILE CD1 C 13 15.271 0.100 . . . . . A 42 ILE CD1 . 19600 1
434 . 1 1 42 42 ILE N N 15 108.381 0.050 . . . . . A 42 ILE N . 19600 1
435 . 1 1 43 43 ARG H H 1 7.588 0.006 . . . . . A 43 ARG H . 19600 1
436 . 1 1 43 43 ARG HA H 1 3.738 0.007 . . . . . A 43 ARG HA . 19600 1
437 . 1 1 43 43 ARG HB2 H 1 1.656 0.005 . . . . . A 43 ARG HB2 . 19600 1
438 . 1 1 43 43 ARG HB3 H 1 1.853 0.008 . . . . . A 43 ARG HB3 . 19600 1
439 . 1 1 43 43 ARG HG2 H 1 1.311 0.006 . . . . . A 43 ARG HG2 . 19600 1
440 . 1 1 43 43 ARG HG3 H 1 1.311 0.006 . . . . . A 43 ARG HG3 . 19600 1
441 . 1 1 43 43 ARG HD2 H 1 2.978 0.015 . . . . . A 43 ARG HD2 . 19600 1
442 . 1 1 43 43 ARG HD3 H 1 2.978 0.015 . . . . . A 43 ARG HD3 . 19600 1
443 . 1 1 43 43 ARG CA C 13 56.823 0.087 . . . . . A 43 ARG CA . 19600 1
444 . 1 1 43 43 ARG CB C 13 26.066 0.094 . . . . . A 43 ARG CB . 19600 1
445 . 1 1 43 43 ARG CG C 13 27.343 0.078 . . . . . A 43 ARG CG . 19600 1
446 . 1 1 43 43 ARG CD C 13 43.635 0.090 . . . . . A 43 ARG CD . 19600 1
447 . 1 1 43 43 ARG N N 15 119.055 0.040 . . . . . A 43 ARG N . 19600 1
448 . 1 1 44 44 LEU H H 1 7.648 0.004 . . . . . A 44 LEU H . 19600 1
449 . 1 1 44 44 LEU HA H 1 4.568 0.006 . . . . . A 44 LEU HA . 19600 1
450 . 1 1 44 44 LEU HB2 H 1 1.027 0.058 . . . . . A 44 LEU HB2 . 19600 1
451 . 1 1 44 44 LEU HB3 H 1 1.203 0.009 . . . . . A 44 LEU HB3 . 19600 1
452 . 1 1 44 44 LEU HG H 1 1.341 0.010 . . . . . A 44 LEU HG . 19600 1
453 . 1 1 44 44 LEU HD11 H 1 0.516 0.007 . . . . . A 44 LEU HD11 . 19600 1
454 . 1 1 44 44 LEU HD12 H 1 0.516 0.007 . . . . . A 44 LEU HD12 . 19600 1
455 . 1 1 44 44 LEU HD13 H 1 0.516 0.007 . . . . . A 44 LEU HD13 . 19600 1
456 . 1 1 44 44 LEU HD21 H 1 0.671 0.021 . . . . . A 44 LEU HD21 . 19600 1
457 . 1 1 44 44 LEU HD22 H 1 0.671 0.021 . . . . . A 44 LEU HD22 . 19600 1
458 . 1 1 44 44 LEU HD23 H 1 0.671 0.021 . . . . . A 44 LEU HD23 . 19600 1
459 . 1 1 44 44 LEU CA C 13 52.996 0.081 . . . . . A 44 LEU CA . 19600 1
460 . 1 1 44 44 LEU CB C 13 47.600 0.142 . . . . . A 44 LEU CB . 19600 1
461 . 1 1 44 44 LEU CG C 13 27.022 0.056 . . . . . A 44 LEU CG . 19600 1
462 . 1 1 44 44 LEU CD1 C 13 23.217 0.000 . . . . . A 44 LEU CD1 . 19600 1
463 . 1 1 44 44 LEU CD2 C 13 24.732 0.089 . . . . . A 44 LEU CD2 . 19600 1
464 . 1 1 44 44 LEU N N 15 119.135 0.047 . . . . . A 44 LEU N . 19600 1
465 . 1 1 45 45 GLN H H 1 8.107 0.003 . . . . . A 45 GLN H . 19600 1
466 . 1 1 45 45 GLN HA H 1 4.065 0.007 . . . . . A 45 GLN HA . 19600 1
467 . 1 1 45 45 GLN HB2 H 1 1.739 0.006 . . . . . A 45 GLN HB2 . 19600 1
468 . 1 1 45 45 GLN HB3 H 1 2.107 0.006 . . . . . A 45 GLN HB3 . 19600 1
469 . 1 1 45 45 GLN HG2 H 1 2.319 0.006 . . . . . A 45 GLN HG2 . 19600 1
470 . 1 1 45 45 GLN HG3 H 1 2.320 0.005 . . . . . A 45 GLN HG3 . 19600 1
471 . 1 1 45 45 GLN CA C 13 56.327 0.026 . . . . . A 45 GLN CA . 19600 1
472 . 1 1 45 45 GLN CB C 13 29.802 0.061 . . . . . A 45 GLN CB . 19600 1
473 . 1 1 45 45 GLN CG C 13 34.724 0.063 . . . . . A 45 GLN CG . 19600 1
474 . 1 1 45 45 GLN N N 15 118.784 0.048 . . . . . A 45 GLN N . 19600 1
475 . 1 1 46 46 GLU H H 1 9.097 0.004 . . . . . A 46 GLU H . 19600 1
476 . 1 1 46 46 GLU HA H 1 3.543 0.008 . . . . . A 46 GLU HA . 19600 1
477 . 1 1 46 46 GLU HB2 H 1 1.976 0.004 . . . . . A 46 GLU HB2 . 19600 1
478 . 1 1 46 46 GLU HB3 H 1 1.749 0.006 . . . . . A 46 GLU HB3 . 19600 1
479 . 1 1 46 46 GLU CA C 13 61.163 0.072 . . . . . A 46 GLU CA . 19600 1
480 . 1 1 46 46 GLU CB C 13 28.636 0.041 . . . . . A 46 GLU CB . 19600 1
481 . 1 1 46 46 GLU N N 15 125.074 0.035 . . . . . A 46 GLU N . 19600 1
482 . 1 1 47 47 SER H H 1 8.533 0.004 . . . . . A 47 SER H . 19600 1
483 . 1 1 47 47 SER HA H 1 3.828 0.027 . . . . . A 47 SER HA . 19600 1
484 . 1 1 47 47 SER HB2 H 1 3.732 0.011 . . . . . A 47 SER HB2 . 19600 1
485 . 1 1 47 47 SER HB3 H 1 3.732 0.011 . . . . . A 47 SER HB3 . 19600 1
486 . 1 1 47 47 SER CA C 13 61.464 0.087 . . . . . A 47 SER CA . 19600 1
487 . 1 1 47 47 SER CB C 13 61.867 0.000 . . . . . A 47 SER CB . 19600 1
488 . 1 1 47 47 SER N N 15 113.706 0.038 . . . . . A 47 SER N . 19600 1
489 . 1 1 48 48 ARG H H 1 7.153 0.010 . . . . . A 48 ARG H . 19600 1
490 . 1 1 48 48 ARG HA H 1 4.048 0.005 . . . . . A 48 ARG HA . 19600 1
491 . 1 1 48 48 ARG HB2 H 1 2.053 0.008 . . . . . A 48 ARG HB2 . 19600 1
492 . 1 1 48 48 ARG HB3 H 1 1.926 0.007 . . . . . A 48 ARG HB3 . 19600 1
493 . 1 1 48 48 ARG HG2 H 1 1.725 0.005 . . . . . A 48 ARG HG2 . 19600 1
494 . 1 1 48 48 ARG HG3 H 1 1.574 0.004 . . . . . A 48 ARG HG3 . 19600 1
495 . 1 1 48 48 ARG HD2 H 1 3.098 0.013 . . . . . A 48 ARG HD2 . 19600 1
496 . 1 1 48 48 ARG HD3 H 1 3.098 0.013 . . . . . A 48 ARG HD3 . 19600 1
497 . 1 1 48 48 ARG CA C 13 58.156 0.070 . . . . . A 48 ARG CA . 19600 1
498 . 1 1 48 48 ARG CB C 13 29.475 0.017 . . . . . A 48 ARG CB . 19600 1
499 . 1 1 48 48 ARG CG C 13 27.330 0.000 . . . . . A 48 ARG CG . 19600 1
500 . 1 1 48 48 ARG CD C 13 43.581 0.061 . . . . . A 48 ARG CD . 19600 1
501 . 1 1 48 48 ARG N N 15 121.795 0.026 . . . . . A 48 ARG N . 19600 1
502 . 1 1 49 49 ILE H H 1 7.613 0.009 . . . . . A 49 ILE H . 19600 1
503 . 1 1 49 49 ILE HA H 1 3.635 0.007 . . . . . A 49 ILE HA . 19600 1
504 . 1 1 49 49 ILE HB H 1 2.221 0.006 . . . . . A 49 ILE HB . 19600 1
505 . 1 1 49 49 ILE HG12 H 1 1.151 0.009 . . . . . A 49 ILE HG12 . 19600 1
506 . 1 1 49 49 ILE HG13 H 1 1.361 0.007 . . . . . A 49 ILE HG13 . 19600 1
507 . 1 1 49 49 ILE HG21 H 1 0.789 0.008 . . . . . A 49 ILE HG21 . 19600 1
508 . 1 1 49 49 ILE HG22 H 1 0.789 0.008 . . . . . A 49 ILE HG22 . 19600 1
509 . 1 1 49 49 ILE HG23 H 1 0.789 0.008 . . . . . A 49 ILE HG23 . 19600 1
510 . 1 1 49 49 ILE HD11 H 1 0.561 0.007 . . . . . A 49 ILE HD11 . 19600 1
511 . 1 1 49 49 ILE HD12 H 1 0.561 0.007 . . . . . A 49 ILE HD12 . 19600 1
512 . 1 1 49 49 ILE HD13 H 1 0.561 0.007 . . . . . A 49 ILE HD13 . 19600 1
513 . 1 1 49 49 ILE CA C 13 64.513 0.107 . . . . . A 49 ILE CA . 19600 1
514 . 1 1 49 49 ILE CB C 13 36.823 0.104 . . . . . A 49 ILE CB . 19600 1
515 . 1 1 49 49 ILE CG1 C 13 27.460 0.000 . . . . . A 49 ILE CG1 . 19600 1
516 . 1 1 49 49 ILE CG2 C 13 18.468 0.121 . . . . . A 49 ILE CG2 . 19600 1
517 . 1 1 49 49 ILE CD1 C 13 12.838 0.094 . . . . . A 49 ILE CD1 . 19600 1
518 . 1 1 49 49 ILE N N 15 121.647 0.050 . . . . . A 49 ILE N . 19600 1
519 . 1 1 50 50 GLN H H 1 8.051 0.006 . . . . . A 50 GLN H . 19600 1
520 . 1 1 50 50 GLN HA H 1 4.133 0.006 . . . . . A 50 GLN HA . 19600 1
521 . 1 1 50 50 GLN HB2 H 1 2.003 0.005 . . . . . A 50 GLN HB2 . 19600 1
522 . 1 1 50 50 GLN HB3 H 1 2.003 0.005 . . . . . A 50 GLN HB3 . 19600 1
523 . 1 1 50 50 GLN HG2 H 1 2.302 0.009 . . . . . A 50 GLN HG2 . 19600 1
524 . 1 1 50 50 GLN HG3 H 1 2.302 0.009 . . . . . A 50 GLN HG3 . 19600 1
525 . 1 1 50 50 GLN CA C 13 60.473 0.114 . . . . . A 50 GLN CA . 19600 1
526 . 1 1 50 50 GLN CB C 13 29.032 0.113 . . . . . A 50 GLN CB . 19600 1
527 . 1 1 50 50 GLN CG C 13 34.216 0.116 . . . . . A 50 GLN CG . 19600 1
528 . 1 1 50 50 GLN N N 15 118.579 0.055 . . . . . A 50 GLN N . 19600 1
529 . 1 1 51 51 VAL H H 1 7.372 0.010 . . . . . A 51 VAL H . 19600 1
530 . 1 1 51 51 VAL HA H 1 3.443 0.006 . . . . . A 51 VAL HA . 19600 1
531 . 1 1 51 51 VAL HB H 1 2.038 0.007 . . . . . A 51 VAL HB . 19600 1
532 . 1 1 51 51 VAL HG11 H 1 0.943 0.028 . . . . . A 51 VAL HG11 . 19600 1
533 . 1 1 51 51 VAL HG12 H 1 0.943 0.028 . . . . . A 51 VAL HG12 . 19600 1
534 . 1 1 51 51 VAL HG13 H 1 0.943 0.028 . . . . . A 51 VAL HG13 . 19600 1
535 . 1 1 51 51 VAL HG21 H 1 0.827 0.011 . . . . . A 51 VAL HG21 . 19600 1
536 . 1 1 51 51 VAL HG22 H 1 0.827 0.011 . . . . . A 51 VAL HG22 . 19600 1
537 . 1 1 51 51 VAL HG23 H 1 0.827 0.011 . . . . . A 51 VAL HG23 . 19600 1
538 . 1 1 51 51 VAL CA C 13 67.087 0.069 . . . . . A 51 VAL CA . 19600 1
539 . 1 1 51 51 VAL CB C 13 32.278 0.124 . . . . . A 51 VAL CB . 19600 1
540 . 1 1 51 51 VAL CG1 C 13 23.280 0.119 . . . . . A 51 VAL CG1 . 19600 1
541 . 1 1 51 51 VAL CG2 C 13 21.764 0.079 . . . . . A 51 VAL CG2 . 19600 1
542 . 1 1 51 51 VAL N N 15 120.580 0.039 . . . . . A 51 VAL N . 19600 1
543 . 1 1 52 52 TRP H H 1 8.135 0.005 . . . . . A 52 TRP H . 19600 1
544 . 1 1 52 52 TRP HA H 1 3.774 0.008 . . . . . A 52 TRP HA . 19600 1
545 . 1 1 52 52 TRP HB2 H 1 3.203 0.004 . . . . . A 52 TRP HB2 . 19600 1
546 . 1 1 52 52 TRP HB3 H 1 3.112 0.005 . . . . . A 52 TRP HB3 . 19600 1
547 . 1 1 52 52 TRP CA C 13 63.502 0.069 . . . . . A 52 TRP CA . 19600 1
548 . 1 1 52 52 TRP CB C 13 28.388 0.099 . . . . . A 52 TRP CB . 19600 1
549 . 1 1 52 52 TRP N N 15 121.485 0.064 . . . . . A 52 TRP N . 19600 1
550 . 1 1 53 53 PHE H H 1 8.764 0.005 . . . . . A 53 PHE H . 19600 1
551 . 1 1 53 53 PHE HA H 1 3.421 0.007 . . . . . A 53 PHE HA . 19600 1
552 . 1 1 53 53 PHE HB2 H 1 3.141 0.004 . . . . . A 53 PHE HB2 . 19600 1
553 . 1 1 53 53 PHE HB3 H 1 2.993 0.005 . . . . . A 53 PHE HB3 . 19600 1
554 . 1 1 53 53 PHE CA C 13 63.987 0.054 . . . . . A 53 PHE CA . 19600 1
555 . 1 1 53 53 PHE CB C 13 39.352 0.096 . . . . . A 53 PHE CB . 19600 1
556 . 1 1 53 53 PHE N N 15 118.122 0.028 . . . . . A 53 PHE N . 19600 1
557 . 1 1 54 54 LYS H H 1 7.947 0.006 . . . . . A 54 LYS H . 19600 1
558 . 1 1 54 54 LYS HA H 1 3.715 0.003 . . . . . A 54 LYS HA . 19600 1
559 . 1 1 54 54 LYS HB2 H 1 1.805 0.006 . . . . . A 54 LYS HB2 . 19600 1
560 . 1 1 54 54 LYS HB3 H 1 1.731 0.006 . . . . . A 54 LYS HB3 . 19600 1
561 . 1 1 54 54 LYS HG2 H 1 1.395 0.007 . . . . . A 54 LYS HG2 . 19600 1
562 . 1 1 54 54 LYS HG3 H 1 1.399 0.004 . . . . . A 54 LYS HG3 . 19600 1
563 . 1 1 54 54 LYS HD2 H 1 1.497 0.003 . . . . . A 54 LYS HD2 . 19600 1
564 . 1 1 54 54 LYS HD3 H 1 1.494 0.002 . . . . . A 54 LYS HD3 . 19600 1
565 . 1 1 54 54 LYS CA C 13 60.677 0.065 . . . . . A 54 LYS CA . 19600 1
566 . 1 1 54 54 LYS CB C 13 32.191 0.066 . . . . . A 54 LYS CB . 19600 1
567 . 1 1 54 54 LYS CG C 13 25.477 0.070 . . . . . A 54 LYS CG . 19600 1
568 . 1 1 54 54 LYS CD C 13 29.920 0.048 . . . . . A 54 LYS CD . 19600 1
569 . 1 1 54 54 LYS N N 15 120.838 0.026 . . . . . A 54 LYS N . 19600 1
570 . 1 1 55 55 ASN H H 1 7.953 0.005 . . . . . A 55 ASN H . 19600 1
571 . 1 1 55 55 ASN HA H 1 4.121 0.004 . . . . . A 55 ASN HA . 19600 1
572 . 1 1 55 55 ASN HB2 H 1 2.427 0.005 . . . . . A 55 ASN HB2 . 19600 1
573 . 1 1 55 55 ASN HB3 H 1 2.233 0.008 . . . . . A 55 ASN HB3 . 19600 1
574 . 1 1 55 55 ASN HD22 H 1 7.947 0.007 . . . . . A 55 ASN HD22 . 19600 1
575 . 1 1 55 55 ASN CA C 13 55.695 0.109 . . . . . A 55 ASN CA . 19600 1
576 . 1 1 55 55 ASN CB C 13 37.740 0.105 . . . . . A 55 ASN CB . 19600 1
577 . 1 1 55 55 ASN N N 15 118.986 0.044 . . . . . A 55 ASN N . 19600 1
578 . 1 1 56 56 ARG H H 1 8.263 0.006 . . . . . A 56 ARG H . 19600 1
579 . 1 1 56 56 ARG HA H 1 3.282 0.005 . . . . . A 56 ARG HA . 19600 1
580 . 1 1 56 56 ARG HB2 H 1 1.705 0.003 . . . . . A 56 ARG HB2 . 19600 1
581 . 1 1 56 56 ARG HB3 H 1 1.523 0.008 . . . . . A 56 ARG HB3 . 19600 1
582 . 1 1 56 56 ARG HG3 H 1 1.386 0.008 . . . . . A 56 ARG HG3 . 19600 1
583 . 1 1 56 56 ARG HD2 H 1 3.008 0.004 . . . . . A 56 ARG HD2 . 19600 1
584 . 1 1 56 56 ARG CA C 13 56.848 0.128 . . . . . A 56 ARG CA . 19600 1
585 . 1 1 56 56 ARG CB C 13 27.672 0.077 . . . . . A 56 ARG CB . 19600 1
586 . 1 1 56 56 ARG CD C 13 43.552 0.000 . . . . . A 56 ARG CD . 19600 1
587 . 1 1 56 56 ARG N N 15 124.991 0.036 . . . . . A 56 ARG N . 19600 1
588 . 1 1 57 57 ARG H H 1 8.343 0.004 . . . . . A 57 ARG H . 19600 1
589 . 1 1 57 57 ARG HA H 1 3.789 0.008 . . . . . A 57 ARG HA . 19600 1
590 . 1 1 57 57 ARG HB2 H 1 1.597 0.009 . . . . . A 57 ARG HB2 . 19600 1
591 . 1 1 57 57 ARG HB3 H 1 1.921 0.002 . . . . . A 57 ARG HB3 . 19600 1
592 . 1 1 57 57 ARG CA C 13 61.179 0.064 . . . . . A 57 ARG CA . 19600 1
593 . 1 1 57 57 ARG CB C 13 31.525 0.028 . . . . . A 57 ARG CB . 19600 1
594 . 1 1 57 57 ARG N N 15 120.173 0.029 . . . . . A 57 ARG N . 19600 1
595 . 1 1 58 58 ALA H H 1 7.179 0.009 . . . . . A 58 ALA H . 19600 1
596 . 1 1 58 58 ALA HA H 1 3.911 0.004 . . . . . A 58 ALA HA . 19600 1
597 . 1 1 58 58 ALA HB1 H 1 1.275 0.006 . . . . . A 58 ALA HB1 . 19600 1
598 . 1 1 58 58 ALA HB2 H 1 1.275 0.006 . . . . . A 58 ALA HB2 . 19600 1
599 . 1 1 58 58 ALA HB3 H 1 1.275 0.006 . . . . . A 58 ALA HB3 . 19600 1
600 . 1 1 58 58 ALA CA C 13 55.341 0.050 . . . . . A 58 ALA CA . 19600 1
601 . 1 1 58 58 ALA CB C 13 17.776 0.194 . . . . . A 58 ALA CB . 19600 1
602 . 1 1 58 58 ALA N N 15 121.602 0.043 . . . . . A 58 ALA N . 19600 1
603 . 1 1 59 59 LYS H H 1 7.463 0.004 . . . . . A 59 LYS H . 19600 1
604 . 1 1 59 59 LYS HA H 1 3.730 0.005 . . . . . A 59 LYS HA . 19600 1
605 . 1 1 59 59 LYS HB2 H 1 1.491 0.004 . . . . . A 59 LYS HB2 . 19600 1
606 . 1 1 59 59 LYS HB3 H 1 1.807 0.005 . . . . . A 59 LYS HB3 . 19600 1
607 . 1 1 59 59 LYS HD2 H 1 1.753 0.006 . . . . . A 59 LYS HD2 . 19600 1
608 . 1 1 59 59 LYS CA C 13 59.325 0.078 . . . . . A 59 LYS CA . 19600 1
609 . 1 1 59 59 LYS CB C 13 32.573 0.068 . . . . . A 59 LYS CB . 19600 1
610 . 1 1 59 59 LYS CD C 13 29.633 0.061 . . . . . A 59 LYS CD . 19600 1
611 . 1 1 59 59 LYS N N 15 119.515 0.038 . . . . . A 59 LYS N . 19600 1
612 . 1 1 60 60 TYR H H 1 7.874 0.005 . . . . . A 60 TYR H . 19600 1
613 . 1 1 60 60 TYR HA H 1 4.160 0.005 . . . . . A 60 TYR HA . 19600 1
614 . 1 1 60 60 TYR HB2 H 1 2.885 0.079 . . . . . A 60 TYR HB2 . 19600 1
615 . 1 1 60 60 TYR HB3 H 1 3.181 0.005 . . . . . A 60 TYR HB3 . 19600 1
616 . 1 1 60 60 TYR HD1 H 1 7.023 0.014 . . . . . A 60 TYR HD1 . 19600 1
617 . 1 1 60 60 TYR HD2 H 1 7.023 0.014 . . . . . A 60 TYR HD2 . 19600 1
618 . 1 1 60 60 TYR CA C 13 61.014 0.141 . . . . . A 60 TYR CA . 19600 1
619 . 1 1 60 60 TYR CB C 13 38.810 0.147 . . . . . A 60 TYR CB . 19600 1
620 . 1 1 60 60 TYR N N 15 120.152 0.034 . . . . . A 60 TYR N . 19600 1
621 . 1 1 61 61 ARG H H 1 7.943 0.005 . . . . . A 61 ARG H . 19600 1
622 . 1 1 61 61 ARG HA H 1 3.831 0.006 . . . . . A 61 ARG HA . 19600 1
623 . 1 1 61 61 ARG HB2 H 1 1.728 0.005 . . . . . A 61 ARG HB2 . 19600 1
624 . 1 1 61 61 ARG HB3 H 1 1.728 0.005 . . . . . A 61 ARG HB3 . 19600 1
625 . 1 1 61 61 ARG CA C 13 59.199 0.152 . . . . . A 61 ARG CA . 19600 1
626 . 1 1 61 61 ARG CB C 13 30.310 0.072 . . . . . A 61 ARG CB . 19600 1
627 . 1 1 61 61 ARG N N 15 118.122 0.064 . . . . . A 61 ARG N . 19600 1
628 . 1 1 62 62 LEU H H 1 7.407 0.006 . . . . . A 62 LEU H . 19600 1
629 . 1 1 62 62 LEU HA H 1 3.930 0.005 . . . . . A 62 LEU HA . 19600 1
630 . 1 1 62 62 LEU HB2 H 1 1.519 0.005 . . . . . A 62 LEU HB2 . 19600 1
631 . 1 1 62 62 LEU HB3 H 1 1.418 0.004 . . . . . A 62 LEU HB3 . 19600 1
632 . 1 1 62 62 LEU HG H 1 1.335 0.004 . . . . . A 62 LEU HG . 19600 1
633 . 1 1 62 62 LEU HD11 H 1 0.639 0.004 . . . . . A 62 LEU HD11 . 19600 1
634 . 1 1 62 62 LEU HD12 H 1 0.639 0.004 . . . . . A 62 LEU HD12 . 19600 1
635 . 1 1 62 62 LEU HD13 H 1 0.639 0.004 . . . . . A 62 LEU HD13 . 19600 1
636 . 1 1 62 62 LEU HD21 H 1 0.616 0.004 . . . . . A 62 LEU HD21 . 19600 1
637 . 1 1 62 62 LEU HD22 H 1 0.616 0.004 . . . . . A 62 LEU HD22 . 19600 1
638 . 1 1 62 62 LEU HD23 H 1 0.616 0.004 . . . . . A 62 LEU HD23 . 19600 1
639 . 1 1 62 62 LEU CA C 13 57.121 0.111 . . . . . A 62 LEU CA . 19600 1
640 . 1 1 62 62 LEU CB C 13 42.109 0.070 . . . . . A 62 LEU CB . 19600 1
641 . 1 1 62 62 LEU CG C 13 26.932 0.000 . . . . . A 62 LEU CG . 19600 1
642 . 1 1 62 62 LEU CD1 C 13 24.369 0.000 . . . . . A 62 LEU CD1 . 19600 1
643 . 1 1 62 62 LEU CD2 C 13 23.320 0.000 . . . . . A 62 LEU CD2 . 19600 1
644 . 1 1 62 62 LEU N N 15 119.191 0.046 . . . . . A 62 LEU N . 19600 1
645 . 1 1 63 63 GLN H H 1 7.676 0.006 . . . . . A 63 GLN H . 19600 1
646 . 1 1 63 63 GLN HA H 1 3.873 0.006 . . . . . A 63 GLN HA . 19600 1
647 . 1 1 63 63 GLN HB2 H 1 1.800 0.007 . . . . . A 63 GLN HB2 . 19600 1
648 . 1 1 63 63 GLN HB3 H 1 1.800 0.007 . . . . . A 63 GLN HB3 . 19600 1
649 . 1 1 63 63 GLN HG2 H 1 2.197 0.010 . . . . . A 63 GLN HG2 . 19600 1
650 . 1 1 63 63 GLN HG3 H 1 2.072 0.004 . . . . . A 63 GLN HG3 . 19600 1
651 . 1 1 63 63 GLN CA C 13 57.338 0.115 . . . . . A 63 GLN CA . 19600 1
652 . 1 1 63 63 GLN CB C 13 28.871 0.078 . . . . . A 63 GLN CB . 19600 1
653 . 1 1 63 63 GLN CG C 13 34.226 0.046 . . . . . A 63 GLN CG . 19600 1
654 . 1 1 63 63 GLN N N 15 118.201 0.040 . . . . . A 63 GLN N . 19600 1
655 . 1 1 64 64 GLU H H 1 7.808 0.008 . . . . . A 64 GLU H . 19600 1
656 . 1 1 64 64 GLU HA H 1 3.800 0.005 . . . . . A 64 GLU HA . 19600 1
657 . 1 1 64 64 GLU HB2 H 1 1.715 0.004 . . . . . A 64 GLU HB2 . 19600 1
658 . 1 1 64 64 GLU HB3 H 1 1.596 0.005 . . . . . A 64 GLU HB3 . 19600 1
659 . 1 1 64 64 GLU CA C 13 57.503 0.121 . . . . . A 64 GLU CA . 19600 1
660 . 1 1 64 64 GLU CB C 13 30.187 0.231 . . . . . A 64 GLU CB . 19600 1
661 . 1 1 64 64 GLU N N 15 120.152 0.056 . . . . . A 64 GLU N . 19600 1
662 . 1 1 65 65 LYS H H 1 7.695 0.004 . . . . . A 65 LYS H . 19600 1
663 . 1 1 65 65 LYS HA H 1 3.986 0.005 . . . . . A 65 LYS HA . 19600 1
664 . 1 1 65 65 LYS HB2 H 1 1.988 0.005 . . . . . A 65 LYS HB2 . 19600 1
665 . 1 1 65 65 LYS HB3 H 1 1.637 0.005 . . . . . A 65 LYS HB3 . 19600 1
666 . 1 1 65 65 LYS HG2 H 1 1.214 0.007 . . . . . A 65 LYS HG2 . 19600 1
667 . 1 1 65 65 LYS HD2 H 1 1.684 0.108 . . . . . A 65 LYS HD2 . 19600 1
668 . 1 1 65 65 LYS CA C 13 56.871 0.074 . . . . . A 65 LYS CA . 19600 1
669 . 1 1 65 65 LYS CB C 13 32.473 0.135 . . . . . A 65 LYS CB . 19600 1
670 . 1 1 65 65 LYS CG C 13 24.961 0.070 . . . . . A 65 LYS CG . 19600 1
671 . 1 1 65 65 LYS N N 15 120.364 0.034 . . . . . A 65 LYS N . 19600 1
672 . 1 1 66 66 GLN H H 1 7.906 0.008 . . . . . A 66 GLN H . 19600 1
673 . 1 1 66 66 GLN HA H 1 4.028 0.005 . . . . . A 66 GLN HA . 19600 1
674 . 1 1 66 66 GLN HB2 H 1 1.847 0.003 . . . . . A 66 GLN HB2 . 19600 1
675 . 1 1 66 66 GLN HB3 H 1 1.733 0.005 . . . . . A 66 GLN HB3 . 19600 1
676 . 1 1 66 66 GLN HG2 H 1 2.131 0.007 . . . . . A 66 GLN HG2 . 19600 1
677 . 1 1 66 66 GLN HG3 H 1 2.133 0.007 . . . . . A 66 GLN HG3 . 19600 1
678 . 1 1 66 66 GLN CA C 13 55.796 0.091 . . . . . A 66 GLN CA . 19600 1
679 . 1 1 66 66 GLN CB C 13 29.299 0.013 . . . . . A 66 GLN CB . 19600 1
680 . 1 1 66 66 GLN CG C 13 34.114 0.128 . . . . . A 66 GLN CG . 19600 1
681 . 1 1 66 66 GLN N N 15 120.265 0.066 . . . . . A 66 GLN N . 19600 1
682 . 1 1 67 67 LYS H H 1 7.963 0.003 . . . . . A 67 LYS H . 19600 1
683 . 1 1 67 67 LYS HA H 1 4.316 0.004 . . . . . A 67 LYS HA . 19600 1
684 . 1 1 67 67 LYS HB2 H 1 1.618 0.004 . . . . . A 67 LYS HB2 . 19600 1
685 . 1 1 67 67 LYS HB3 H 1 1.511 0.003 . . . . . A 67 LYS HB3 . 19600 1
686 . 1 1 67 67 LYS HG2 H 1 1.271 0.002 . . . . . A 67 LYS HG2 . 19600 1
687 . 1 1 67 67 LYS HG3 H 1 1.229 0.003 . . . . . A 67 LYS HG3 . 19600 1
688 . 1 1 67 67 LYS HD2 H 1 1.471 0.006 . . . . . A 67 LYS HD2 . 19600 1
689 . 1 1 67 67 LYS HD3 H 1 1.438 0.038 . . . . . A 67 LYS HD3 . 19600 1
690 . 1 1 67 67 LYS CA C 13 54.596 0.087 . . . . . A 67 LYS CA . 19600 1
691 . 1 1 67 67 LYS CB C 13 32.457 0.064 . . . . . A 67 LYS CB . 19600 1
692 . 1 1 67 67 LYS CG C 13 24.747 0.000 . . . . . A 67 LYS CG . 19600 1
693 . 1 1 67 67 LYS CD C 13 29.434 0.095 . . . . . A 67 LYS CD . 19600 1
694 . 1 1 67 67 LYS N N 15 124.357 0.026 . . . . . A 67 LYS N . 19600 1
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