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 16450
_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' . . . 16450 1
2 '3D CBCA(CO)NH' . . . 16450 1
3 '3D HNCACB' . . . 16450 1
4 '3D HNCO' . . . 16450 1
5 '3D HNCACO' . . . 16450 1
6 '3D 1H-15N TOCSY' . . . 16450 1
7 '3D HCCH-TOCSY' . . . 16450 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 ALA H H 1 8.032 0.007 . 1 . . . . 2 Ala H . 16450 1
2 . 1 1 2 2 ALA HA H 1 4.247 0.006 . 1 . . . . 2 Ala HA . 16450 1
3 . 1 1 2 2 ALA HB1 H 1 1.244 0.002 . 1 . . . . 2 Ala HB1 . 16450 1
4 . 1 1 2 2 ALA HB2 H 1 1.244 0.002 . 1 . . . . 2 Ala HB2 . 16450 1
5 . 1 1 2 2 ALA HB3 H 1 1.244 0.002 . 1 . . . . 2 Ala HB3 . 16450 1
6 . 1 1 2 2 ALA C C 13 171.096 0.000 . 1 . . . . 2 Ala C . 16450 1
7 . 1 1 2 2 ALA CA C 13 52.648 0.000 . 1 . . . . 2 Ala CA . 16450 1
8 . 1 1 2 2 ALA CB C 13 18.913 0.000 . 1 . . . . 2 Ala CB . 16450 1
9 . 1 1 2 2 ALA N N 15 123.143 0.083 . 1 . . . . 2 Ala N . 16450 1
10 . 1 1 7 7 PRO C C 13 177.384 0.000 . 1 . . . . 7 Pro C . 16450 1
11 . 1 1 8 8 CYS H H 1 8.525 0.003 . 1 . . . . 8 Cys H . 16450 1
12 . 1 1 8 8 CYS HA H 1 4.669 0.013 . 1 . . . . 8 Cys HA . 16450 1
13 . 1 1 8 8 CYS HB2 H 1 3.026 0.005 . 2 . . . . 8 Cys HB2 . 16450 1
14 . 1 1 8 8 CYS HB3 H 1 3.250 0.002 . 2 . . . . 8 Cys HB3 . 16450 1
15 . 1 1 8 8 CYS C C 13 174.709 0.005 . 1 . . . . 8 Cys C . 16450 1
16 . 1 1 8 8 CYS CA C 13 55.000 0.010 . 1 . . . . 8 Cys CA . 16450 1
17 . 1 1 8 8 CYS CB C 13 39.891 0.000 . 1 . . . . 8 Cys CB . 16450 1
18 . 1 1 8 8 CYS N N 15 117.155 0.067 . 1 . . . . 8 Cys N . 16450 1
19 . 1 1 9 9 ALA H H 1 7.881 0.015 . 1 . . . . 9 Ala H . 16450 1
20 . 1 1 9 9 ALA HA H 1 4.298 0.009 . 1 . . . . 9 Ala HA . 16450 1
21 . 1 1 9 9 ALA HB1 H 1 1.405 0.004 . 1 . . . . 9 Ala HB1 . 16450 1
22 . 1 1 9 9 ALA HB2 H 1 1.405 0.004 . 1 . . . . 9 Ala HB2 . 16450 1
23 . 1 1 9 9 ALA HB3 H 1 1.405 0.004 . 1 . . . . 9 Ala HB3 . 16450 1
24 . 1 1 9 9 ALA C C 13 176.911 0.011 . 1 . . . . 9 Ala C . 16450 1
25 . 1 1 9 9 ALA CA C 13 52.662 0.019 . 1 . . . . 9 Ala CA . 16450 1
26 . 1 1 9 9 ALA CB C 13 19.272 0.042 . 1 . . . . 9 Ala CB . 16450 1
27 . 1 1 9 9 ALA N N 15 124.413 0.079 . 1 . . . . 9 Ala N . 16450 1
28 . 1 1 10 10 ASN H H 1 8.211 0.002 . 1 . . . . 10 Asn H . 16450 1
29 . 1 1 10 10 ASN HA H 1 4.945 0.001 . 1 . . . . 10 Asn HA . 16450 1
30 . 1 1 10 10 ASN HB2 H 1 2.762 0.002 . 1 . . . . 10 Asn HB2 . 16450 1
31 . 1 1 10 10 ASN HB3 H 1 2.762 0.002 . 1 . . . . 10 Asn HB3 . 16450 1
32 . 1 1 10 10 ASN C C 13 173.431 0.000 . 1 . . . . 10 Asn C . 16450 1
33 . 1 1 10 10 ASN CA C 13 51.447 0.000 . 1 . . . . 10 Asn CA . 16450 1
34 . 1 1 10 10 ASN CB C 13 39.011 0.000 . 1 . . . . 10 Asn CB . 16450 1
35 . 1 1 10 10 ASN N N 15 118.392 0.054 . 1 . . . . 10 Asn N . 16450 1
36 . 1 1 11 11 PRO HA H 1 4.520 0.019 . 1 . . . . 11 Pro HA . 16450 1
37 . 1 1 11 11 PRO HB2 H 1 2.301 0.001 . 1 . . . . 11 Pro HB2 . 16450 1
38 . 1 1 11 11 PRO HB3 H 1 2.301 0.001 . 1 . . . . 11 Pro HB3 . 16450 1
39 . 1 1 11 11 PRO HD2 H 1 3.876 0.007 . 1 . . . . 11 Pro HD2 . 16450 1
40 . 1 1 11 11 PRO HD3 H 1 3.875 0.007 . 1 . . . . 11 Pro HD3 . 16450 1
41 . 1 1 11 11 PRO HG2 H 1 2.003 0.002 . 1 . . . . 11 Pro HG2 . 16450 1
42 . 1 1 11 11 PRO HG3 H 1 2.005 0.000 . 1 . . . . 11 Pro HG3 . 16450 1
43 . 1 1 11 11 PRO C C 13 177.337 0.000 . 1 . . . . 11 Pro C . 16450 1
44 . 1 1 11 11 PRO CA C 13 63.847 0.064 . 1 . . . . 11 Pro CA . 16450 1
45 . 1 1 11 11 PRO CB C 13 32.161 0.006 . 1 . . . . 11 Pro CB . 16450 1
46 . 1 1 11 11 PRO CD C 13 50.273 0.000 . 1 . . . . 11 Pro CD . 16450 1
47 . 1 1 12 12 THR H H 1 8.200 0.003 . 1 . . . . 12 Thr H . 16450 1
48 . 1 1 12 12 THR HA H 1 4.377 0.002 . 1 . . . . 12 Thr HA . 16450 1
49 . 1 1 12 12 THR HB H 1 4.236 0.012 . 1 . . . . 12 Thr HB . 16450 1
50 . 1 1 12 12 THR HG21 H 1 1.220 0.007 . 1 . . . . 12 Thr HG21 . 16450 1
51 . 1 1 12 12 THR HG22 H 1 1.220 0.007 . 1 . . . . 12 Thr HG22 . 16450 1
52 . 1 1 12 12 THR HG23 H 1 1.220 0.007 . 1 . . . . 12 Thr HG23 . 16450 1
53 . 1 1 12 12 THR C C 13 174.686 0.005 . 1 . . . . 12 Thr C . 16450 1
54 . 1 1 12 12 THR CA C 13 62.383 0.000 . 1 . . . . 12 Thr CA . 16450 1
55 . 1 1 12 12 THR CB C 13 69.739 0.014 . 1 . . . . 12 Thr CB . 16450 1
56 . 1 1 12 12 THR CG2 C 13 21.516 0.000 . 1 . . . . 12 Thr CG2 . 16450 1
57 . 1 1 12 12 THR N N 15 113.650 0.052 . 1 . . . . 12 Thr N . 16450 1
58 . 1 1 13 13 ARG H H 1 8.163 0.003 . 1 . . . . 13 Arg H . 16450 1
59 . 1 1 13 13 ARG HA H 1 4.135 0.002 . 1 . . . . 13 Arg HA . 16450 1
60 . 1 1 13 13 ARG HB2 H 1 1.847 0.002 . 1 . . . . 13 Arg HB2 . 16450 1
61 . 1 1 13 13 ARG HB3 H 1 1.847 0.002 . 1 . . . . 13 Arg HB3 . 16450 1
62 . 1 1 13 13 ARG HD2 H 1 3.199 0.003 . 1 . . . . 13 Arg HD2 . 16450 1
63 . 1 1 13 13 ARG HD3 H 1 3.199 0.003 . 1 . . . . 13 Arg HD3 . 16450 1
64 . 1 1 13 13 ARG HG2 H 1 1.766 0.003 . 1 . . . . 13 Arg HG2 . 16450 1
65 . 1 1 13 13 ARG HG3 H 1 1.766 0.003 . 1 . . . . 13 Arg HG3 . 16450 1
66 . 1 1 13 13 ARG C C 13 176.091 0.000 . 1 . . . . 13 Arg C . 16450 1
67 . 1 1 13 13 ARG CA C 13 56.290 0.000 . 1 . . . . 13 Arg CA . 16450 1
68 . 1 1 13 13 ARG CB C 13 30.728 0.000 . 1 . . . . 13 Arg CB . 16450 1
69 . 1 1 13 13 ARG CD C 13 43.516 0.000 . 1 . . . . 13 Arg CD . 16450 1
70 . 1 1 13 13 ARG CG C 13 27.930 0.000 . 1 . . . . 13 Arg CG . 16450 1
71 . 1 1 13 13 ARG N N 15 123.181 0.051 . 1 . . . . 13 Arg N . 16450 1
72 . 1 1 14 14 GLN H H 1 8.421 0.004 . 1 . . . . 14 Gln H . 16450 1
73 . 1 1 14 14 GLN HA H 1 4.411 0.006 . 1 . . . . 14 Gln HA . 16450 1
74 . 1 1 14 14 GLN HB2 H 1 2.034 0.005 . 1 . . . . 14 Gln HB2 . 16450 1
75 . 1 1 14 14 GLN HB3 H 1 2.036 0.002 . 1 . . . . 14 Gln HB3 . 16450 1
76 . 1 1 14 14 GLN HG2 H 1 2.320 0.006 . 1 . . . . 14 Gln HG2 . 16450 1
77 . 1 1 14 14 GLN HG3 H 1 2.320 0.006 . 1 . . . . 14 Gln HG3 . 16450 1
78 . 1 1 14 14 GLN C C 13 177.016 0.000 . 1 . . . . 14 Gln C . 16450 1
79 . 1 1 14 14 GLN CA C 13 56.227 0.000 . 1 . . . . 14 Gln CA . 16450 1
80 . 1 1 14 14 GLN CB C 13 29.560 0.000 . 1 . . . . 14 Gln CB . 16450 1
81 . 1 1 14 14 GLN CG C 13 32.930 0.000 . 1 . . . . 14 Gln CG . 16450 1
82 . 1 1 14 14 GLN N N 15 119.500 0.000 . 1 . . . . 14 Gln N . 16450 1
83 . 1 1 15 15 THR H H 1 8.234 0.007 . 1 . . . . 15 Thr H . 16450 1
84 . 1 1 15 15 THR HA H 1 4.427 0.008 . 1 . . . . 15 Thr HA . 16450 1
85 . 1 1 15 15 THR HB H 1 4.255 0.004 . 1 . . . . 15 Thr HB . 16450 1
86 . 1 1 15 15 THR HG21 H 1 1.200 0.003 . 1 . . . . 15 Thr HG21 . 16450 1
87 . 1 1 15 15 THR HG22 H 1 1.200 0.003 . 1 . . . . 15 Thr HG22 . 16450 1
88 . 1 1 15 15 THR HG23 H 1 1.200 0.003 . 1 . . . . 15 Thr HG23 . 16450 1
89 . 1 1 15 15 THR C C 13 175.119 0.000 . 1 . . . . 15 Thr C . 16450 1
90 . 1 1 15 15 THR CA C 13 62.202 0.000 . 1 . . . . 15 Thr CA . 16450 1
91 . 1 1 15 15 THR CB C 13 70.670 0.000 . 1 . . . . 15 Thr CB . 16450 1
92 . 1 1 15 15 THR CG2 C 13 21.758 0.000 . 1 . . . . 15 Thr CG2 . 16450 1
93 . 1 1 15 15 THR N N 15 115.095 0.091 . 1 . . . . 15 Thr N . 16450 1
94 . 1 1 16 16 GLY H H 1 8.458 0.005 . 1 . . . . 16 Gly H . 16450 1
95 . 1 1 16 16 GLY HA2 H 1 4.000 0.000 . 1 . . . . 16 Gly HA2 . 16450 1
96 . 1 1 16 16 GLY HA3 H 1 4.000 0.000 . 1 . . . . 16 Gly HA3 . 16450 1
97 . 1 1 16 16 GLY C C 13 174.072 0.000 . 1 . . . . 16 Gly C . 16450 1
98 . 1 1 16 16 GLY CA C 13 45.384 0.000 . 1 . . . . 16 Gly CA . 16450 1
99 . 1 1 16 16 GLY N N 15 111.373 0.002 . 1 . . . . 16 Gly N . 16450 1
100 . 1 1 17 17 LYS H H 1 8.179 0.008 . 1 . . . . 17 Lys H . 16450 1
101 . 1 1 17 17 LYS HA H 1 4.501 0.002 . 1 . . . . 17 Lys HA . 16450 1
102 . 1 1 17 17 LYS HB2 H 1 1.881 0.001 . 1 . . . . 17 Lys HB2 . 16450 1
103 . 1 1 17 17 LYS HB3 H 1 1.881 0.001 . 1 . . . . 17 Lys HB3 . 16450 1
104 . 1 1 17 17 LYS HE2 H 1 2.995 0.002 . 1 . . . . 17 Lys HE2 . 16450 1
105 . 1 1 17 17 LYS HE3 H 1 2.995 0.002 . 1 . . . . 17 Lys HE3 . 16450 1
106 . 1 1 17 17 LYS C C 13 176.831 0.000 . 1 . . . . 17 Lys C . 16450 1
107 . 1 1 17 17 LYS CA C 13 55.922 0.000 . 1 . . . . 17 Lys CA . 16450 1
108 . 1 1 17 17 LYS CB C 13 32.865 0.000 . 1 . . . . 17 Lys CB . 16450 1
109 . 1 1 17 17 LYS N N 15 119.792 0.062 . 1 . . . . 17 Lys N . 16450 1
110 . 1 1 18 18 THR H H 1 8.240 0.006 . 1 . . . . 18 Thr H . 16450 1
111 . 1 1 18 18 THR HA H 1 4.418 0.009 . 1 . . . . 18 Thr HA . 16450 1
112 . 1 1 18 18 THR HB H 1 4.265 0.002 . 1 . . . . 18 Thr HB . 16450 1
113 . 1 1 18 18 THR HG21 H 1 1.212 0.004 . 1 . . . . 18 Thr HG21 . 16450 1
114 . 1 1 18 18 THR HG22 H 1 1.212 0.004 . 1 . . . . 18 Thr HG22 . 16450 1
115 . 1 1 18 18 THR HG23 H 1 1.212 0.004 . 1 . . . . 18 Thr HG23 . 16450 1
116 . 1 1 18 18 THR C C 13 174.585 0.000 . 1 . . . . 18 Thr C . 16450 1
117 . 1 1 18 18 THR CA C 13 62.039 0.000 . 1 . . . . 18 Thr CA . 16450 1
118 . 1 1 18 18 THR CB C 13 70.004 0.000 . 1 . . . . 18 Thr CB . 16450 1
119 . 1 1 18 18 THR CG2 C 13 22.102 0.000 . 1 . . . . 18 Thr CG2 . 16450 1
120 . 1 1 18 18 THR N N 15 115.284 0.138 . 1 . . . . 18 Thr N . 16450 1
121 . 1 1 19 19 GLY H H 1 8.454 0.004 . 1 . . . . 19 Gly H . 16450 1
122 . 1 1 19 19 GLY HA2 H 1 3.999 0.000 . 1 . . . . 19 Gly HA2 . 16450 1
123 . 1 1 19 19 GLY HA3 H 1 3.999 0.000 . 1 . . . . 19 Gly HA3 . 16450 1
124 . 1 1 19 19 GLY C C 13 174.578 0.000 . 1 . . . . 19 Gly C . 16450 1
125 . 1 1 19 19 GLY CA C 13 45.404 0.000 . 1 . . . . 19 Gly CA . 16450 1
126 . 1 1 19 19 GLY N N 15 111.220 0.000 . 1 . . . . 19 Gly N . 16450 1
127 . 1 1 20 20 GLY H H 1 8.305 0.004 . 1 . . . . 20 Gly H . 16450 1
128 . 1 1 20 20 GLY HA2 H 1 3.942 0.000 . 1 . . . . 20 Gly HA2 . 16450 1
129 . 1 1 20 20 GLY HA3 H 1 3.942 0.000 . 1 . . . . 20 Gly HA3 . 16450 1
130 . 1 1 20 20 GLY C C 13 174.105 0.000 . 1 . . . . 20 Gly C . 16450 1
131 . 1 1 20 20 GLY CA C 13 45.252 0.000 . 1 . . . . 20 Gly CA . 16450 1
132 . 1 1 20 20 GLY N N 15 108.822 0.051 . 1 . . . . 20 Gly N . 16450 1
133 . 1 1 21 21 GLN H H 1 8.405 0.002 . 1 . . . . 21 Gln H . 16450 1
134 . 1 1 21 21 GLN HA H 1 4.463 0.016 . 1 . . . . 21 Gln HA . 16450 1
135 . 1 1 21 21 GLN HB2 H 1 2.039 0.010 . 1 . . . . 21 Gln HB2 . 16450 1
136 . 1 1 21 21 GLN HB3 H 1 2.039 0.010 . 1 . . . . 21 Gln HB3 . 16450 1
137 . 1 1 21 21 GLN HG2 H 1 2.335 0.014 . 1 . . . . 21 Gln HG2 . 16450 1
138 . 1 1 21 21 GLN HG3 H 1 2.335 0.014 . 1 . . . . 21 Gln HG3 . 16450 1
139 . 1 1 21 21 GLN C C 13 176.307 0.000 . 1 . . . . 21 Gln C . 16450 1
140 . 1 1 21 21 GLN CA C 13 56.207 0.000 . 1 . . . . 21 Gln CA . 16450 1
141 . 1 1 21 21 GLN CB C 13 29.357 0.000 . 1 . . . . 21 Gln CB . 16450 1
142 . 1 1 21 21 GLN CG C 13 33.516 0.000 . 1 . . . . 21 Gln CG . 16450 1
143 . 1 1 21 21 GLN N N 15 119.500 0.000 . 1 . . . . 21 Gln N . 16450 1
144 . 1 1 22 22 THR H H 1 8.222 0.002 . 1 . . . . 22 Thr H . 16450 1
145 . 1 1 22 22 THR HA H 1 4.762 0.007 . 1 . . . . 22 Thr HA . 16450 1
146 . 1 1 22 22 THR HB H 1 4.090 0.023 . 1 . . . . 22 Thr HB . 16450 1
147 . 1 1 22 22 THR HG21 H 1 1.049 0.010 . 1 . . . . 22 Thr HG21 . 16450 1
148 . 1 1 22 22 THR HG22 H 1 1.049 0.010 . 1 . . . . 22 Thr HG22 . 16450 1
149 . 1 1 22 22 THR HG23 H 1 1.049 0.010 . 1 . . . . 22 Thr HG23 . 16450 1
150 . 1 1 22 22 THR C C 13 174.540 0.006 . 1 . . . . 22 Thr C . 16450 1
151 . 1 1 22 22 THR CA C 13 60.799 0.000 . 1 . . . . 22 Thr CA . 16450 1
152 . 1 1 22 22 THR CB C 13 71.448 0.000 . 1 . . . . 22 Thr CB . 16450 1
153 . 1 1 22 22 THR CG2 C 13 20.930 0.000 . 1 . . . . 22 Thr CG2 . 16450 1
154 . 1 1 22 22 THR N N 15 114.131 0.052 . 1 . . . . 22 Thr N . 16450 1
155 . 1 1 23 23 ASP H H 1 8.586 0.003 . 1 . . . . 23 Asp H . 16450 1
156 . 1 1 23 23 ASP HA H 1 4.654 0.000 . 1 . . . . 23 Asp HA . 16450 1
157 . 1 1 23 23 ASP C C 13 177.589 0.001 . 1 . . . . 23 Asp C . 16450 1
158 . 1 1 23 23 ASP CA C 13 53.350 0.016 . 1 . . . . 23 Asp CA . 16450 1
159 . 1 1 23 23 ASP CB C 13 41.232 0.000 . 1 . . . . 23 Asp CB . 16450 1
160 . 1 1 23 23 ASP N N 15 121.970 0.057 . 1 . . . . 23 Asp N . 16450 1
161 . 1 1 24 24 GLN H H 1 8.545 0.002 . 1 . . . . 24 Gln H . 16450 1
162 . 1 1 24 24 GLN HA H 1 4.135 0.000 . 1 . . . . 24 Gln HA . 16450 1
163 . 1 1 24 24 GLN C C 13 175.733 0.006 . 1 . . . . 24 Gln C . 16450 1
164 . 1 1 24 24 GLN CA C 13 57.218 0.000 . 1 . . . . 24 Gln CA . 16450 1
165 . 1 1 24 24 GLN CB C 13 28.438 0.001 . 1 . . . . 24 Gln CB . 16450 1
166 . 1 1 24 24 GLN N N 15 118.005 0.057 . 1 . . . . 24 Gln N . 16450 1
167 . 1 1 25 25 TYR H H 1 8.122 0.002 . 1 . . . . 25 Tyr H . 16450 1
168 . 1 1 25 25 TYR HA H 1 4.630 0.013 . 1 . . . . 25 Tyr HA . 16450 1
169 . 1 1 25 25 TYR HB2 H 1 2.894 0.003 . 2 . . . . 25 Tyr HB2 . 16450 1
170 . 1 1 25 25 TYR HB3 H 1 3.282 0.003 . 2 . . . . 25 Tyr HB3 . 16450 1
171 . 1 1 25 25 TYR C C 13 176.086 0.004 . 1 . . . . 25 Tyr C . 16450 1
172 . 1 1 25 25 TYR CA C 13 57.609 0.000 . 1 . . . . 25 Tyr CA . 16450 1
173 . 1 1 25 25 TYR CB C 13 38.403 0.016 . 1 . . . . 25 Tyr CB . 16450 1
174 . 1 1 25 25 TYR N N 15 120.074 0.111 . 1 . . . . 25 Tyr N . 16450 1
175 . 1 1 26 26 GLY H H 1 8.054 0.003 . 1 . . . . 26 Gly H . 16450 1
176 . 1 1 26 26 GLY HA2 H 1 3.734 0.000 . 2 . . . . 26 Gly HA2 . 16450 1
177 . 1 1 26 26 GLY HA3 H 1 4.145 0.000 . 2 . . . . 26 Gly HA3 . 16450 1
178 . 1 1 26 26 GLY C C 13 173.817 0.003 . 1 . . . . 26 Gly C . 16450 1
179 . 1 1 26 26 GLY CA C 13 45.162 0.000 . 1 . . . . 26 Gly CA . 16450 1
180 . 1 1 26 26 GLY N N 15 108.362 0.057 . 1 . . . . 26 Gly N . 16450 1
181 . 1 1 27 27 ASN H H 1 8.477 0.006 . 1 . . . . 27 Asn H . 16450 1
182 . 1 1 27 27 ASN HA H 1 5.026 0.001 . 1 . . . . 27 Asn HA . 16450 1
183 . 1 1 27 27 ASN HB2 H 1 2.820 0.008 . 1 . . . . 27 Asn HB2 . 16450 1
184 . 1 1 27 27 ASN HB3 H 1 2.820 0.008 . 1 . . . . 27 Asn HB3 . 16450 1
185 . 1 1 27 27 ASN C C 13 173.193 0.000 . 1 . . . . 27 Asn C . 16450 1
186 . 1 1 27 27 ASN CA C 13 51.402 0.000 . 1 . . . . 27 Asn CA . 16450 1
187 . 1 1 27 27 ASN CB C 13 38.435 0.000 . 1 . . . . 27 Asn CB . 16450 1
188 . 1 1 27 27 ASN N N 15 120.564 0.148 . 1 . . . . 27 Asn N . 16450 1
189 . 1 1 28 28 PRO HA H 1 4.508 0.007 . 1 . . . . 28 Pro HA . 16450 1
190 . 1 1 28 28 PRO HB2 H 1 2.300 0.003 . 1 . . . . 28 Pro HB2 . 16450 1
191 . 1 1 28 28 PRO HB3 H 1 2.300 0.003 . 1 . . . . 28 Pro HB3 . 16450 1
192 . 1 1 28 28 PRO HD2 H 1 3.871 0.003 . 1 . . . . 28 Pro HD2 . 16450 1
193 . 1 1 28 28 PRO HD3 H 1 3.871 0.003 . 1 . . . . 28 Pro HD3 . 16450 1
194 . 1 1 28 28 PRO HG2 H 1 2.019 0.006 . 1 . . . . 28 Pro HG2 . 16450 1
195 . 1 1 28 28 PRO HG3 H 1 2.019 0.006 . 1 . . . . 28 Pro HG3 . 16450 1
196 . 1 1 28 28 PRO C C 13 176.943 0.000 . 1 . . . . 28 Pro C . 16450 1
197 . 1 1 28 28 PRO CA C 13 63.425 0.019 . 1 . . . . 28 Pro CA . 16450 1
198 . 1 1 28 28 PRO CB C 13 32.001 0.000 . 1 . . . . 28 Pro CB . 16450 1
199 . 1 1 28 28 PRO CD C 13 50.273 0.000 . 1 . . . . 28 Pro CD . 16450 1
200 . 1 1 28 28 PRO CG C 13 27.687 0.000 . 1 . . . . 28 Pro CG . 16450 1
201 . 1 1 29 29 VAL H H 1 7.979 0.003 . 1 . . . . 29 Val H . 16450 1
202 . 1 1 29 29 VAL HA H 1 4.065 0.004 . 1 . . . . 29 Val HA . 16450 1
203 . 1 1 29 29 VAL HB H 1 1.920 0.012 . 1 . . . . 29 Val HB . 16450 1
204 . 1 1 29 29 VAL HG11 H 1 0.821 0.001 . 1 . . . . 29 Val HG11 . 16450 1
205 . 1 1 29 29 VAL HG12 H 1 0.821 0.001 . 1 . . . . 29 Val HG12 . 16450 1
206 . 1 1 29 29 VAL HG13 H 1 0.821 0.001 . 1 . . . . 29 Val HG13 . 16450 1
207 . 1 1 29 29 VAL HG21 H 1 0.821 0.001 . 1 . . . . 29 Val HG21 . 16450 1
208 . 1 1 29 29 VAL HG22 H 1 0.821 0.001 . 1 . . . . 29 Val HG22 . 16450 1
209 . 1 1 29 29 VAL HG23 H 1 0.821 0.001 . 1 . . . . 29 Val HG23 . 16450 1
210 . 1 1 29 29 VAL C C 13 175.852 0.000 . 1 . . . . 29 Val C . 16450 1
211 . 1 1 29 29 VAL CA C 13 62.364 0.000 . 1 . . . . 29 Val CA . 16450 1
212 . 1 1 29 29 VAL CB C 13 32.721 0.000 . 1 . . . . 29 Val CB . 16450 1
213 . 1 1 29 29 VAL CG1 C 13 20.930 0.000 . 1 . . . . 29 Val CG1 . 16450 1
214 . 1 1 29 29 VAL CG2 C 13 20.930 0.000 . 1 . . . . 29 Val CG2 . 16450 1
215 . 1 1 29 29 VAL N N 15 120.701 0.052 . 1 . . . . 29 Val N . 16450 1
216 . 1 1 30 30 HIS H H 1 8.447 0.005 . 1 . . . . 30 His H . 16450 1
217 . 1 1 30 30 HIS HA H 1 4.636 0.005 . 1 . . . . 30 His HA . 16450 1
218 . 1 1 30 30 HIS HB2 H 1 3.196 0.013 . 1 . . . . 30 His HB2 . 16450 1
219 . 1 1 30 30 HIS HB3 H 1 3.196 0.013 . 1 . . . . 30 His HB3 . 16450 1
220 . 1 1 30 30 HIS C C 13 174.096 0.005 . 1 . . . . 30 His C . 16450 1
221 . 1 1 30 30 HIS CA C 13 56.340 0.000 . 1 . . . . 30 His CA . 16450 1
222 . 1 1 30 30 HIS CB C 13 29.603 0.000 . 1 . . . . 30 His CB . 16450 1
223 . 1 1 30 30 HIS N N 15 122.771 0.222 . 1 . . . . 30 His N . 16450 1
224 . 1 1 31 31 GLN H H 1 8.474 0.001 . 1 . . . . 31 Gln H . 16450 1
225 . 1 1 31 31 GLN HA H 1 4.313 0.005 . 1 . . . . 31 Gln HA . 16450 1
226 . 1 1 31 31 GLN HB2 H 1 2.102 0.006 . 1 . . . . 31 Gln HB2 . 16450 1
227 . 1 1 31 31 GLN HB3 H 1 2.102 0.006 . 1 . . . . 31 Gln HB3 . 16450 1
228 . 1 1 31 31 GLN HG2 H 1 2.362 0.007 . 1 . . . . 31 Gln HG2 . 16450 1
229 . 1 1 31 31 GLN HG3 H 1 2.362 0.007 . 1 . . . . 31 Gln HG3 . 16450 1
230 . 1 1 31 31 GLN C C 13 176.250 0.000 . 1 . . . . 31 Gln C . 16450 1
231 . 1 1 31 31 GLN CA C 13 56.316 0.000 . 1 . . . . 31 Gln CA . 16450 1
232 . 1 1 31 31 GLN CB C 13 29.732 0.000 . 1 . . . . 31 Gln CB . 16450 1
233 . 1 1 31 31 GLN CG C 13 32.786 0.000 . 1 . . . . 31 Gln CG . 16450 1
234 . 1 1 31 31 GLN N N 15 121.100 0.000 . 1 . . . . 31 Gln N . 16450 1
235 . 1 1 32 32 THR H H 1 8.271 0.004 . 1 . . . . 32 Thr H . 16450 1
236 . 1 1 32 32 THR HA H 1 4.377 0.008 . 1 . . . . 32 Thr HA . 16450 1
237 . 1 1 32 32 THR HB H 1 4.282 0.003 . 1 . . . . 32 Thr HB . 16450 1
238 . 1 1 32 32 THR HG21 H 1 1.204 0.010 . 1 . . . . 32 Thr HG21 . 16450 1
239 . 1 1 32 32 THR HG22 H 1 1.204 0.010 . 1 . . . . 32 Thr HG22 . 16450 1
240 . 1 1 32 32 THR HG23 H 1 1.204 0.010 . 1 . . . . 32 Thr HG23 . 16450 1
241 . 1 1 32 32 THR C C 13 174.605 0.000 . 1 . . . . 32 Thr C . 16450 1
242 . 1 1 32 32 THR CA C 13 62.176 0.000 . 1 . . . . 32 Thr CA . 16450 1
243 . 1 1 32 32 THR CB C 13 69.933 0.000 . 1 . . . . 32 Thr CB . 16450 1
244 . 1 1 32 32 THR CG2 C 13 22.102 0.000 . 1 . . . . 32 Thr CG2 . 16450 1
245 . 1 1 32 32 THR N N 15 115.878 0.029 . 1 . . . . 32 Thr N . 16450 1
246 . 1 1 33 33 GLU H H 1 8.472 0.003 . 1 . . . . 33 Glu H . 16450 1
247 . 1 1 33 33 GLU HA H 1 4.309 0.006 . 1 . . . . 33 Glu HA . 16450 1
248 . 1 1 33 33 GLU HB2 H 1 2.003 0.005 . 1 . . . . 33 Glu HB2 . 16450 1
249 . 1 1 33 33 GLU HB3 H 1 2.003 0.005 . 1 . . . . 33 Glu HB3 . 16450 1
250 . 1 1 33 33 GLU HG2 H 1 2.262 0.001 . 1 . . . . 33 Glu HG2 . 16450 1
251 . 1 1 33 33 GLU HG3 H 1 2.262 0.001 . 1 . . . . 33 Glu HG3 . 16450 1
252 . 1 1 33 33 GLU C C 13 176.180 0.006 . 1 . . . . 33 Glu C . 16450 1
253 . 1 1 33 33 GLU CA C 13 56.781 0.000 . 1 . . . . 33 Glu CA . 16450 1
254 . 1 1 33 33 GLU CB C 13 30.251 0.000 . 1 . . . . 33 Glu CB . 16450 1
255 . 1 1 33 33 GLU CG C 13 35.516 0.000 . 1 . . . . 33 Glu CG . 16450 1
256 . 1 1 33 33 GLU N N 15 123.542 0.052 . 1 . . . . 33 Glu N . 16450 1
257 . 1 1 34 34 ALA H H 1 8.318 0.003 . 1 . . . . 34 Ala H . 16450 1
258 . 1 1 34 34 ALA HA H 1 4.325 0.005 . 1 . . . . 34 Ala HA . 16450 1
259 . 1 1 34 34 ALA HB1 H 1 1.362 0.003 . 1 . . . . 34 Ala HB1 . 16450 1
260 . 1 1 34 34 ALA HB2 H 1 1.362 0.003 . 1 . . . . 34 Ala HB2 . 16450 1
261 . 1 1 34 34 ALA HB3 H 1 1.362 0.003 . 1 . . . . 34 Ala HB3 . 16450 1
262 . 1 1 34 34 ALA C C 13 177.646 0.011 . 1 . . . . 34 Ala C . 16450 1
263 . 1 1 34 34 ALA CA C 13 52.564 0.014 . 1 . . . . 34 Ala CA . 16450 1
264 . 1 1 34 34 ALA CB C 13 19.026 0.000 . 1 . . . . 34 Ala CB . 16450 1
265 . 1 1 34 34 ALA N N 15 125.327 0.054 . 1 . . . . 34 Ala N . 16450 1
266 . 1 1 35 35 LEU H H 1 8.175 0.005 . 1 . . . . 35 Leu H . 16450 1
267 . 1 1 35 35 LEU HA H 1 4.329 0.011 . 1 . . . . 35 Leu HA . 16450 1
268 . 1 1 35 35 LEU HB2 H 1 1.641 0.004 . 1 . . . . 35 Leu HB2 . 16450 1
269 . 1 1 35 35 LEU HB3 H 1 1.641 0.004 . 1 . . . . 35 Leu HB3 . 16450 1
270 . 1 1 35 35 LEU HD11 H 1 0.913 0.015 . 1 . . . . 35 Leu HD11 . 16450 1
271 . 1 1 35 35 LEU HD12 H 1 0.913 0.015 . 1 . . . . 35 Leu HD12 . 16450 1
272 . 1 1 35 35 LEU HD13 H 1 0.913 0.015 . 1 . . . . 35 Leu HD13 . 16450 1
273 . 1 1 35 35 LEU HD21 H 1 0.913 0.015 . 1 . . . . 35 Leu HD21 . 16450 1
274 . 1 1 35 35 LEU HD22 H 1 0.913 0.015 . 1 . . . . 35 Leu HD22 . 16450 1
275 . 1 1 35 35 LEU HD23 H 1 0.913 0.015 . 1 . . . . 35 Leu HD23 . 16450 1
276 . 1 1 35 35 LEU HG H 1 1.582 0.005 . 1 . . . . 35 Leu HG . 16450 1
277 . 1 1 35 35 LEU C C 13 178.044 0.005 . 1 . . . . 35 Leu C . 16450 1
278 . 1 1 35 35 LEU CA C 13 55.490 0.016 . 1 . . . . 35 Leu CA . 16450 1
279 . 1 1 35 35 LEU CB C 13 42.332 0.003 . 1 . . . . 35 Leu CB . 16450 1
280 . 1 1 35 35 LEU CD1 C 13 24.172 0.000 . 1 . . . . 35 Leu CD1 . 16450 1
281 . 1 1 35 35 LEU CD2 C 13 24.172 0.000 . 1 . . . . 35 Leu CD2 . 16450 1
282 . 1 1 35 35 LEU CG C 13 27.102 0.000 . 1 . . . . 35 Leu CG . 16450 1
283 . 1 1 35 35 LEU N N 15 121.381 0.052 . 1 . . . . 35 Leu N . 16450 1
284 . 1 1 36 36 GLY H H 1 8.296 0.005 . 1 . . . . 36 Gly H . 16450 1
285 . 1 1 36 36 GLY HA2 H 1 3.916 0.000 . 1 . . . . 36 Gly HA2 . 16450 1
286 . 1 1 36 36 GLY HA3 H 1 3.916 0.000 . 1 . . . . 36 Gly HA3 . 16450 1
287 . 1 1 36 36 GLY C C 13 173.923 0.009 . 1 . . . . 36 Gly C . 16450 1
288 . 1 1 36 36 GLY CA C 13 45.293 0.000 . 1 . . . . 36 Gly CA . 16450 1
289 . 1 1 36 36 GLY N N 15 109.399 0.059 . 1 . . . . 36 Gly N . 16450 1
290 . 1 1 37 37 ALA H H 1 8.054 0.004 . 1 . . . . 37 Ala H . 16450 1
291 . 1 1 37 37 ALA HA H 1 4.241 0.010 . 1 . . . . 37 Ala HA . 16450 1
292 . 1 1 37 37 ALA HB1 H 1 1.261 0.007 . 1 . . . . 37 Ala HB1 . 16450 1
293 . 1 1 37 37 ALA HB2 H 1 1.261 0.007 . 1 . . . . 37 Ala HB2 . 16450 1
294 . 1 1 37 37 ALA HB3 H 1 1.261 0.007 . 1 . . . . 37 Ala HB3 . 16450 1
295 . 1 1 37 37 ALA C C 13 177.552 0.000 . 1 . . . . 37 Ala C . 16450 1
296 . 1 1 37 37 ALA CA C 13 52.619 0.020 . 1 . . . . 37 Ala CA . 16450 1
297 . 1 1 37 37 ALA CB C 13 19.079 0.000 . 1 . . . . 37 Ala CB . 16450 1
298 . 1 1 37 37 ALA N N 15 123.221 0.152 . 1 . . . . 37 Ala N . 16450 1
299 . 1 1 38 38 TYR H H 1 8.167 0.003 . 1 . . . . 38 Tyr H . 16450 1
300 . 1 1 38 38 TYR HA H 1 4.544 0.005 . 1 . . . . 38 Tyr HA . 16450 1
301 . 1 1 38 38 TYR HB2 H 1 3.009 0.010 . 1 . . . . 38 Tyr HB2 . 16450 1
302 . 1 1 38 38 TYR HB3 H 1 3.009 0.010 . 1 . . . . 38 Tyr HB3 . 16450 1
303 . 1 1 38 38 TYR C C 13 176.528 0.001 . 1 . . . . 38 Tyr C . 16450 1
304 . 1 1 38 38 TYR CA C 13 58.200 0.000 . 1 . . . . 38 Tyr CA . 16450 1
305 . 1 1 38 38 TYR CB C 13 38.555 0.035 . 1 . . . . 38 Tyr CB . 16450 1
306 . 1 1 38 38 TYR N N 15 119.183 0.054 . 1 . . . . 38 Tyr N . 16450 1
307 . 1 1 39 39 GLY H H 1 8.218 0.003 . 1 . . . . 39 Gly H . 16450 1
308 . 1 1 39 39 GLY HA2 H 1 3.894 0.000 . 1 . . . . 39 Gly HA2 . 16450 1
309 . 1 1 39 39 GLY HA3 H 1 3.894 0.000 . 1 . . . . 39 Gly HA3 . 16450 1
310 . 1 1 39 39 GLY C C 13 173.898 0.005 . 1 . . . . 39 Gly C . 16450 1
311 . 1 1 39 39 GLY CA C 13 45.322 0.004 . 1 . . . . 39 Gly CA . 16450 1
312 . 1 1 39 39 GLY N N 15 110.541 0.059 . 1 . . . . 39 Gly N . 16450 1
313 . 1 1 40 40 ALA H H 1 8.156 0.004 . 1 . . . . 40 Ala H . 16450 1
314 . 1 1 40 40 ALA HA H 1 4.318 0.001 . 1 . . . . 40 Ala HA . 16450 1
315 . 1 1 40 40 ALA HB1 H 1 1.394 0.007 . 1 . . . . 40 Ala HB1 . 16450 1
316 . 1 1 40 40 ALA HB2 H 1 1.394 0.007 . 1 . . . . 40 Ala HB2 . 16450 1
317 . 1 1 40 40 ALA HB3 H 1 1.394 0.007 . 1 . . . . 40 Ala HB3 . 16450 1
318 . 1 1 40 40 ALA C C 13 178.319 0.004 . 1 . . . . 40 Ala C . 16450 1
319 . 1 1 40 40 ALA CA C 13 52.749 0.004 . 1 . . . . 40 Ala CA . 16450 1
320 . 1 1 40 40 ALA CB C 13 19.202 0.000 . 1 . . . . 40 Ala CB . 16450 1
321 . 1 1 40 40 ALA N N 15 123.813 0.025 . 1 . . . . 40 Ala N . 16450 1
322 . 1 1 41 41 GLY H H 1 8.433 0.003 . 1 . . . . 41 Gly H . 16450 1
323 . 1 1 41 41 GLY HA2 H 1 4.003 0.000 . 1 . . . . 41 Gly HA2 . 16450 1
324 . 1 1 41 41 GLY HA3 H 1 4.003 0.000 . 1 . . . . 41 Gly HA3 . 16450 1
325 . 1 1 41 41 GLY C C 13 174.579 0.000 . 1 . . . . 41 Gly C . 16450 1
326 . 1 1 41 41 GLY CA C 13 45.397 0.013 . 1 . . . . 41 Gly CA . 16450 1
327 . 1 1 41 41 GLY N N 15 108.187 0.059 . 1 . . . . 41 Gly N . 16450 1
328 . 1 1 42 42 THR H H 1 8.115 0.003 . 1 . . . . 42 Thr H . 16450 1
329 . 1 1 42 42 THR HA H 1 4.345 0.006 . 1 . . . . 42 Thr HA . 16450 1
330 . 1 1 42 42 THR HB H 1 4.265 0.003 . 1 . . . . 42 Thr HB . 16450 1
331 . 1 1 42 42 THR HG21 H 1 1.186 0.009 . 1 . . . . 42 Thr HG21 . 16450 1
332 . 1 1 42 42 THR HG22 H 1 1.186 0.009 . 1 . . . . 42 Thr HG22 . 16450 1
333 . 1 1 42 42 THR HG23 H 1 1.186 0.009 . 1 . . . . 42 Thr HG23 . 16450 1
334 . 1 1 42 42 THR C C 13 175.349 0.000 . 1 . . . . 42 Thr C . 16450 1
335 . 1 1 42 42 THR CA C 13 61.851 0.000 . 1 . . . . 42 Thr CA . 16450 1
336 . 1 1 42 42 THR CB C 13 69.775 0.000 . 1 . . . . 42 Thr CB . 16450 1
337 . 1 1 42 42 THR CG2 C 13 21.930 0.000 . 1 . . . . 42 Thr CG2 . 16450 1
338 . 1 1 42 42 THR N N 15 113.051 0.059 . 1 . . . . 42 Thr N . 16450 1
339 . 1 1 43 43 GLY H H 1 8.510 0.002 . 1 . . . . 43 Gly H . 16450 1
340 . 1 1 43 43 GLY HA2 H 1 3.989 0.000 . 1 . . . . 43 Gly HA2 . 16450 1
341 . 1 1 43 43 GLY HA3 H 1 3.989 0.000 . 1 . . . . 43 Gly HA3 . 16450 1
342 . 1 1 43 43 GLY C C 13 174.543 0.020 . 1 . . . . 43 Gly C . 16450 1
343 . 1 1 43 43 GLY CA C 13 45.479 0.000 . 1 . . . . 43 Gly CA . 16450 1
344 . 1 1 43 43 GLY N N 15 111.274 0.059 . 1 . . . . 43 Gly N . 16450 1
345 . 1 1 44 44 THR H H 1 8.068 0.003 . 1 . . . . 44 Thr H . 16450 1
346 . 1 1 44 44 THR HA H 1 4.377 0.002 . 1 . . . . 44 Thr HA . 16450 1
347 . 1 1 44 44 THR HB H 1 4.266 0.004 . 1 . . . . 44 Thr HB . 16450 1
348 . 1 1 44 44 THR HG21 H 1 1.196 0.008 . 1 . . . . 44 Thr HG21 . 16450 1
349 . 1 1 44 44 THR HG22 H 1 1.196 0.008 . 1 . . . . 44 Thr HG22 . 16450 1
350 . 1 1 44 44 THR HG23 H 1 1.196 0.008 . 1 . . . . 44 Thr HG23 . 16450 1
351 . 1 1 44 44 THR C C 13 175.389 0.000 . 1 . . . . 44 Thr C . 16450 1
352 . 1 1 44 44 THR CA C 13 62.081 0.000 . 1 . . . . 44 Thr CA . 16450 1
353 . 1 1 44 44 THR CB C 13 69.984 0.000 . 1 . . . . 44 Thr CB . 16450 1
354 . 1 1 44 44 THR CG2 C 13 21.758 0.000 . 1 . . . . 44 Thr CG2 . 16450 1
355 . 1 1 44 44 THR N N 15 112.845 0.079 . 1 . . . . 44 Thr N . 16450 1
356 . 1 1 45 45 GLY H H 1 8.488 0.002 . 1 . . . . 45 Gly H . 16450 1
357 . 1 1 45 45 GLY HA2 H 1 3.986 0.000 . 1 . . . . 45 Gly HA2 . 16450 1
358 . 1 1 45 45 GLY HA3 H 1 3.986 0.000 . 1 . . . . 45 Gly HA3 . 16450 1
359 . 1 1 45 45 GLY C C 13 174.172 0.000 . 1 . . . . 45 Gly C . 16450 1
360 . 1 1 45 45 GLY CA C 13 45.430 0.013 . 1 . . . . 45 Gly CA . 16450 1
361 . 1 1 45 45 GLY N N 15 111.122 0.059 . 1 . . . . 45 Gly N . 16450 1
362 . 1 1 46 46 MET H H 1 8.181 0.003 . 1 . . . . 46 Met H . 16450 1
363 . 1 1 46 46 MET HA H 1 4.455 0.004 . 1 . . . . 46 Met HA . 16450 1
364 . 1 1 46 46 MET HB2 H 1 2.058 0.012 . 1 . . . . 46 Met HB2 . 16450 1
365 . 1 1 46 46 MET HB3 H 1 2.058 0.012 . 1 . . . . 46 Met HB3 . 16450 1
366 . 1 1 46 46 MET HG2 H 1 2.565 0.018 . 1 . . . . 46 Met HG2 . 16450 1
367 . 1 1 46 46 MET HG3 H 1 2.565 0.018 . 1 . . . . 46 Met HG3 . 16450 1
368 . 1 1 46 46 MET C C 13 176.189 0.000 . 1 . . . . 46 Met C . 16450 1
369 . 1 1 46 46 MET CA C 13 55.786 0.000 . 1 . . . . 46 Met CA . 16450 1
370 . 1 1 46 46 MET CB C 13 32.863 0.000 . 1 . . . . 46 Met CB . 16450 1
371 . 1 1 46 46 MET CG C 13 31.691 0.000 . 1 . . . . 46 Met CG . 16450 1
372 . 1 1 46 46 MET N N 15 119.200 0.000 . 1 . . . . 46 Met N . 16450 1
373 . 1 1 48 48 GLY H H 1 8.630 0.005 . 1 . . . . 48 Gly H . 16450 1
374 . 1 1 48 48 GLY HA2 H 1 3.958 0.000 . 1 . . . . 48 Gly HA2 . 16450 1
375 . 1 1 48 48 GLY HA3 H 1 3.958 0.000 . 1 . . . . 48 Gly HA3 . 16450 1
376 . 1 1 48 48 GLY C C 13 175.191 0.003 . 1 . . . . 48 Gly C . 16450 1
377 . 1 1 48 48 GLY CA C 13 45.926 0.005 . 1 . . . . 48 Gly CA . 16450 1
378 . 1 1 48 48 GLY N N 15 109.744 0.069 . 1 . . . . 48 Gly N . 16450 1
379 . 1 1 49 49 GLY H H 1 8.426 0.005 . 1 . . . . 49 Gly H . 16450 1
380 . 1 1 49 49 GLY HA2 H 1 3.970 0.000 . 1 . . . . 49 Gly HA2 . 16450 1
381 . 1 1 49 49 GLY HA3 H 1 3.970 0.000 . 1 . . . . 49 Gly HA3 . 16450 1
382 . 1 1 49 49 GLY C C 13 174.576 0.003 . 1 . . . . 49 Gly C . 16450 1
383 . 1 1 49 49 GLY CA C 13 45.473 0.000 . 1 . . . . 49 Gly CA . 16450 1
384 . 1 1 49 49 GLY N N 15 109.279 0.065 . 1 . . . . 49 Gly N . 16450 1
385 . 1 1 50 50 GLU H H 1 8.133 0.005 . 1 . . . . 50 Glu H . 16450 1
386 . 1 1 50 50 GLU HA H 1 4.385 0.006 . 1 . . . . 50 Glu HA . 16450 1
387 . 1 1 50 50 GLU HB2 H 1 1.848 0.002 . 1 . . . . 50 Glu HB2 . 16450 1
388 . 1 1 50 50 GLU HB3 H 1 1.848 0.002 . 1 . . . . 50 Glu HB3 . 16450 1
389 . 1 1 50 50 GLU HG2 H 1 2.262 0.000 . 1 . . . . 50 Glu HG2 . 16450 1
390 . 1 1 50 50 GLU HG3 H 1 2.262 0.000 . 1 . . . . 50 Glu HG3 . 16450 1
391 . 1 1 50 50 GLU C C 13 176.081 0.000 . 1 . . . . 50 Glu C . 16450 1
392 . 1 1 50 50 GLU CA C 13 56.273 0.000 . 1 . . . . 50 Glu CA . 16450 1
393 . 1 1 50 50 GLU CB C 13 30.759 0.000 . 1 . . . . 50 Glu CB . 16450 1
394 . 1 1 50 50 GLU N N 15 120.320 0.000 . 1 . . . . 50 Glu N . 16450 1
395 . 1 1 51 51 HIS H H 1 8.402 0.005 . 1 . . . . 51 His H . 16450 1
396 . 1 1 51 51 HIS HA H 1 4.454 0.001 . 1 . . . . 51 His HA . 16450 1
397 . 1 1 51 51 HIS HB2 H 1 3.206 0.006 . 1 . . . . 51 His HB2 . 16450 1
398 . 1 1 51 51 HIS HB3 H 1 3.206 0.006 . 1 . . . . 51 His HB3 . 16450 1
399 . 1 1 51 51 HIS C C 13 177.183 0.000 . 1 . . . . 51 His C . 16450 1
400 . 1 1 51 51 HIS CA C 13 56.585 0.000 . 1 . . . . 51 His CA . 16450 1
401 . 1 1 51 51 HIS CB C 13 29.580 0.000 . 1 . . . . 51 His CB . 16450 1
402 . 1 1 51 51 HIS N N 15 122.810 0.000 . 1 . . . . 51 His N . 16450 1
403 . 1 1 55 55 PRO HA H 1 4.432 0.003 . 1 . . . . 55 Pro HA . 16450 1
404 . 1 1 55 55 PRO HB2 H 1 2.303 0.002 . 1 . . . . 55 Pro HB2 . 16450 1
405 . 1 1 55 55 PRO HB3 H 1 2.303 0.002 . 1 . . . . 55 Pro HB3 . 16450 1
406 . 1 1 55 55 PRO HD2 H 1 3.904 0.005 . 1 . . . . 55 Pro HD2 . 16450 1
407 . 1 1 55 55 PRO HD3 H 1 3.904 0.005 . 1 . . . . 55 Pro HD3 . 16450 1
408 . 1 1 55 55 PRO HG2 H 1 1.975 0.012 . 1 . . . . 55 Pro HG2 . 16450 1
409 . 1 1 55 55 PRO HG3 H 1 1.975 0.012 . 1 . . . . 55 Pro HG3 . 16450 1
410 . 1 1 55 55 PRO C C 13 176.705 0.000 . 1 . . . . 55 Pro C . 16450 1
411 . 1 1 55 55 PRO CA C 13 63.336 0.000 . 1 . . . . 55 Pro CA . 16450 1
412 . 1 1 55 55 PRO CB C 13 32.010 0.017 . 1 . . . . 55 Pro CB . 16450 1
413 . 1 1 55 55 PRO CD C 13 50.273 0.000 . 1 . . . . 55 Pro CD . 16450 1
414 . 1 1 55 55 PRO CG C 13 27.102 0.000 . 1 . . . . 55 Pro CG . 16450 1
415 . 1 1 56 56 HIS H H 1 8.394 0.002 . 1 . . . . 56 His H . 16450 1
416 . 1 1 56 56 HIS C C 13 176.280 0.000 . 1 . . . . 56 His C . 16450 1
417 . 1 1 56 56 HIS CA C 13 56.215 0.000 . 1 . . . . 56 His CA . 16450 1
418 . 1 1 56 56 HIS CB C 13 29.609 0.000 . 1 . . . . 56 His CB . 16450 1
419 . 1 1 56 56 HIS N N 15 119.200 0.000 . 1 . . . . 56 His N . 16450 1
420 . 1 1 59 59 PRO HA H 1 4.382 0.009 . 1 . . . . 59 Pro HA . 16450 1
421 . 1 1 59 59 PRO HB2 H 1 2.302 0.003 . 1 . . . . 59 Pro HB2 . 16450 1
422 . 1 1 59 59 PRO HB3 H 1 2.302 0.004 . 1 . . . . 59 Pro HB3 . 16450 1
423 . 1 1 59 59 PRO HD2 H 1 3.707 0.001 . 1 . . . . 59 Pro HD2 . 16450 1
424 . 1 1 59 59 PRO HD3 H 1 3.707 0.001 . 1 . . . . 59 Pro HD3 . 16450 1
425 . 1 1 59 59 PRO HG2 H 1 2.008 0.000 . 1 . . . . 59 Pro HG2 . 16450 1
426 . 1 1 59 59 PRO HG3 H 1 2.008 0.000 . 1 . . . . 59 Pro HG3 . 16450 1
427 . 1 1 59 59 PRO C C 13 177.491 0.000 . 1 . . . . 59 Pro C . 16450 1
428 . 1 1 59 59 PRO CA C 13 63.714 0.000 . 1 . . . . 59 Pro CA . 16450 1
429 . 1 1 59 59 PRO CB C 13 31.998 0.002 . 1 . . . . 59 Pro CB . 16450 1
430 . 1 1 59 59 PRO CD C 13 50.711 0.000 . 1 . . . . 59 Pro CD . 16450 1
431 . 1 1 60 60 GLY H H 1 8.479 0.004 . 1 . . . . 60 Gly H . 16450 1
432 . 1 1 60 60 GLY HA2 H 1 3.949 0.000 . 1 . . . . 60 Gly HA2 . 16450 1
433 . 1 1 60 60 GLY HA3 H 1 3.949 0.000 . 1 . . . . 60 Gly HA3 . 16450 1
434 . 1 1 60 60 GLY C C 13 173.743 0.022 . 1 . . . . 60 Gly C . 16450 1
435 . 1 1 60 60 GLY CA C 13 45.421 0.003 . 1 . . . . 60 Gly CA . 16450 1
436 . 1 1 60 60 GLY N N 15 109.339 0.121 . 1 . . . . 60 Gly N . 16450 1
437 . 1 1 61 61 VAL H H 1 7.879 0.005 . 1 . . . . 61 Val H . 16450 1
438 . 1 1 61 61 VAL HA H 1 4.106 0.009 . 1 . . . . 61 Val HA . 16450 1
439 . 1 1 61 61 VAL HB H 1 2.073 0.020 . 1 . . . . 61 Val HB . 16450 1
440 . 1 1 61 61 VAL HG11 H 1 0.912 0.008 . 1 . . . . 61 Val HG11 . 16450 1
441 . 1 1 61 61 VAL HG12 H 1 0.912 0.008 . 1 . . . . 61 Val HG12 . 16450 1
442 . 1 1 61 61 VAL HG13 H 1 0.912 0.008 . 1 . . . . 61 Val HG13 . 16450 1
443 . 1 1 61 61 VAL HG21 H 1 0.912 0.011 . 1 . . . . 61 Val HG21 . 16450 1
444 . 1 1 61 61 VAL HG22 H 1 0.912 0.011 . 1 . . . . 61 Val HG22 . 16450 1
445 . 1 1 61 61 VAL HG23 H 1 0.912 0.011 . 1 . . . . 61 Val HG23 . 16450 1
446 . 1 1 61 61 VAL C C 13 176.172 0.000 . 1 . . . . 61 Val C . 16450 1
447 . 1 1 61 61 VAL CA C 13 62.518 0.000 . 1 . . . . 61 Val CA . 16450 1
448 . 1 1 61 61 VAL CB C 13 32.629 0.000 . 1 . . . . 61 Val CB . 16450 1
449 . 1 1 61 61 VAL CG1 C 13 20.930 0.000 . 1 . . . . 61 Val CG1 . 16450 1
450 . 1 1 61 61 VAL CG2 C 13 20.930 0.000 . 1 . . . . 61 Val CG2 . 16450 1
451 . 1 1 61 61 VAL N N 15 119.242 0.025 . 1 . . . . 61 Val N . 16450 1
452 . 1 1 62 62 LEU H H 1 8.306 0.003 . 1 . . . . 62 Leu H . 16450 1
453 . 1 1 62 62 LEU HA H 1 4.354 0.011 . 1 . . . . 62 Leu HA . 16450 1
454 . 1 1 62 62 LEU HB2 H 1 1.571 0.005 . 1 . . . . 62 Leu HB2 . 16450 1
455 . 1 1 62 62 LEU HB3 H 1 1.571 0.005 . 1 . . . . 62 Leu HB3 . 16450 1
456 . 1 1 62 62 LEU HD11 H 1 0.910 0.005 . 1 . . . . 62 Leu HD11 . 16450 1
457 . 1 1 62 62 LEU HD12 H 1 0.910 0.005 . 1 . . . . 62 Leu HD12 . 16450 1
458 . 1 1 62 62 LEU HD13 H 1 0.910 0.005 . 1 . . . . 62 Leu HD13 . 16450 1
459 . 1 1 62 62 LEU HD21 H 1 0.910 0.005 . 1 . . . . 62 Leu HD21 . 16450 1
460 . 1 1 62 62 LEU HD22 H 1 0.910 0.005 . 1 . . . . 62 Leu HD22 . 16450 1
461 . 1 1 62 62 LEU HD23 H 1 0.910 0.005 . 1 . . . . 62 Leu HD23 . 16450 1
462 . 1 1 62 62 LEU C C 13 176.925 0.016 . 1 . . . . 62 Leu C . 16450 1
463 . 1 1 62 62 LEU CA C 13 55.211 0.015 . 1 . . . . 62 Leu CA . 16450 1
464 . 1 1 62 62 LEU CB C 13 42.381 0.000 . 1 . . . . 62 Leu CB . 16450 1
465 . 1 1 62 62 LEU CD1 C 13 24.102 0.000 . 1 . . . . 62 Leu CD1 . 16450 1
466 . 1 1 62 62 LEU CD2 C 13 24.102 0.000 . 1 . . . . 62 Leu CD2 . 16450 1
467 . 1 1 62 62 LEU N N 15 125.399 0.052 . 1 . . . . 62 Leu N . 16450 1
468 . 1 1 63 63 ASN H H 1 8.408 0.004 . 1 . . . . 63 Asn H . 16450 1
469 . 1 1 63 63 ASN HA H 1 4.717 0.005 . 1 . . . . 63 Asn HA . 16450 1
470 . 1 1 63 63 ASN HB2 H 1 2.818 0.010 . 1 . . . . 63 Asn HB2 . 16450 1
471 . 1 1 63 63 ASN HB3 H 1 2.818 0.010 . 1 . . . . 63 Asn HB3 . 16450 1
472 . 1 1 63 63 ASN C C 13 175.158 0.003 . 1 . . . . 63 Asn C . 16450 1
473 . 1 1 63 63 ASN CA C 13 53.205 0.004 . 1 . . . . 63 Asn CA . 16450 1
474 . 1 1 63 63 ASN CB C 13 38.762 0.028 . 1 . . . . 63 Asn CB . 16450 1
475 . 1 1 63 63 ASN N N 15 119.521 0.055 . 1 . . . . 63 Asn N . 16450 1
476 . 1 1 64 64 ARG H H 1 8.410 0.008 . 1 . . . . 64 Arg H . 16450 1
477 . 1 1 64 64 ARG HA H 1 4.523 0.015 . 1 . . . . 64 Arg HA . 16450 1
478 . 1 1 64 64 ARG HB2 H 1 2.043 0.014 . 1 . . . . 64 Arg HB2 . 16450 1
479 . 1 1 64 64 ARG HB3 H 1 2.039 0.011 . 1 . . . . 64 Arg HB3 . 16450 1
480 . 1 1 64 64 ARG C C 13 175.156 0.000 . 1 . . . . 64 Arg C . 16450 1
481 . 1 1 64 64 ARG CA C 13 56.297 0.010 . 1 . . . . 64 Arg CA . 16450 1
482 . 1 1 64 64 ARG CB C 13 30.155 0.000 . 1 . . . . 64 Arg CB . 16450 1
483 . 1 1 64 64 ARG N N 15 120.538 0.057 . 1 . . . . 64 Arg N . 16450 1
484 . 1 1 65 65 SER H H 1 8.406 0.002 . 1 . . . . 65 Ser H . 16450 1
485 . 1 1 65 65 SER HA H 1 4.478 0.004 . 1 . . . . 65 Ser HA . 16450 1
486 . 1 1 65 65 SER HB2 H 1 3.909 0.003 . 1 . . . . 65 Ser HB2 . 16450 1
487 . 1 1 65 65 SER HB3 H 1 3.909 0.003 . 1 . . . . 65 Ser HB3 . 16450 1
488 . 1 1 65 65 SER C C 13 175.090 0.013 . 1 . . . . 65 Ser C . 16450 1
489 . 1 1 65 65 SER CA C 13 58.687 0.001 . 1 . . . . 65 Ser CA . 16450 1
490 . 1 1 65 65 SER CB C 13 63.992 0.016 . 1 . . . . 65 Ser CB . 16450 1
491 . 1 1 65 65 SER N N 15 117.053 0.054 . 1 . . . . 65 Ser N . 16450 1
492 . 1 1 66 66 GLY H H 1 8.449 0.003 . 1 . . . . 66 Gly H . 16450 1
493 . 1 1 66 66 GLY HA2 H 1 4.005 0.000 . 1 . . . . 66 Gly HA2 . 16450 1
494 . 1 1 66 66 GLY HA3 H 1 4.005 0.000 . 1 . . . . 66 Gly HA3 . 16450 1
495 . 1 1 66 66 GLY C C 13 174.207 0.000 . 1 . . . . 66 Gly C . 16450 1
496 . 1 1 66 66 GLY CA C 13 45.423 0.000 . 1 . . . . 66 Gly CA . 16450 1
497 . 1 1 66 66 GLY N N 15 111.211 0.079 . 1 . . . . 66 Gly N . 16450 1
498 . 1 1 67 67 SER H H 1 8.244 0.006 . 1 . . . . 67 Ser H . 16450 1
499 . 1 1 67 67 SER HA H 1 4.332 0.000 . 1 . . . . 67 Ser HA . 16450 1
500 . 1 1 67 67 SER HB2 H 1 3.889 0.000 . 1 . . . . 67 Ser HB2 . 16450 1
501 . 1 1 67 67 SER HB3 H 1 3.889 0.000 . 1 . . . . 67 Ser HB3 . 16450 1
502 . 1 1 67 67 SER C C 13 174.600 0.000 . 1 . . . . 67 Ser C . 16450 1
503 . 1 1 67 67 SER CA C 13 58.338 0.000 . 1 . . . . 67 Ser CA . 16450 1
504 . 1 1 67 67 SER CB C 13 64.130 0.000 . 1 . . . . 67 Ser CB . 16450 1
505 . 1 1 67 67 SER N N 15 115.702 0.073 . 1 . . . . 67 Ser N . 16450 1
506 . 1 1 68 68 SER H H 1 8.453 0.004 . 1 . . . . 68 Ser H . 16450 1
507 . 1 1 68 68 SER HA H 1 4.565 0.001 . 1 . . . . 68 Ser HA . 16450 1
508 . 1 1 68 68 SER HB2 H 1 3.902 0.001 . 1 . . . . 68 Ser HB2 . 16450 1
509 . 1 1 68 68 SER HB3 H 1 3.902 0.001 . 1 . . . . 68 Ser HB3 . 16450 1
510 . 1 1 68 68 SER C C 13 174.584 0.000 . 1 . . . . 68 Ser C . 16450 1
511 . 1 1 68 68 SER CA C 13 58.489 0.000 . 1 . . . . 68 Ser CA . 16450 1
512 . 1 1 68 68 SER CB C 13 63.953 0.000 . 1 . . . . 68 Ser CB . 16450 1
513 . 1 1 68 68 SER N N 15 117.997 0.057 . 1 . . . . 68 Ser N . 16450 1
514 . 1 1 69 69 SER H H 1 8.417 0.003 . 1 . . . . 69 Ser H . 16450 1
515 . 1 1 69 69 SER HA H 1 4.536 0.012 . 1 . . . . 69 Ser HA . 16450 1
516 . 1 1 69 69 SER HB2 H 1 3.889 0.005 . 1 . . . . 69 Ser HB2 . 16450 1
517 . 1 1 69 69 SER HB3 H 1 3.889 0.005 . 1 . . . . 69 Ser HB3 . 16450 1
518 . 1 1 69 69 SER C C 13 174.680 0.000 . 1 . . . . 69 Ser C . 16450 1
519 . 1 1 69 69 SER CA C 13 58.685 0.046 . 1 . . . . 69 Ser CA . 16450 1
520 . 1 1 69 69 SER CB C 13 64.057 0.065 . 1 . . . . 69 Ser CB . 16450 1
521 . 1 1 69 69 SER N N 15 117.911 0.103 . 1 . . . . 69 Ser N . 16450 1
522 . 1 1 70 70 SER H H 1 8.392 0.005 . 1 . . . . 70 Ser H . 16450 1
523 . 1 1 70 70 SER HA H 1 4.537 0.006 . 1 . . . . 70 Ser HA . 16450 1
524 . 1 1 70 70 SER HB2 H 1 3.885 0.003 . 1 . . . . 70 Ser HB2 . 16450 1
525 . 1 1 70 70 SER HB3 H 1 3.885 0.003 . 1 . . . . 70 Ser HB3 . 16450 1
526 . 1 1 70 70 SER C C 13 174.696 0.000 . 1 . . . . 70 Ser C . 16450 1
527 . 1 1 70 70 SER CA C 13 58.717 0.000 . 1 . . . . 70 Ser CA . 16450 1
528 . 1 1 70 70 SER CB C 13 64.120 0.000 . 1 . . . . 70 Ser CB . 16450 1
529 . 1 1 70 70 SER N N 15 117.884 0.054 . 1 . . . . 70 Ser N . 16450 1
530 . 1 1 71 71 GLU H H 1 8.422 0.004 . 1 . . . . 71 Glu H . 16450 1
531 . 1 1 71 71 GLU HA H 1 4.384 0.020 . 1 . . . . 71 Glu HA . 16450 1
532 . 1 1 71 71 GLU HB2 H 1 1.854 0.015 . 1 . . . . 71 Glu HB2 . 16450 1
533 . 1 1 71 71 GLU HB3 H 1 1.854 0.015 . 1 . . . . 71 Glu HB3 . 16450 1
534 . 1 1 71 71 GLU HG2 H 1 2.259 0.004 . 1 . . . . 71 Glu HG2 . 16450 1
535 . 1 1 71 71 GLU HG3 H 1 2.259 0.004 . 1 . . . . 71 Glu HG3 . 16450 1
536 . 1 1 71 71 GLU C C 13 176.184 0.000 . 1 . . . . 71 Glu C . 16450 1
537 . 1 1 71 71 GLU CA C 13 56.472 0.000 . 1 . . . . 71 Glu CA . 16450 1
538 . 1 1 71 71 GLU CB C 13 30.039 0.000 . 1 . . . . 71 Glu CB . 16450 1
539 . 1 1 71 71 GLU CG C 13 33.172 0.000 . 1 . . . . 71 Glu CG . 16450 1
540 . 1 1 71 71 GLU N N 15 122.302 0.055 . 1 . . . . 71 Glu N . 16450 1
541 . 1 1 72 72 ASP H H 1 8.240 0.003 . 1 . . . . 72 Asp H . 16450 1
542 . 1 1 72 72 ASP HA H 1 4.645 0.003 . 1 . . . . 72 Asp HA . 16450 1
543 . 1 1 72 72 ASP HB2 H 1 2.687 0.012 . 1 . . . . 72 Asp HB2 . 16450 1
544 . 1 1 72 72 ASP HB3 H 1 2.687 0.012 . 1 . . . . 72 Asp HB3 . 16450 1
545 . 1 1 72 72 ASP C C 13 176.139 0.003 . 1 . . . . 72 Asp C . 16450 1
546 . 1 1 72 72 ASP CA C 13 54.515 0.000 . 1 . . . . 72 Asp CA . 16450 1
547 . 1 1 72 72 ASP CB C 13 41.537 0.000 . 1 . . . . 72 Asp CB . 16450 1
548 . 1 1 72 72 ASP N N 15 121.041 0.054 . 1 . . . . 72 Asp N . 16450 1
549 . 1 1 73 73 ASP H H 1 8.263 0.004 . 1 . . . . 73 Asp H . 16450 1
550 . 1 1 73 73 ASP HA H 1 4.606 0.016 . 1 . . . . 73 Asp HA . 16450 1
551 . 1 1 73 73 ASP HB2 H 1 2.743 0.004 . 1 . . . . 73 Asp HB2 . 16450 1
552 . 1 1 73 73 ASP HB3 H 1 2.743 0.004 . 1 . . . . 73 Asp HB3 . 16450 1
553 . 1 1 73 73 ASP C C 13 177.306 0.002 . 1 . . . . 73 Asp C . 16450 1
554 . 1 1 73 73 ASP CA C 13 54.691 0.000 . 1 . . . . 73 Asp CA . 16450 1
555 . 1 1 73 73 ASP CB C 13 41.056 0.000 . 1 . . . . 73 Asp CB . 16450 1
556 . 1 1 73 73 ASP N N 15 122.177 0.103 . 1 . . . . 73 Asp N . 16450 1
557 . 1 1 74 74 GLY H H 1 8.539 0.003 . 1 . . . . 74 Gly H . 16450 1
558 . 1 1 74 74 GLY HA2 H 1 3.971 0.000 . 1 . . . . 74 Gly HA2 . 16450 1
559 . 1 1 74 74 GLY HA3 H 1 3.971 0.000 . 1 . . . . 74 Gly HA3 . 16450 1
560 . 1 1 74 74 GLY C C 13 175.015 0.007 . 1 . . . . 74 Gly C . 16450 1
561 . 1 1 74 74 GLY CA C 13 45.813 0.000 . 1 . . . . 74 Gly CA . 16450 1
562 . 1 1 74 74 GLY N N 15 109.251 0.062 . 1 . . . . 74 Gly N . 16450 1
563 . 1 1 75 75 GLN H H 1 8.404 0.006 . 1 . . . . 75 Gln H . 16450 1
564 . 1 1 75 75 GLN HA H 1 4.398 0.014 . 1 . . . . 75 Gln HA . 16450 1
565 . 1 1 75 75 GLN HB2 H 1 2.096 0.024 . 1 . . . . 75 Gln HB2 . 16450 1
566 . 1 1 75 75 GLN HB3 H 1 2.096 0.024 . 1 . . . . 75 Gln HB3 . 16450 1
567 . 1 1 75 75 GLN HG2 H 1 2.351 0.016 . 1 . . . . 75 Gln HG2 . 16450 1
568 . 1 1 75 75 GLN HG3 H 1 2.351 0.015 . 1 . . . . 75 Gln HG3 . 16450 1
569 . 1 1 75 75 GLN C C 13 177.017 0.000 . 1 . . . . 75 Gln C . 16450 1
570 . 1 1 75 75 GLN CA C 13 56.160 0.006 . 1 . . . . 75 Gln CA . 16450 1
571 . 1 1 75 75 GLN CB C 13 29.371 0.000 . 1 . . . . 75 Gln CB . 16450 1
572 . 1 1 75 75 GLN CG C 13 32.344 0.000 . 1 . . . . 75 Gln CG . 16450 1
573 . 1 1 75 75 GLN N N 15 119.672 0.189 . 1 . . . . 75 Gln N . 16450 1
574 . 1 1 76 76 GLY H H 1 8.347 0.003 . 1 . . . . 76 Gly H . 16450 1
575 . 1 1 76 76 GLY HA2 H 1 3.972 0.000 . 1 . . . . 76 Gly HA2 . 16450 1
576 . 1 1 76 76 GLY HA3 H 1 3.972 0.000 . 1 . . . . 76 Gly HA3 . 16450 1
577 . 1 1 76 76 GLY C C 13 174.358 0.000 . 1 . . . . 76 Gly C . 16450 1
578 . 1 1 76 76 GLY CA C 13 45.188 0.000 . 1 . . . . 76 Gly CA . 16450 1
579 . 1 1 76 76 GLY N N 15 108.994 0.065 . 1 . . . . 76 Gly N . 16450 1
580 . 1 1 77 77 GLY H H 1 8.492 0.003 . 1 . . . . 77 Gly H . 16450 1
581 . 1 1 77 77 GLY HA2 H 1 3.960 0.000 . 1 . . . . 77 Gly HA2 . 16450 1
582 . 1 1 77 77 GLY HA3 H 1 3.960 0.000 . 1 . . . . 77 Gly HA3 . 16450 1
583 . 1 1 77 77 GLY C C 13 174.669 0.000 . 1 . . . . 77 Gly C . 16450 1
584 . 1 1 77 77 GLY CA C 13 45.331 0.000 . 1 . . . . 77 Gly CA . 16450 1
585 . 1 1 77 77 GLY N N 15 110.304 0.123 . 1 . . . . 77 Gly N . 16450 1
586 . 1 1 78 78 ARG H H 1 8.132 0.001 . 1 . . . . 78 Arg H . 16450 1
587 . 1 1 78 78 ARG HA H 1 4.338 0.005 . 1 . . . . 78 Arg HA . 16450 1
588 . 1 1 78 78 ARG HB2 H 1 1.760 0.001 . 1 . . . . 78 Arg HB2 . 16450 1
589 . 1 1 78 78 ARG HB3 H 1 1.760 0.001 . 1 . . . . 78 Arg HB3 . 16450 1
590 . 1 1 78 78 ARG HD2 H 1 3.202 0.006 . 1 . . . . 78 Arg HD2 . 16450 1
591 . 1 1 78 78 ARG HD3 H 1 3.202 0.006 . 1 . . . . 78 Arg HD3 . 16450 1
592 . 1 1 78 78 ARG HG2 H 1 1.625 0.003 . 1 . . . . 78 Arg HG2 . 16450 1
593 . 1 1 78 78 ARG HG3 H 1 1.625 0.003 . 1 . . . . 78 Arg HG3 . 16450 1
594 . 1 1 78 78 ARG C C 13 176.633 0.005 . 1 . . . . 78 Arg C . 16450 1
595 . 1 1 78 78 ARG CA C 13 57.304 0.000 . 1 . . . . 78 Arg CA . 16450 1
596 . 1 1 78 78 ARG CB C 13 30.749 0.000 . 1 . . . . 78 Arg CB . 16450 1
597 . 1 1 78 78 ARG CD C 13 42.102 0.000 . 1 . . . . 78 Arg CD . 16450 1
598 . 1 1 78 78 ARG CG C 13 27.102 0.000 . 1 . . . . 78 Arg CG . 16450 1
599 . 1 1 78 78 ARG N N 15 120.868 0.036 . 1 . . . . 78 Arg N . 16450 1
600 . 1 1 79 79 ARG H H 1 8.323 0.003 . 1 . . . . 79 Arg H . 16450 1
601 . 1 1 79 79 ARG HA H 1 4.259 0.003 . 1 . . . . 79 Arg HA . 16450 1
602 . 1 1 79 79 ARG HB2 H 1 1.933 0.007 . 1 . . . . 79 Arg HB2 . 16450 1
603 . 1 1 79 79 ARG HB3 H 1 1.933 0.007 . 1 . . . . 79 Arg HB3 . 16450 1
604 . 1 1 79 79 ARG C C 13 176.260 0.007 . 1 . . . . 79 Arg C . 16450 1
605 . 1 1 79 79 ARG CA C 13 57.287 0.031 . 1 . . . . 79 Arg CA . 16450 1
606 . 1 1 79 79 ARG CB C 13 30.133 0.250 . 1 . . . . 79 Arg CB . 16450 1
607 . 1 1 79 79 ARG N N 15 121.460 0.053 . 1 . . . . 79 Arg N . 16450 1
608 . 1 1 80 80 LYS H H 1 8.295 0.002 . 1 . . . . 80 Lys H . 16450 1
609 . 1 1 80 80 LYS HA H 1 4.249 0.008 . 1 . . . . 80 Lys HA . 16450 1
610 . 1 1 80 80 LYS HB2 H 1 1.991 0.007 . 1 . . . . 80 Lys HB2 . 16450 1
611 . 1 1 80 80 LYS HB3 H 1 1.991 0.007 . 1 . . . . 80 Lys HB3 . 16450 1
612 . 1 1 80 80 LYS C C 13 176.592 0.000 . 1 . . . . 80 Lys C . 16450 1
613 . 1 1 80 80 LYS CA C 13 56.677 0.000 . 1 . . . . 80 Lys CA . 16450 1
614 . 1 1 80 80 LYS CB C 13 30.180 0.000 . 1 . . . . 80 Lys CB . 16450 1
615 . 1 1 80 80 LYS N N 15 121.431 0.054 . 1 . . . . 80 Lys N . 16450 1
616 . 1 1 81 81 LYS H H 1 8.297 0.006 . 1 . . . . 81 Lys H . 16450 1
617 . 1 1 81 81 LYS HA H 1 4.232 0.002 . 1 . . . . 81 Lys HA . 16450 1
618 . 1 1 81 81 LYS HB2 H 1 1.825 0.005 . 1 . . . . 81 Lys HB2 . 16450 1
619 . 1 1 81 81 LYS HB3 H 1 1.825 0.005 . 1 . . . . 81 Lys HB3 . 16450 1
620 . 1 1 81 81 LYS HD2 H 1 1.676 0.002 . 1 . . . . 81 Lys HD2 . 16450 1
621 . 1 1 81 81 LYS HD3 H 1 1.676 0.002 . 1 . . . . 81 Lys HD3 . 16450 1
622 . 1 1 81 81 LYS HE2 H 1 2.993 0.006 . 1 . . . . 81 Lys HE2 . 16450 1
623 . 1 1 81 81 LYS HE3 H 1 2.993 0.006 . 1 . . . . 81 Lys HE3 . 16450 1
624 . 1 1 81 81 LYS HG2 H 1 1.450 0.006 . 1 . . . . 81 Lys HG2 . 16450 1
625 . 1 1 81 81 LYS HG3 H 1 1.450 0.006 . 1 . . . . 81 Lys HG3 . 16450 1
626 . 1 1 81 81 LYS C C 13 176.604 0.000 . 1 . . . . 81 Lys C . 16450 1
627 . 1 1 81 81 LYS CA C 13 56.839 0.004 . 1 . . . . 81 Lys CA . 16450 1
628 . 1 1 81 81 LYS CB C 13 30.031 0.000 . 1 . . . . 81 Lys CB . 16450 1
629 . 1 1 81 81 LYS CD C 13 30.000 0.000 . 1 . . . . 81 Lys CD . 16450 1
630 . 1 1 81 81 LYS CG C 13 23.516 0.000 . 1 . . . . 81 Lys CG . 16450 1
631 . 1 1 81 81 LYS N N 15 122.182 0.059 . 1 . . . . 81 Lys N . 16450 1
632 . 1 1 82 82 GLY H H 1 8.539 0.002 . 1 . . . . 82 Gly H . 16450 1
633 . 1 1 82 82 GLY HA2 H 1 3.972 0.000 . 1 . . . . 82 Gly HA2 . 16450 1
634 . 1 1 82 82 GLY HA3 H 1 3.972 0.000 . 1 . . . . 82 Gly HA3 . 16450 1
635 . 1 1 82 82 GLY C C 13 174.349 0.005 . 1 . . . . 82 Gly C . 16450 1
636 . 1 1 82 82 GLY CA C 13 45.338 0.000 . 1 . . . . 82 Gly CA . 16450 1
637 . 1 1 82 82 GLY N N 15 109.537 0.088 . 1 . . . . 82 Gly N . 16450 1
638 . 1 1 83 83 MET H H 1 8.456 0.002 . 1 . . . . 83 Met H . 16450 1
639 . 1 1 83 83 MET HA H 1 4.266 0.007 . 1 . . . . 83 Met HA . 16450 1
640 . 1 1 83 83 MET HB2 H 1 2.034 0.057 . 1 . . . . 83 Met HB2 . 16450 1
641 . 1 1 83 83 MET HB3 H 1 2.034 0.057 . 1 . . . . 83 Met HB3 . 16450 1
642 . 1 1 83 83 MET HG2 H 1 2.263 0.001 . 1 . . . . 83 Met HG2 . 16450 1
643 . 1 1 83 83 MET HG3 H 1 2.263 0.001 . 1 . . . . 83 Met HG3 . 16450 1
644 . 1 1 83 83 MET C C 13 176.560 0.000 . 1 . . . . 83 Met C . 16450 1
645 . 1 1 83 83 MET CA C 13 56.004 0.000 . 1 . . . . 83 Met CA . 16450 1
646 . 1 1 83 83 MET CB C 13 29.984 0.123 . 1 . . . . 83 Met CB . 16450 1
647 . 1 1 83 83 MET N N 15 120.863 0.000 . 1 . . . . 83 Met N . 16450 1
648 . 1 1 84 84 LYS H H 1 8.503 0.006 . 1 . . . . 84 Lys H . 16450 1
649 . 1 1 84 84 LYS HA H 1 4.284 0.002 . 1 . . . . 84 Lys HA . 16450 1
650 . 1 1 84 84 LYS HB2 H 1 1.851 0.001 . 1 . . . . 84 Lys HB2 . 16450 1
651 . 1 1 84 84 LYS HB3 H 1 1.850 0.010 . 1 . . . . 84 Lys HB3 . 16450 1
652 . 1 1 84 84 LYS HD2 H 1 1.679 0.000 . 1 . . . . 84 Lys HD2 . 16450 1
653 . 1 1 84 84 LYS HD3 H 1 1.679 0.000 . 1 . . . . 84 Lys HD3 . 16450 1
654 . 1 1 84 84 LYS HG2 H 1 1.456 0.002 . 1 . . . . 84 Lys HG2 . 16450 1
655 . 1 1 84 84 LYS HG3 H 1 1.456 0.002 . 1 . . . . 84 Lys HG3 . 16450 1
656 . 1 1 84 84 LYS C C 13 176.373 0.002 . 1 . . . . 84 Lys C . 16450 1
657 . 1 1 84 84 LYS CA C 13 56.513 0.015 . 1 . . . . 84 Lys CA . 16450 1
658 . 1 1 84 84 LYS CB C 13 32.948 0.000 . 1 . . . . 84 Lys CB . 16450 1
659 . 1 1 84 84 LYS CG C 13 24.687 0.000 . 1 . . . . 84 Lys CG . 16450 1
660 . 1 1 84 84 LYS N N 15 123.057 0.097 . 1 . . . . 84 Lys N . 16450 1
661 . 1 1 85 85 GLU H H 1 8.345 0.004 . 1 . . . . 85 Glu H . 16450 1
662 . 1 1 85 85 GLU HA H 1 4.246 0.003 . 1 . . . . 85 Glu HA . 16450 1
663 . 1 1 85 85 GLU HB2 H 1 1.967 0.013 . 1 . . . . 85 Glu HB2 . 16450 1
664 . 1 1 85 85 GLU HB3 H 1 1.967 0.013 . 1 . . . . 85 Glu HB3 . 16450 1
665 . 1 1 85 85 GLU HG2 H 1 2.265 0.003 . 1 . . . . 85 Glu HG2 . 16450 1
666 . 1 1 85 85 GLU HG3 H 1 2.263 0.004 . 1 . . . . 85 Glu HG3 . 16450 1
667 . 1 1 85 85 GLU C C 13 176.475 0.001 . 1 . . . . 85 Glu C . 16450 1
668 . 1 1 85 85 GLU CA C 13 56.842 0.000 . 1 . . . . 85 Glu CA . 16450 1
669 . 1 1 85 85 GLU CB C 13 30.267 0.000 . 1 . . . . 85 Glu CB . 16450 1
670 . 1 1 85 85 GLU CG C 13 36.687 0.000 . 1 . . . . 85 Glu CG . 16450 1
671 . 1 1 85 85 GLU N N 15 121.335 0.103 . 1 . . . . 85 Glu N . 16450 1
672 . 1 1 86 86 LYS H H 1 8.267 0.004 . 1 . . . . 86 Lys H . 16450 1
673 . 1 1 86 86 LYS HA H 1 4.302 0.004 . 1 . . . . 86 Lys HA . 16450 1
674 . 1 1 86 86 LYS HB2 H 1 1.851 0.005 . 1 . . . . 86 Lys HB2 . 16450 1
675 . 1 1 86 86 LYS HB3 H 1 1.851 0.005 . 1 . . . . 86 Lys HB3 . 16450 1
676 . 1 1 86 86 LYS HD2 H 1 1.683 0.003 . 1 . . . . 86 Lys HD2 . 16450 1
677 . 1 1 86 86 LYS HD3 H 1 1.683 0.003 . 1 . . . . 86 Lys HD3 . 16450 1
678 . 1 1 86 86 LYS HG2 H 1 1.426 0.006 . 1 . . . . 86 Lys HG2 . 16450 1
679 . 1 1 86 86 LYS HG3 H 1 1.426 0.006 . 1 . . . . 86 Lys HG3 . 16450 1
680 . 1 1 86 86 LYS C C 13 176.712 0.004 . 1 . . . . 86 Lys C . 16450 1
681 . 1 1 86 86 LYS CA C 13 56.657 0.015 . 1 . . . . 86 Lys CA . 16450 1
682 . 1 1 86 86 LYS CB C 13 32.967 0.000 . 1 . . . . 86 Lys CB . 16450 1
683 . 1 1 86 86 LYS CD C 13 28.414 0.000 . 1 . . . . 86 Lys CD . 16450 1
684 . 1 1 86 86 LYS CG C 13 24.687 0.000 . 1 . . . . 86 Lys CG . 16450 1
685 . 1 1 86 86 LYS N N 15 121.951 0.114 . 1 . . . . 86 Lys N . 16450 1
686 . 1 1 87 87 ILE H H 1 8.088 0.004 . 1 . . . . 87 Ile H . 16450 1
687 . 1 1 87 87 ILE HA H 1 4.106 0.002 . 1 . . . . 87 Ile HA . 16450 1
688 . 1 1 87 87 ILE HB H 1 1.879 0.012 . 1 . . . . 87 Ile HB . 16450 1
689 . 1 1 87 87 ILE HG12 H 1 0.897 0.008 . 1 . . . . 87 Ile HG12 . 16450 1
690 . 1 1 87 87 ILE HG13 H 1 0.897 0.008 . 1 . . . . 87 Ile HG13 . 16450 1
691 . 1 1 87 87 ILE HG21 H 1 0.965 0.000 . 1 . . . . 87 Ile HG21 . 16450 1
692 . 1 1 87 87 ILE HG22 H 1 0.965 0.000 . 1 . . . . 87 Ile HG22 . 16450 1
693 . 1 1 87 87 ILE HG23 H 1 0.965 0.000 . 1 . . . . 87 Ile HG23 . 16450 1
694 . 1 1 87 87 ILE C C 13 176.325 0.006 . 1 . . . . 87 Ile C . 16450 1
695 . 1 1 87 87 ILE CA C 13 61.612 0.017 . 1 . . . . 87 Ile CA . 16450 1
696 . 1 1 87 87 ILE CB C 13 38.566 0.021 . 1 . . . . 87 Ile CB . 16450 1
697 . 1 1 87 87 ILE CG2 C 13 20.000 0.000 . 1 . . . . 87 Ile CG2 . 16450 1
698 . 1 1 87 87 ILE N N 15 122.061 0.054 . 1 . . . . 87 Ile N . 16450 1
699 . 1 1 88 88 LYS H H 1 8.311 0.002 . 1 . . . . 88 Lys H . 16450 1
700 . 1 1 88 88 LYS HA H 1 4.296 0.003 . 1 . . . . 88 Lys HA . 16450 1
701 . 1 1 88 88 LYS HB2 H 1 1.707 0.021 . 1 . . . . 88 Lys HB2 . 16450 1
702 . 1 1 88 88 LYS HB3 H 1 1.716 0.017 . 1 . . . . 88 Lys HB3 . 16450 1
703 . 1 1 88 88 LYS HD3 H 1 1.443 0.005 . 1 . . . . 88 Lys HD3 . 16450 1
704 . 1 1 88 88 LYS HE2 H 1 2.995 0.005 . 1 . . . . 88 Lys HE2 . 16450 1
705 . 1 1 88 88 LYS HE3 H 1 2.995 0.005 . 1 . . . . 88 Lys HE3 . 16450 1
706 . 1 1 88 88 LYS HG2 H 1 1.443 0.004 . 1 . . . . 88 Lys HG2 . 16450 1
707 . 1 1 88 88 LYS HG3 H 1 1.444 0.000 . 1 . . . . 88 Lys HG3 . 16450 1
708 . 1 1 88 88 LYS C C 13 176.432 0.000 . 1 . . . . 88 Lys C . 16450 1
709 . 1 1 88 88 LYS CA C 13 56.752 0.071 . 1 . . . . 88 Lys CA . 16450 1
710 . 1 1 88 88 LYS CB C 13 32.943 0.019 . 1 . . . . 88 Lys CB . 16450 1
711 . 1 1 88 88 LYS CG C 13 24.753 0.065 . 1 . . . . 88 Lys CG . 16450 1
712 . 1 1 88 88 LYS N N 15 125.124 0.050 . 1 . . . . 88 Lys N . 16450 1
713 . 1 1 89 89 GLU H H 1 8.402 0.003 . 1 . . . . 89 Glu H . 16450 1
714 . 1 1 89 89 GLU HA H 1 4.450 0.015 . 1 . . . . 89 Glu HA . 16450 1
715 . 1 1 89 89 GLU HB2 H 1 2.113 0.005 . 1 . . . . 89 Glu HB2 . 16450 1
716 . 1 1 89 89 GLU HB3 H 1 2.113 0.005 . 1 . . . . 89 Glu HB3 . 16450 1
717 . 1 1 89 89 GLU HG2 H 1 2.372 0.001 . 1 . . . . 89 Glu HG2 . 16450 1
718 . 1 1 89 89 GLU HG3 H 1 2.372 0.001 . 1 . . . . 89 Glu HG3 . 16450 1
719 . 1 1 89 89 GLU C C 13 176.068 0.026 . 1 . . . . 89 Glu C . 16450 1
720 . 1 1 89 89 GLU CA C 13 56.207 0.002 . 1 . . . . 89 Glu CA . 16450 1
721 . 1 1 89 89 GLU CB C 13 29.211 0.000 . 1 . . . . 89 Glu CB . 16450 1
722 . 1 1 89 89 GLU CG C 13 32.930 0.000 . 1 . . . . 89 Glu CG . 16450 1
723 . 1 1 89 89 GLU N N 15 121.205 0.056 . 1 . . . . 89 Glu N . 16450 1
724 . 1 1 90 90 ARG H H 1 8.391 0.002 . 1 . . . . 90 Arg H . 16450 1
725 . 1 1 90 90 ARG HA H 1 4.302 0.016 . 1 . . . . 90 Arg HA . 16450 1
726 . 1 1 90 90 ARG HB2 H 1 1.778 0.015 . 1 . . . . 90 Arg HB2 . 16450 1
727 . 1 1 90 90 ARG HB3 H 1 1.778 0.015 . 1 . . . . 90 Arg HB3 . 16450 1
728 . 1 1 90 90 ARG HD2 H 1 3.185 0.015 . 1 . . . . 90 Arg HD2 . 16450 1
729 . 1 1 90 90 ARG HD3 H 1 3.189 0.015 . 1 . . . . 90 Arg HD3 . 16450 1
730 . 1 1 90 90 ARG HG2 H 1 1.678 0.000 . 1 . . . . 90 Arg HG2 . 16450 1
731 . 1 1 90 90 ARG HG3 H 1 1.678 0.000 . 1 . . . . 90 Arg HG3 . 16450 1
732 . 1 1 90 90 ARG C C 13 175.911 0.000 . 1 . . . . 90 Arg C . 16450 1
733 . 1 1 90 90 ARG CA C 13 56.082 0.000 . 1 . . . . 90 Arg CA . 16450 1
734 . 1 1 90 90 ARG CB C 13 30.750 0.000 . 1 . . . . 90 Arg CB . 16450 1
735 . 1 1 90 90 ARG CD C 13 42.930 0.000 . 1 . . . . 90 Arg CD . 16450 1
736 . 1 1 90 90 ARG N N 15 122.802 0.049 . 1 . . . . 90 Arg N . 16450 1
737 . 1 1 91 91 ILE H H 1 8.209 0.004 . 1 . . . . 91 Ile H . 16450 1
738 . 1 1 91 91 ILE HA H 1 4.482 0.015 . 1 . . . . 91 Ile HA . 16450 1
739 . 1 1 91 91 ILE HB H 1 1.878 0.007 . 1 . . . . 91 Ile HB . 16450 1
740 . 1 1 91 91 ILE HD11 H 1 0.899 0.000 . 1 . . . . 91 Ile HD11 . 16450 1
741 . 1 1 91 91 ILE HD12 H 1 0.899 0.000 . 1 . . . . 91 Ile HD12 . 16450 1
742 . 1 1 91 91 ILE HD13 H 1 0.899 0.000 . 1 . . . . 91 Ile HD13 . 16450 1
743 . 1 1 91 91 ILE HG12 H 1 0.947 0.003 . 1 . . . . 91 Ile HG12 . 16450 1
744 . 1 1 91 91 ILE HG13 H 1 0.948 0.004 . 1 . . . . 91 Ile HG13 . 16450 1
745 . 1 1 91 91 ILE C C 13 174.580 0.000 . 1 . . . . 91 Ile C . 16450 1
746 . 1 1 91 91 ILE CA C 13 58.668 0.000 . 1 . . . . 91 Ile CA . 16450 1
747 . 1 1 91 91 ILE CB C 13 38.674 0.006 . 1 . . . . 91 Ile CB . 16450 1
748 . 1 1 91 91 ILE CD1 C 13 12.730 0.000 . 1 . . . . 91 Ile CD1 . 16450 1
749 . 1 1 91 91 ILE CG2 C 13 16.730 0.000 . 1 . . . . 91 Ile CG2 . 16450 1
750 . 1 1 91 91 ILE N N 15 124.029 0.030 . 1 . . . . 91 Ile N . 16450 1
751 . 1 1 92 92 PRO HA H 1 4.323 0.000 . 1 . . . . 92 Pro HA . 16450 1
752 . 1 1 92 92 PRO HB2 H 1 2.358 0.000 . 1 . . . . 92 Pro HB2 . 16450 1
753 . 1 1 92 92 PRO HB3 H 1 2.358 0.000 . 1 . . . . 92 Pro HB3 . 16450 1
754 . 1 1 92 92 PRO C C 13 177.550 0.000 . 1 . . . . 92 Pro C . 16450 1
755 . 1 1 92 92 PRO CA C 13 63.648 0.000 . 1 . . . . 92 Pro CA . 16450 1
756 . 1 1 92 92 PRO CB C 13 32.170 0.090 . 1 . . . . 92 Pro CB . 16450 1
757 . 1 1 93 93 GLY H H 1 8.509 0.003 . 1 . . . . 93 Gly H . 16450 1
758 . 1 1 93 93 GLY HA2 H 1 3.960 0.000 . 1 . . . . 93 Gly HA2 . 16450 1
759 . 1 1 93 93 GLY HA3 H 1 3.960 0.000 . 1 . . . . 93 Gly HA3 . 16450 1
760 . 1 1 93 93 GLY C C 13 174.346 0.001 . 1 . . . . 93 Gly C . 16450 1
761 . 1 1 93 93 GLY CA C 13 45.342 0.000 . 1 . . . . 93 Gly CA . 16450 1
762 . 1 1 93 93 GLY N N 15 109.603 0.134 . 1 . . . . 93 Gly N . 16450 1
763 . 1 1 94 94 MET H H 1 8.189 0.002 . 1 . . . . 94 Met H . 16450 1
764 . 1 1 94 94 MET HA H 1 4.441 0.007 . 1 . . . . 94 Met HA . 16450 1
765 . 1 1 94 94 MET HB2 H 1 2.059 0.005 . 1 . . . . 94 Met HB2 . 16450 1
766 . 1 1 94 94 MET HB3 H 1 2.059 0.005 . 1 . . . . 94 Met HB3 . 16450 1
767 . 1 1 94 94 MET HG2 H 1 2.559 0.014 . 1 . . . . 94 Met HG2 . 16450 1
768 . 1 1 94 94 MET HG3 H 1 2.559 0.014 . 1 . . . . 94 Met HG3 . 16450 1
769 . 1 1 94 94 MET C C 13 176.815 0.009 . 1 . . . . 94 Met C . 16450 1
770 . 1 1 94 94 MET CA C 13 55.964 0.008 . 1 . . . . 94 Met CA . 16450 1
771 . 1 1 94 94 MET CB C 13 32.863 0.001 . 1 . . . . 94 Met CB . 16450 1
772 . 1 1 94 94 MET CG C 13 32.260 0.000 . 1 . . . . 94 Met CG . 16450 1
773 . 1 1 94 94 MET N N 15 119.739 0.068 . 1 . . . . 94 Met N . 16450 1
774 . 1 1 95 95 GLY H H 1 8.528 0.003 . 1 . . . . 95 Gly H . 16450 1
775 . 1 1 95 95 GLY HA2 H 1 3.987 0.000 . 1 . . . . 95 Gly HA2 . 16450 1
776 . 1 1 95 95 GLY HA3 H 1 3.987 0.000 . 1 . . . . 95 Gly HA3 . 16450 1
777 . 1 1 95 95 GLY C C 13 173.994 0.003 . 1 . . . . 95 Gly C . 16450 1
778 . 1 1 95 95 GLY CA C 13 45.374 0.035 . 1 . . . . 95 Gly CA . 16450 1
779 . 1 1 95 95 GLY N N 15 110.252 0.123 . 1 . . . . 95 Gly N . 16450 1
780 . 1 1 96 96 ARG H H 1 8.221 0.006 . 1 . . . . 96 Arg H . 16450 1
781 . 1 1 96 96 ARG HA H 1 4.344 0.012 . 1 . . . . 96 Arg HA . 16450 1
782 . 1 1 96 96 ARG HB2 H 1 1.771 0.013 . 1 . . . . 96 Arg HB2 . 16450 1
783 . 1 1 96 96 ARG HB3 H 1 1.771 0.013 . 1 . . . . 96 Arg HB3 . 16450 1
784 . 1 1 96 96 ARG HD2 H 1 3.191 0.006 . 1 . . . . 96 Arg HD2 . 16450 1
785 . 1 1 96 96 ARG HD3 H 1 3.192 0.005 . 1 . . . . 96 Arg HD3 . 16450 1
786 . 1 1 96 96 ARG C C 13 176.642 0.000 . 1 . . . . 96 Arg C . 16450 1
787 . 1 1 96 96 ARG CA C 13 56.250 0.000 . 1 . . . . 96 Arg CA . 16450 1
788 . 1 1 96 96 ARG CB C 13 31.019 0.000 . 1 . . . . 96 Arg CB . 16450 1
789 . 1 1 96 96 ARG CD C 13 43.490 0.000 . 1 . . . . 96 Arg CD . 16450 1
790 . 1 1 96 96 ARG N N 15 120.782 0.087 . 1 . . . . 96 Arg N . 16450 1
791 . 1 1 97 97 LYS H H 1 8.507 0.002 . 1 . . . . 97 Lys H . 16450 1
792 . 1 1 97 97 LYS HA H 1 4.283 0.002 . 1 . . . . 97 Lys HA . 16450 1
793 . 1 1 97 97 LYS HB2 H 1 1.938 0.010 . 1 . . . . 97 Lys HB2 . 16450 1
794 . 1 1 97 97 LYS HB3 H 1 1.938 0.010 . 1 . . . . 97 Lys HB3 . 16450 1
795 . 1 1 97 97 LYS HD2 H 1 1.765 0.000 . 1 . . . . 97 Lys HD2 . 16450 1
796 . 1 1 97 97 LYS HD3 H 1 1.765 0.000 . 1 . . . . 97 Lys HD3 . 16450 1
797 . 1 1 97 97 LYS HE2 H 1 2.996 0.007 . 1 . . . . 97 Lys HE2 . 16450 1
798 . 1 1 97 97 LYS HE3 H 1 2.995 0.006 . 1 . . . . 97 Lys HE3 . 16450 1
799 . 1 1 97 97 LYS HG2 H 1 1.468 0.011 . 1 . . . . 97 Lys HG2 . 16450 1
800 . 1 1 97 97 LYS HG3 H 1 1.471 0.012 . 1 . . . . 97 Lys HG3 . 16450 1
801 . 1 1 97 97 LYS C C 13 173.988 0.000 . 1 . . . . 97 Lys C . 16450 1
802 . 1 1 97 97 LYS CA C 13 56.758 0.000 . 1 . . . . 97 Lys CA . 16450 1
803 . 1 1 97 97 LYS CB C 13 32.978 0.000 . 1 . . . . 97 Lys CB . 16450 1
804 . 1 1 97 97 LYS CE C 13 42.080 0.000 . 1 . . . . 97 Lys CE . 16450 1
805 . 1 1 97 97 LYS CG C 13 24.880 0.000 . 1 . . . . 97 Lys CG . 16450 1
806 . 1 1 97 97 LYS N N 15 123.115 0.065 . 1 . . . . 97 Lys N . 16450 1
807 . 1 1 100 100 GLN H H 1 8.570 0.007 . 1 . . . . 100 Gln H . 16450 1
808 . 1 1 100 100 GLN HA H 1 4.296 0.009 . 1 . . . . 100 Gln HA . 16450 1
809 . 1 1 100 100 GLN HB2 H 1 1.925 0.005 . 1 . . . . 100 Gln HB2 . 16450 1
810 . 1 1 100 100 GLN HB3 H 1 1.925 0.005 . 1 . . . . 100 Gln HB3 . 16450 1
811 . 1 1 100 100 GLN HG2 H 1 2.338 0.015 . 1 . . . . 100 Gln HG2 . 16450 1
812 . 1 1 100 100 GLN HG3 H 1 2.328 0.002 . 1 . . . . 100 Gln HG3 . 16450 1
813 . 1 1 100 100 GLN C C 13 176.239 0.009 . 1 . . . . 100 Gln C . 16450 1
814 . 1 1 100 100 GLN CA C 13 56.768 0.068 . 1 . . . . 100 Gln CA . 16450 1
815 . 1 1 100 100 GLN CB C 13 30.337 0.057 . 1 . . . . 100 Gln CB . 16450 1
816 . 1 1 100 100 GLN CG C 13 35.710 0.000 . 1 . . . . 100 Gln CG . 16450 1
817 . 1 1 100 100 GLN N N 15 123.167 0.045 . 1 . . . . 100 Gln N . 16450 1
818 . 1 1 101 101 LYS H H 1 8.459 0.004 . 1 . . . . 101 Lys H . 16450 1
819 . 1 1 101 101 LYS HA H 1 4.289 0.010 . 1 . . . . 101 Lys HA . 16450 1
820 . 1 1 101 101 LYS HB3 H 1 2.013 0.000 . 1 . . . . 101 Lys HB3 . 16450 1
821 . 1 1 101 101 LYS HD2 H 1 1.999 0.000 . 1 . . . . 101 Lys HD2 . 16450 1
822 . 1 1 101 101 LYS HD3 H 1 2.006 0.007 . 1 . . . . 101 Lys HD3 . 16450 1
823 . 1 1 101 101 LYS C C 13 176.481 0.000 . 1 . . . . 101 Lys C . 16450 1
824 . 1 1 101 101 LYS CA C 13 56.492 0.000 . 1 . . . . 101 Lys CA . 16450 1
825 . 1 1 101 101 LYS CB C 13 32.977 0.000 . 1 . . . . 101 Lys CB . 16450 1
826 . 1 1 101 101 LYS N N 15 123.322 0.054 . 1 . . . . 101 Lys N . 16450 1
827 . 1 1 102 102 GLN H H 1 8.472 0.003 . 1 . . . . 102 Gln H . 16450 1
828 . 1 1 102 102 GLN HA H 1 4.313 0.003 . 1 . . . . 102 Gln HA . 16450 1
829 . 1 1 102 102 GLN HB2 H 1 2.044 0.007 . 1 . . . . 102 Gln HB2 . 16450 1
830 . 1 1 102 102 GLN HB3 H 1 2.042 0.006 . 1 . . . . 102 Gln HB3 . 16450 1
831 . 1 1 102 102 GLN HG2 H 1 2.355 0.011 . 1 . . . . 102 Gln HG2 . 16450 1
832 . 1 1 102 102 GLN HG3 H 1 2.350 0.004 . 1 . . . . 102 Gln HG3 . 16450 1
833 . 1 1 102 102 GLN C C 13 176.242 0.010 . 1 . . . . 102 Gln C . 16450 1
834 . 1 1 102 102 GLN CA C 13 56.047 0.020 . 1 . . . . 102 Gln CA . 16450 1
835 . 1 1 102 102 GLN CB C 13 29.667 0.000 . 1 . . . . 102 Gln CB . 16450 1
836 . 1 1 102 102 GLN CG C 13 33.320 0.000 . 1 . . . . 102 Gln CG . 16450 1
837 . 1 1 102 102 GLN N N 15 121.852 0.052 . 1 . . . . 102 Gln N . 16450 1
838 . 1 1 103 103 THR H H 1 8.274 0.004 . 1 . . . . 103 Thr H . 16450 1
839 . 1 1 103 103 THR HA H 1 4.391 0.005 . 1 . . . . 103 Thr HA . 16450 1
840 . 1 1 103 103 THR HB H 1 4.229 0.011 . 1 . . . . 103 Thr HB . 16450 1
841 . 1 1 103 103 THR HG21 H 1 1.212 0.008 . 1 . . . . 103 Thr HG21 . 16450 1
842 . 1 1 103 103 THR HG22 H 1 1.212 0.008 . 1 . . . . 103 Thr HG22 . 16450 1
843 . 1 1 103 103 THR HG23 H 1 1.212 0.008 . 1 . . . . 103 Thr HG23 . 16450 1
844 . 1 1 103 103 THR C C 13 174.588 0.000 . 1 . . . . 103 Thr C . 16450 1
845 . 1 1 103 103 THR CA C 13 61.482 1.005 . 1 . . . . 103 Thr CA . 16450 1
846 . 1 1 103 103 THR CB C 13 68.891 1.502 . 1 . . . . 103 Thr CB . 16450 1
847 . 1 1 103 103 THR CG2 C 13 21.910 0.000 . 1 . . . . 103 Thr CG2 . 16450 1
848 . 1 1 103 103 THR N N 15 115.871 0.052 . 1 . . . . 103 Thr N . 16450 1
849 . 1 1 104 104 SER H H 1 8.364 0.009 . 1 . . . . 104 Ser H . 16450 1
850 . 1 1 104 104 SER HA H 1 4.556 0.000 . 1 . . . . 104 Ser HA . 16450 1
851 . 1 1 104 104 SER HB2 H 1 3.889 0.000 . 1 . . . . 104 Ser HB2 . 16450 1
852 . 1 1 104 104 SER HB3 H 1 3.889 0.000 . 1 . . . . 104 Ser HB3 . 16450 1
853 . 1 1 104 104 SER C C 13 174.319 0.000 . 1 . . . . 104 Ser C . 16450 1
854 . 1 1 104 104 SER CA C 13 58.496 0.000 . 1 . . . . 104 Ser CA . 16450 1
855 . 1 1 104 104 SER CB C 13 63.994 0.009 . 1 . . . . 104 Ser CB . 16450 1
856 . 1 1 104 104 SER N N 15 118.157 0.054 . 1 . . . . 104 Ser N . 16450 1
857 . 1 1 105 105 ALA H H 1 8.420 0.004 . 1 . . . . 105 Ala H . 16450 1
858 . 1 1 105 105 ALA HA H 1 4.376 0.000 . 1 . . . . 105 Ala HA . 16450 1
859 . 1 1 105 105 ALA HB1 H 1 1.448 0.000 . 1 . . . . 105 Ala HB1 . 16450 1
860 . 1 1 105 105 ALA HB2 H 1 1.448 0.000 . 1 . . . . 105 Ala HB2 . 16450 1
861 . 1 1 105 105 ALA HB3 H 1 1.448 0.000 . 1 . . . . 105 Ala HB3 . 16450 1
862 . 1 1 105 105 ALA C C 13 177.940 0.004 . 1 . . . . 105 Ala C . 16450 1
863 . 1 1 105 105 ALA CA C 13 52.815 0.021 . 1 . . . . 105 Ala CA . 16450 1
864 . 1 1 105 105 ALA CB C 13 19.264 0.040 . 1 . . . . 105 Ala CB . 16450 1
865 . 1 1 105 105 ALA N N 15 126.118 0.070 . 1 . . . . 105 Ala N . 16450 1
866 . 1 1 106 106 THR H H 1 8.111 0.003 . 1 . . . . 106 Thr H . 16450 1
867 . 1 1 106 106 THR HA H 1 4.391 0.004 . 1 . . . . 106 Thr HA . 16450 1
868 . 1 1 106 106 THR HB H 1 4.265 0.011 . 1 . . . . 106 Thr HB . 16450 1
869 . 1 1 106 106 THR HG21 H 1 1.210 0.007 . 1 . . . . 106 Thr HG21 . 16450 1
870 . 1 1 106 106 THR HG22 H 1 1.210 0.007 . 1 . . . . 106 Thr HG22 . 16450 1
871 . 1 1 106 106 THR HG23 H 1 1.210 0.007 . 1 . . . . 106 Thr HG23 . 16450 1
872 . 1 1 106 106 THR C C 13 174.528 0.000 . 1 . . . . 106 Thr C . 16450 1
873 . 1 1 106 106 THR CA C 13 61.987 0.000 . 1 . . . . 106 Thr CA . 16450 1
874 . 1 1 106 106 THR CB C 13 69.941 0.000 . 1 . . . . 106 Thr CB . 16450 1
875 . 1 1 106 106 THR CG2 C 13 21.910 0.000 . 1 . . . . 106 Thr CG2 . 16450 1
876 . 1 1 106 106 THR N N 15 112.744 0.052 . 1 . . . . 106 Thr N . 16450 1
877 . 1 1 107 107 SER H H 1 8.258 0.003 . 1 . . . . 107 Ser H . 16450 1
878 . 1 1 107 107 SER HA H 1 4.648 0.012 . 1 . . . . 107 Ser HA . 16450 1
879 . 1 1 107 107 SER HB2 H 1 3.898 0.005 . 1 . . . . 107 Ser HB2 . 16450 1
880 . 1 1 107 107 SER HB3 H 1 3.898 0.005 . 1 . . . . 107 Ser HB3 . 16450 1
881 . 1 1 107 107 SER C C 13 174.209 0.000 . 1 . . . . 107 Ser C . 16450 1
882 . 1 1 107 107 SER CA C 13 58.279 0.000 . 1 . . . . 107 Ser CA . 16450 1
883 . 1 1 107 107 SER CB C 13 64.040 0.000 . 1 . . . . 107 Ser CB . 16450 1
884 . 1 1 107 107 SER N N 15 118.317 0.043 . 1 . . . . 107 Ser N . 16450 1
885 . 1 1 108 108 THR H H 1 8.250 0.002 . 1 . . . . 108 Thr H . 16450 1
886 . 1 1 108 108 THR HA H 1 4.648 0.004 . 1 . . . . 108 Thr HA . 16450 1
887 . 1 1 108 108 THR HB H 1 4.160 0.011 . 1 . . . . 108 Thr HB . 16450 1
888 . 1 1 108 108 THR HG21 H 1 1.233 0.011 . 1 . . . . 108 Thr HG21 . 16450 1
889 . 1 1 108 108 THR HG22 H 1 1.233 0.011 . 1 . . . . 108 Thr HG22 . 16450 1
890 . 1 1 108 108 THR HG23 H 1 1.233 0.011 . 1 . . . . 108 Thr HG23 . 16450 1
891 . 1 1 108 108 THR C C 13 172.916 0.000 . 1 . . . . 108 Thr C . 16450 1
892 . 1 1 108 108 THR CA C 13 59.962 0.000 . 1 . . . . 108 Thr CA . 16450 1
893 . 1 1 108 108 THR CB C 13 69.920 0.000 . 1 . . . . 108 Thr CB . 16450 1
894 . 1 1 108 108 THR CG2 C 13 20.080 0.000 . 1 . . . . 108 Thr CG2 . 16450 1
895 . 1 1 108 108 THR N N 15 118.307 0.053 . 1 . . . . 108 Thr N . 16450 1
896 . 1 1 109 109 PRO HA H 1 4.396 0.000 . 1 . . . . 109 Pro HA . 16450 1
897 . 1 1 109 109 PRO HB2 H 1 2.313 0.006 . 1 . . . . 109 Pro HB2 . 16450 1
898 . 1 1 109 109 PRO HB3 H 1 2.313 0.006 . 1 . . . . 109 Pro HB3 . 16450 1
899 . 1 1 109 109 PRO C C 13 177.598 0.004 . 1 . . . . 109 Pro C . 16450 1
900 . 1 1 109 109 PRO CA C 13 63.824 0.000 . 1 . . . . 109 Pro CA . 16450 1
901 . 1 1 109 109 PRO CB C 13 32.213 0.009 . 1 . . . . 109 Pro CB . 16450 1
902 . 1 1 110 110 GLY H H 1 8.508 0.003 . 1 . . . . 110 Gly H . 16450 1
903 . 1 1 110 110 GLY HA2 H 1 3.956 0.000 . 1 . . . . 110 Gly HA2 . 16450 1
904 . 1 1 110 110 GLY HA3 H 1 3.956 0.000 . 1 . . . . 110 Gly HA3 . 16450 1
905 . 1 1 110 110 GLY C C 13 174.352 0.023 . 1 . . . . 110 Gly C . 16450 1
906 . 1 1 110 110 GLY CA C 13 45.362 0.045 . 1 . . . . 110 Gly CA . 16450 1
907 . 1 1 110 110 GLY N N 15 109.509 0.058 . 1 . . . . 110 Gly N . 16450 1
908 . 1 1 111 111 GLN H H 1 8.207 0.003 . 1 . . . . 111 Gln H . 16450 1
909 . 1 1 111 111 GLN HA H 1 4.333 0.019 . 1 . . . . 111 Gln HA . 16450 1
910 . 1 1 111 111 GLN HB2 H 1 2.063 0.000 . 1 . . . . 111 Gln HB2 . 16450 1
911 . 1 1 111 111 GLN HB3 H 1 2.064 0.001 . 1 . . . . 111 Gln HB3 . 16450 1
912 . 1 1 111 111 GLN HG2 H 1 2.389 0.009 . 1 . . . . 111 Gln HG2 . 16450 1
913 . 1 1 111 111 GLN HG3 H 1 2.389 0.009 . 1 . . . . 111 Gln HG3 . 16450 1
914 . 1 1 111 111 GLN C C 13 176.753 0.009 . 1 . . . . 111 Gln C . 16450 1
915 . 1 1 111 111 GLN CA C 13 56.070 0.000 . 1 . . . . 111 Gln CA . 16450 1
916 . 1 1 111 111 GLN CB C 13 29.459 0.021 . 1 . . . . 111 Gln CB . 16450 1
917 . 1 1 111 111 GLN CG C 13 33.080 0.000 . 1 . . . . 111 Gln CG . 16450 1
918 . 1 1 111 111 GLN N N 15 119.814 0.054 . 1 . . . . 111 Gln N . 16450 1
919 . 1 1 112 112 GLY H H 1 8.538 0.002 . 1 . . . . 112 Gly H . 16450 1
920 . 1 1 112 112 GLY HA2 H 1 3.962 0.000 . 1 . . . . 112 Gly HA2 . 16450 1
921 . 1 1 112 112 GLY HA3 H 1 3.962 0.000 . 1 . . . . 112 Gly HA3 . 16450 1
922 . 1 1 112 112 GLY C C 13 174.322 0.003 . 1 . . . . 112 Gly C . 16450 1
923 . 1 1 112 112 GLY CA C 13 45.445 0.000 . 1 . . . . 112 Gly CA . 16450 1
924 . 1 1 112 112 GLY N N 15 110.152 0.061 . 1 . . . . 112 Gly N . 16450 1
925 . 1 1 113 113 GLN H H 1 8.274 0.003 . 1 . . . . 113 Gln H . 16450 1
926 . 1 1 113 113 GLN HA H 1 4.348 0.005 . 1 . . . . 113 Gln HA . 16450 1
927 . 1 1 113 113 GLN HB2 H 1 2.043 0.007 . 1 . . . . 113 Gln HB2 . 16450 1
928 . 1 1 113 113 GLN HB3 H 1 2.043 0.007 . 1 . . . . 113 Gln HB3 . 16450 1
929 . 1 1 113 113 GLN HG2 H 1 2.338 0.000 . 1 . . . . 113 Gln HG2 . 16450 1
930 . 1 1 113 113 GLN HG3 H 1 2.338 0.000 . 1 . . . . 113 Gln HG3 . 16450 1
931 . 1 1 113 113 GLN C C 13 176.266 0.007 . 1 . . . . 113 Gln C . 16450 1
932 . 1 1 113 113 GLN CA C 13 56.228 0.010 . 1 . . . . 113 Gln CA . 16450 1
933 . 1 1 113 113 GLN CB C 13 29.412 0.018 . 1 . . . . 113 Gln CB . 16450 1
934 . 1 1 113 113 GLN CG C 13 33.320 0.000 . 1 . . . . 113 Gln CG . 16450 1
935 . 1 1 113 113 GLN N N 15 119.893 0.072 . 1 . . . . 113 Gln N . 16450 1
936 . 1 1 114 114 GLN H H 1 8.478 0.004 . 1 . . . . 114 Gln H . 16450 1
937 . 1 1 114 114 GLN HA H 1 4.331 0.015 . 1 . . . . 114 Gln HA . 16450 1
938 . 1 1 114 114 GLN HB2 H 1 2.072 0.025 . 1 . . . . 114 Gln HB2 . 16450 1
939 . 1 1 114 114 GLN HB3 H 1 2.072 0.025 . 1 . . . . 114 Gln HB3 . 16450 1
940 . 1 1 114 114 GLN HG2 H 1 2.381 0.015 . 1 . . . . 114 Gln HG2 . 16450 1
941 . 1 1 114 114 GLN HG3 H 1 2.381 0.015 . 1 . . . . 114 Gln HG3 . 16450 1
942 . 1 1 114 114 GLN C C 13 176.114 0.002 . 1 . . . . 114 Gln C . 16450 1
943 . 1 1 114 114 GLN CA C 13 56.178 0.000 . 1 . . . . 114 Gln CA . 16450 1
944 . 1 1 114 114 GLN CB C 13 29.366 0.000 . 1 . . . . 114 Gln CB . 16450 1
945 . 1 1 114 114 GLN CG C 13 33.910 0.000 . 1 . . . . 114 Gln CG . 16450 1
946 . 1 1 114 114 GLN N N 15 121.429 0.052 . 1 . . . . 114 Gln N . 16450 1
947 . 1 1 115 115 GLN H H 1 8.422 0.002 . 1 . . . . 115 Gln H . 16450 1
948 . 1 1 115 115 GLN HA H 1 4.314 0.009 . 1 . . . . 115 Gln HA . 16450 1
949 . 1 1 115 115 GLN HB2 H 1 2.029 0.010 . 1 . . . . 115 Gln HB2 . 16450 1
950 . 1 1 115 115 GLN HB3 H 1 2.029 0.010 . 1 . . . . 115 Gln HB3 . 16450 1
951 . 1 1 115 115 GLN HG2 H 1 2.333 0.000 . 1 . . . . 115 Gln HG2 . 16450 1
952 . 1 1 115 115 GLN HG3 H 1 2.333 0.000 . 1 . . . . 115 Gln HG3 . 16450 1
953 . 1 1 115 115 GLN C C 13 176.069 0.039 . 1 . . . . 115 Gln C . 16450 1
954 . 1 1 115 115 GLN CA C 13 56.209 0.001 . 1 . . . . 115 Gln CA . 16450 1
955 . 1 1 115 115 GLN CB C 13 29.335 0.002 . 1 . . . . 115 Gln CB . 16450 1
956 . 1 1 115 115 GLN CG C 13 33.910 0.000 . 1 . . . . 115 Gln CG . 16450 1
957 . 1 1 115 115 GLN N N 15 121.758 0.056 . 1 . . . . 115 Gln N . 16450 1
958 . 1 1 116 116 LYS H H 1 8.387 0.003 . 1 . . . . 116 Lys H . 16450 1
959 . 1 1 116 116 LYS HA H 1 4.301 0.018 . 1 . . . . 116 Lys HA . 16450 1
960 . 1 1 116 116 LYS HB2 H 1 1.681 0.001 . 1 . . . . 116 Lys HB2 . 16450 1
961 . 1 1 116 116 LYS HB3 H 1 1.684 0.006 . 1 . . . . 116 Lys HB3 . 16450 1
962 . 1 1 116 116 LYS HD2 H 1 1.599 0.216 . 1 . . . . 116 Lys HD2 . 16450 1
963 . 1 1 116 116 LYS HD3 H 1 1.599 0.216 . 1 . . . . 116 Lys HD3 . 16450 1
964 . 1 1 116 116 LYS HE2 H 1 3.002 0.001 . 1 . . . . 116 Lys HE2 . 16450 1
965 . 1 1 116 116 LYS HE3 H 1 3.002 0.001 . 1 . . . . 116 Lys HE3 . 16450 1
966 . 1 1 116 116 LYS HG2 H 1 1.451 0.000 . 1 . . . . 116 Lys HG2 . 16450 1
967 . 1 1 116 116 LYS HG3 H 1 1.451 0.000 . 1 . . . . 116 Lys HG3 . 16450 1
968 . 1 1 116 116 LYS C C 13 177.181 0.005 . 1 . . . . 116 Lys C . 16450 1
969 . 1 1 116 116 LYS CA C 13 56.634 0.014 . 1 . . . . 116 Lys CA . 16450 1
970 . 1 1 116 116 LYS CB C 13 33.012 0.003 . 1 . . . . 116 Lys CB . 16450 1
971 . 1 1 116 116 LYS CG C 13 24.490 0.000 . 1 . . . . 116 Lys CG . 16450 1
972 . 1 1 116 116 LYS N N 15 122.791 0.057 . 1 . . . . 116 Lys N . 16450 1
973 . 1 1 117 117 GLY H H 1 8.489 0.003 . 1 . . . . 117 Gly H . 16450 1
974 . 1 1 117 117 GLY HA2 H 1 3.949 0.000 . 1 . . . . 117 Gly HA2 . 16450 1
975 . 1 1 117 117 GLY HA3 H 1 3.949 0.000 . 1 . . . . 117 Gly HA3 . 16450 1
976 . 1 1 117 117 GLY C C 13 174.337 0.000 . 1 . . . . 117 Gly C . 16450 1
977 . 1 1 117 117 GLY CA C 13 45.221 0.000 . 1 . . . . 117 Gly CA . 16450 1
978 . 1 1 117 117 GLY N N 15 109.911 0.059 . 1 . . . . 117 Gly N . 16450 1
979 . 1 1 118 118 MET H H 1 8.183 0.003 . 1 . . . . 118 Met H . 16450 1
980 . 1 1 118 118 MET HA H 1 4.488 0.014 . 1 . . . . 118 Met HA . 16450 1
981 . 1 1 118 118 MET HB2 H 1 2.075 0.017 . 1 . . . . 118 Met HB2 . 16450 1
982 . 1 1 118 118 MET HB3 H 1 2.075 0.017 . 1 . . . . 118 Met HB3 . 16450 1
983 . 1 1 118 118 MET HG2 H 1 2.598 0.011 . 1 . . . . 118 Met HG2 . 16450 1
984 . 1 1 118 118 MET HG3 H 1 2.598 0.011 . 1 . . . . 118 Met HG3 . 16450 1
985 . 1 1 118 118 MET C C 13 176.824 0.000 . 1 . . . . 118 Met C . 16450 1
986 . 1 1 118 118 MET CA C 13 55.808 0.000 . 1 . . . . 118 Met CA . 16450 1
987 . 1 1 118 118 MET CB C 13 32.930 0.000 . 1 . . . . 118 Met CB . 16450 1
988 . 1 1 118 118 MET CG C 13 31.910 0.000 . 1 . . . . 118 Met CG . 16450 1
989 . 1 1 118 118 MET N N 15 119.713 0.059 . 1 . . . . 118 Met N . 16450 1
990 . 1 1 119 119 MET H H 1 8.396 0.003 . 1 . . . . 119 Met H . 16450 1
991 . 1 1 119 119 MET HA H 1 4.368 0.001 . 1 . . . . 119 Met HA . 16450 1
992 . 1 1 119 119 MET HB2 H 1 2.072 0.021 . 1 . . . . 119 Met HB2 . 16450 1
993 . 1 1 119 119 MET HB3 H 1 2.072 0.021 . 1 . . . . 119 Met HB3 . 16450 1
994 . 1 1 119 119 MET HG2 H 1 2.360 0.011 . 1 . . . . 119 Met HG2 . 16450 1
995 . 1 1 119 119 MET HG3 H 1 2.360 0.011 . 1 . . . . 119 Met HG3 . 16450 1
996 . 1 1 119 119 MET C C 13 176.365 0.008 . 1 . . . . 119 Met C . 16450 1
997 . 1 1 119 119 MET CA C 13 55.811 0.000 . 1 . . . . 119 Met CA . 16450 1
998 . 1 1 119 119 MET CB C 13 32.646 0.000 . 1 . . . . 119 Met CB . 16450 1
999 . 1 1 119 119 MET CG C 13 32.646 0.000 . 1 . . . . 119 Met CG . 16450 1
1000 . 1 1 119 119 MET N N 15 120.956 0.055 . 1 . . . . 119 Met N . 16450 1
1001 . 1 1 120 120 GLU H H 1 8.344 0.003 . 1 . . . . 120 Glu H . 16450 1
1002 . 1 1 120 120 GLU HA H 1 4.231 0.005 . 1 . . . . 120 Glu HA . 16450 1
1003 . 1 1 120 120 GLU HB2 H 1 1.969 0.006 . 1 . . . . 120 Glu HB2 . 16450 1
1004 . 1 1 120 120 GLU HB3 H 1 1.969 0.006 . 1 . . . . 120 Glu HB3 . 16450 1
1005 . 1 1 120 120 GLU HG2 H 1 2.261 0.005 . 1 . . . . 120 Glu HG2 . 16450 1
1006 . 1 1 120 120 GLU HG3 H 1 2.261 0.005 . 1 . . . . 120 Glu HG3 . 16450 1
1007 . 1 1 120 120 GLU C C 13 176.467 0.007 . 1 . . . . 120 Glu C . 16450 1
1008 . 1 1 120 120 GLU CA C 13 56.991 0.000 . 1 . . . . 120 Glu CA . 16450 1
1009 . 1 1 120 120 GLU CB C 13 30.387 0.000 . 1 . . . . 120 Glu CB . 16450 1
1010 . 1 1 120 120 GLU CG C 13 36.330 0.000 . 1 . . . . 120 Glu CG . 16450 1
1011 . 1 1 120 120 GLU N N 15 121.961 0.052 . 1 . . . . 120 Glu N . 16450 1
1012 . 1 1 121 121 LYS H H 1 8.265 0.003 . 1 . . . . 121 Lys H . 16450 1
1013 . 1 1 121 121 LYS HA H 1 4.303 0.009 . 1 . . . . 121 Lys HA . 16450 1
1014 . 1 1 121 121 LYS HB2 H 1 1.583 0.173 . 1 . . . . 121 Lys HB2 . 16450 1
1015 . 1 1 121 121 LYS HB3 H 1 1.583 0.173 . 1 . . . . 121 Lys HB3 . 16450 1
1016 . 1 1 121 121 LYS C C 13 176.493 0.000 . 1 . . . . 121 Lys C . 16450 1
1017 . 1 1 121 121 LYS CA C 13 56.470 0.000 . 1 . . . . 121 Lys CA . 16450 1
1018 . 1 1 121 121 LYS CB C 13 32.672 0.000 . 1 . . . . 121 Lys CB . 16450 1
1019 . 1 1 121 121 LYS N N 15 122.300 0.042 . 1 . . . . 121 Lys N . 16450 1
1020 . 1 1 122 122 ILE H H 1 8.171 0.012 . 1 . . . . 122 Ile H . 16450 1
1021 . 1 1 122 122 ILE HA H 1 4.112 0.004 . 1 . . . . 122 Ile HA . 16450 1
1022 . 1 1 122 122 ILE HB H 1 1.858 0.003 . 1 . . . . 122 Ile HB . 16450 1
1023 . 1 1 122 122 ILE HD11 H 1 0.866 0.002 . 1 . . . . 122 Ile HD11 . 16450 1
1024 . 1 1 122 122 ILE HD12 H 1 0.866 0.002 . 1 . . . . 122 Ile HD12 . 16450 1
1025 . 1 1 122 122 ILE HD13 H 1 0.866 0.002 . 1 . . . . 122 Ile HD13 . 16450 1
1026 . 1 1 122 122 ILE HG12 H 1 0.862 0.001 . 1 . . . . 122 Ile HG12 . 16450 1
1027 . 1 1 122 122 ILE HG13 H 1 0.862 0.001 . 1 . . . . 122 Ile HG13 . 16450 1
1028 . 1 1 122 122 ILE C C 13 176.177 0.006 . 1 . . . . 122 Ile C . 16450 1
1029 . 1 1 122 122 ILE CA C 13 61.310 0.037 . 1 . . . . 122 Ile CA . 16450 1
1030 . 1 1 122 122 ILE CB C 13 38.732 0.031 . 1 . . . . 122 Ile CB . 16450 1
1031 . 1 1 122 122 ILE CD1 C 13 12.730 0.000 . 1 . . . . 122 Ile CD1 . 16450 1
1032 . 1 1 122 122 ILE CG1 C 13 25.200 0.000 . 1 . . . . 122 Ile CG1 . 16450 1
1033 . 1 1 122 122 ILE CG2 C 13 17.400 0.000 . 1 . . . . 122 Ile CG2 . 16450 1
1034 . 1 1 122 122 ILE N N 15 122.897 0.014 . 1 . . . . 122 Ile N . 16450 1
1035 . 1 1 123 123 LYS H H 1 8.402 0.002 . 1 . . . . 123 Lys H . 16450 1
1036 . 1 1 123 123 LYS HA H 1 4.305 0.009 . 1 . . . . 123 Lys HA . 16450 1
1037 . 1 1 123 123 LYS HB2 H 1 1.805 0.018 . 1 . . . . 123 Lys HB2 . 16450 1
1038 . 1 1 123 123 LYS HB3 H 1 1.805 0.018 . 1 . . . . 123 Lys HB3 . 16450 1
1039 . 1 1 123 123 LYS HD2 H 1 1.695 0.000 . 1 . . . . 123 Lys HD2 . 16450 1
1040 . 1 1 123 123 LYS HD3 H 1 1.695 0.000 . 1 . . . . 123 Lys HD3 . 16450 1
1041 . 1 1 123 123 LYS HE2 H 1 3.004 0.000 . 1 . . . . 123 Lys HE2 . 16450 1
1042 . 1 1 123 123 LYS HE3 H 1 3.004 0.000 . 1 . . . . 123 Lys HE3 . 16450 1
1043 . 1 1 123 123 LYS HG2 H 1 1.416 0.003 . 1 . . . . 123 Lys HG2 . 16450 1
1044 . 1 1 123 123 LYS HG3 H 1 1.416 0.003 . 1 . . . . 123 Lys HG3 . 16450 1
1045 . 1 1 123 123 LYS C C 13 176.292 0.000 . 1 . . . . 123 Lys C . 16450 1
1046 . 1 1 123 123 LYS CA C 13 56.427 0.000 . 1 . . . . 123 Lys CA . 16450 1
1047 . 1 1 123 123 LYS CB C 13 32.953 0.000 . 1 . . . . 123 Lys CB . 16450 1
1048 . 1 1 123 123 LYS CD C 13 29.157 0.000 . 1 . . . . 123 Lys CD . 16450 1
1049 . 1 1 123 123 LYS CG C 13 24.490 0.000 . 1 . . . . 123 Lys CG . 16450 1
1050 . 1 1 123 123 LYS N N 15 126.032 0.055 . 1 . . . . 123 Lys N . 16450 1
1051 . 1 1 124 124 GLU H H 1 8.360 0.003 . 1 . . . . 124 Glu H . 16450 1
1052 . 1 1 124 124 GLU HA H 1 4.262 0.015 . 1 . . . . 124 Glu HA . 16450 1
1053 . 1 1 124 124 GLU HB2 H 1 1.924 0.012 . 1 . . . . 124 Glu HB2 . 16450 1
1054 . 1 1 124 124 GLU HB3 H 1 1.924 0.012 . 1 . . . . 124 Glu HB3 . 16450 1
1055 . 1 1 124 124 GLU HG2 H 1 2.257 0.003 . 1 . . . . 124 Glu HG2 . 16450 1
1056 . 1 1 124 124 GLU HG3 H 1 2.257 0.003 . 1 . . . . 124 Glu HG3 . 16450 1
1057 . 1 1 124 124 GLU C C 13 176.128 0.000 . 1 . . . . 124 Glu C . 16450 1
1058 . 1 1 124 124 GLU CA C 13 56.921 0.000 . 1 . . . . 124 Glu CA . 16450 1
1059 . 1 1 124 124 GLU CB C 13 30.592 0.000 . 1 . . . . 124 Glu CB . 16450 1
1060 . 1 1 124 124 GLU CG C 13 36.250 0.000 . 1 . . . . 124 Glu CG . 16450 1
1061 . 1 1 124 124 GLU N N 15 122.707 0.041 . 1 . . . . 124 Glu N . 16450 1
1062 . 1 1 125 125 LYS H H 1 8.300 0.002 . 1 . . . . 125 Lys H . 16450 1
1063 . 1 1 125 125 LYS HA H 1 4.294 0.007 . 1 . . . . 125 Lys HA . 16450 1
1064 . 1 1 125 125 LYS HB3 H 1 1.781 0.020 . 1 . . . . 125 Lys HB3 . 16450 1
1065 . 1 1 125 125 LYS HD2 H 1 1.830 0.000 . 1 . . . . 125 Lys HD2 . 16450 1
1066 . 1 1 125 125 LYS HD3 H 1 1.830 0.000 . 1 . . . . 125 Lys HD3 . 16450 1
1067 . 1 1 125 125 LYS HG2 H 1 1.418 0.007 . 1 . . . . 125 Lys HG2 . 16450 1
1068 . 1 1 125 125 LYS HG3 H 1 1.418 0.007 . 1 . . . . 125 Lys HG3 . 16450 1
1069 . 1 1 125 125 LYS C C 13 176.613 0.000 . 1 . . . . 125 Lys C . 16450 1
1070 . 1 1 125 125 LYS CA C 13 56.321 0.000 . 1 . . . . 125 Lys CA . 16450 1
1071 . 1 1 125 125 LYS CB C 13 33.041 0.000 . 1 . . . . 125 Lys CB . 16450 1
1072 . 1 1 125 125 LYS CG C 13 24.490 0.000 . 1 . . . . 125 Lys CG . 16450 1
1073 . 1 1 125 125 LYS N N 15 122.668 0.057 . 1 . . . . 125 Lys N . 16450 1
1074 . 1 1 126 126 LEU H H 1 8.283 0.004 . 1 . . . . 126 Leu H . 16450 1
1075 . 1 1 126 126 LEU HA H 1 4.594 0.000 . 1 . . . . 126 Leu HA . 16450 1
1076 . 1 1 126 126 LEU HB2 H 1 1.595 0.013 . 1 . . . . 126 Leu HB2 . 16450 1
1077 . 1 1 126 126 LEU HB3 H 1 1.595 0.013 . 1 . . . . 126 Leu HB3 . 16450 1
1078 . 1 1 126 126 LEU HD11 H 1 0.914 0.013 . 1 . . . . 126 Leu HD11 . 16450 1
1079 . 1 1 126 126 LEU HD12 H 1 0.914 0.013 . 1 . . . . 126 Leu HD12 . 16450 1
1080 . 1 1 126 126 LEU HD13 H 1 0.914 0.013 . 1 . . . . 126 Leu HD13 . 16450 1
1081 . 1 1 126 126 LEU HD21 H 1 0.912 0.012 . 1 . . . . 126 Leu HD21 . 16450 1
1082 . 1 1 126 126 LEU HD22 H 1 0.912 0.012 . 1 . . . . 126 Leu HD22 . 16450 1
1083 . 1 1 126 126 LEU HD23 H 1 0.912 0.012 . 1 . . . . 126 Leu HD23 . 16450 1
1084 . 1 1 126 126 LEU HG H 1 1.626 0.014 . 1 . . . . 126 Leu HG . 16450 1
1085 . 1 1 126 126 LEU C C 13 175.289 0.000 . 1 . . . . 126 Leu C . 16450 1
1086 . 1 1 126 126 LEU CA C 13 53.106 0.000 . 1 . . . . 126 Leu CA . 16450 1
1087 . 1 1 126 126 LEU CB C 13 41.546 0.000 . 1 . . . . 126 Leu CB . 16450 1
1088 . 1 1 126 126 LEU CD1 C 13 24.000 0.000 . 1 . . . . 126 Leu CD1 . 16450 1
1089 . 1 1 126 126 LEU CD2 C 13 24.000 0.000 . 1 . . . . 126 Leu CD2 . 16450 1
1090 . 1 1 126 126 LEU CG C 13 27.010 0.000 . 1 . . . . 126 Leu CG . 16450 1
1091 . 1 1 126 126 LEU N N 15 125.258 0.095 . 1 . . . . 126 Leu N . 16450 1
1092 . 1 1 127 127 PRO HA H 1 4.440 0.019 . 1 . . . . 127 Pro HA . 16450 1
1093 . 1 1 127 127 PRO HB2 H 1 2.301 0.003 . 1 . . . . 127 Pro HB2 . 16450 1
1094 . 1 1 127 127 PRO HB3 H 1 2.307 0.010 . 1 . . . . 127 Pro HB3 . 16450 1
1095 . 1 1 127 127 PRO HG2 H 1 2.071 0.001 . 1 . . . . 127 Pro HG2 . 16450 1
1096 . 1 1 127 127 PRO HG3 H 1 2.071 0.001 . 1 . . . . 127 Pro HG3 . 16450 1
1097 . 1 1 127 127 PRO C C 13 175.341 0.000 . 1 . . . . 127 Pro C . 16450 1
1098 . 1 1 127 127 PRO CA C 13 63.646 0.000 . 1 . . . . 127 Pro CA . 16450 1
1099 . 1 1 127 127 PRO CB C 13 32.017 0.010 . 1 . . . . 127 Pro CB . 16450 1
1100 . 1 1 128 128 GLY H H 1 8.486 0.007 . 1 . . . . 128 Gly H . 16450 1
1101 . 1 1 128 128 GLY HA2 H 1 3.950 0.000 . 1 . . . . 128 Gly HA2 . 16450 1
1102 . 1 1 128 128 GLY HA3 H 1 3.950 0.000 . 1 . . . . 128 Gly HA3 . 16450 1
1103 . 1 1 128 128 GLY C C 13 173.705 0.005 . 1 . . . . 128 Gly C . 16450 1
1104 . 1 1 128 128 GLY CA C 13 45.325 0.000 . 1 . . . . 128 Gly CA . 16450 1
1105 . 1 1 128 128 GLY N N 15 109.986 0.206 . 1 . . . . 128 Gly N . 16450 1
1106 . 1 1 129 129 ALA H H 1 7.986 0.004 . 1 . . . . 129 Ala H . 16450 1
1107 . 1 1 129 129 ALA HA H 1 4.336 0.010 . 1 . . . . 129 Ala HA . 16450 1
1108 . 1 1 129 129 ALA HB1 H 1 1.371 0.002 . 1 . . . . 129 Ala HB1 . 16450 1
1109 . 1 1 129 129 ALA HB2 H 1 1.371 0.002 . 1 . . . . 129 Ala HB2 . 16450 1
1110 . 1 1 129 129 ALA HB3 H 1 1.371 0.002 . 1 . . . . 129 Ala HB3 . 16450 1
1111 . 1 1 129 129 ALA C C 13 176.805 0.000 . 1 . . . . 129 Ala C . 16450 1
1112 . 1 1 129 129 ALA CA C 13 52.496 0.007 . 1 . . . . 129 Ala CA . 16450 1
1113 . 1 1 129 129 ALA CB C 13 19.455 0.036 . 1 . . . . 129 Ala CB . 16450 1
1114 . 1 1 129 129 ALA N N 15 123.903 0.044 . 1 . . . . 129 Ala N . 16450 1
1115 . 1 1 130 130 HIS H H 1 7.999 0.010 . 1 . . . . 130 His H . 16450 1
1116 . 1 1 130 130 HIS HA H 1 4.456 0.004 . 1 . . . . 130 His HA . 16450 1
1117 . 1 1 130 130 HIS HB2 H 1 3.153 0.005 . 1 . . . . 130 His HB2 . 16450 1
1118 . 1 1 130 130 HIS HB3 H 1 3.153 0.005 . 1 . . . . 130 His HB3 . 16450 1
1119 . 1 1 130 130 HIS C C 13 170.981 0.000 . 1 . . . . 130 His C . 16450 1
1120 . 1 1 130 130 HIS CA C 13 57.137 0.000 . 1 . . . . 130 His CA . 16450 1
1121 . 1 1 130 130 HIS CB C 13 30.340 0.003 . 1 . . . . 130 His CB . 16450 1
1122 . 1 1 130 130 HIS N N 15 123.062 0.093 . 1 . . . . 130 His N . 16450 1
stop_
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