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 25033
_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 '3D CBCA(CO)NH' . . . 25033 1
2 '3D HNCACB' . . . 25033 1
3 '3D HNCO' . . . 25033 1
4 '3D 1H-15N NOESY' . . . 25033 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 11 11 GLY C C 13 174.266 0.000 . . . . . A 11 GLY C . 25033 1
2 . 1 1 12 12 SER H H 1 8.422 0.018 . . . . . A 12 SER H . 25033 1
3 . 1 1 12 12 SER C C 13 175.271 0.000 . . . . . A 12 SER C . 25033 1
4 . 1 1 12 12 SER CA C 13 58.570 0.000 . . . . . A 12 SER CA . 25033 1
5 . 1 1 12 12 SER CB C 13 63.984 0.000 . . . . . A 12 SER CB . 25033 1
6 . 1 1 12 12 SER N N 15 116.112 0.141 . . . . . A 12 SER N . 25033 1
7 . 1 1 13 13 GLY H H 1 8.537 0.030 . . . . . A 13 GLY H . 25033 1
8 . 1 1 13 13 GLY HA2 H 1 4.750 0.022 . . . . . A 13 GLY HA2 . 25033 1
9 . 1 1 13 13 GLY HA3 H 1 3.996 0.000 . . . . . A 13 GLY HA3 . 25033 1
10 . 1 1 13 13 GLY C C 13 174.238 0.000 . . . . . A 13 GLY C . 25033 1
11 . 1 1 13 13 GLY CA C 13 45.520 0.000 . . . . . A 13 GLY CA . 25033 1
12 . 1 1 13 13 GLY N N 15 111.178 0.090 . . . . . A 13 GLY N . 25033 1
13 . 1 1 14 14 GLU H H 1 8.285 0.002 . . . . . A 14 GLU H . 25033 1
14 . 1 1 14 14 GLU HA H 1 4.267 0.004 . . . . . A 14 GLU HA . 25033 1
15 . 1 1 14 14 GLU HB2 H 1 1.915 0.001 . . . . . A 14 GLU HB2 . 25033 1
16 . 1 1 14 14 GLU HB3 H 1 2.050 0.000 . . . . . A 14 GLU HB3 . 25033 1
17 . 1 1 14 14 GLU HG2 H 1 2.248 0.000 . . . . . A 14 GLU HG2 . 25033 1
18 . 1 1 14 14 GLU HG3 H 1 2.248 0.000 . . . . . A 14 GLU HG3 . 25033 1
19 . 1 1 14 14 GLU C C 13 176.455 0.000 . . . . . A 14 GLU C . 25033 1
20 . 1 1 14 14 GLU CA C 13 56.753 0.000 . . . . . A 14 GLU CA . 25033 1
21 . 1 1 14 14 GLU CB C 13 30.464 0.007 . . . . . A 14 GLU CB . 25033 1
22 . 1 1 14 14 GLU CG C 13 36.110 0.000 . . . . . A 14 GLU CG . 25033 1
23 . 1 1 14 14 GLU N N 15 120.547 0.038 . . . . . A 14 GLU N . 25033 1
24 . 1 1 15 15 GLN H H 1 8.444 0.015 . . . . . A 15 GLN H . 25033 1
25 . 1 1 15 15 GLN HA H 1 4.349 0.000 . . . . . A 15 GLN HA . 25033 1
26 . 1 1 15 15 GLN HB2 H 1 1.966 0.001 . . . . . A 15 GLN HB2 . 25033 1
27 . 1 1 15 15 GLN HB3 H 1 2.090 0.000 . . . . . A 15 GLN HB3 . 25033 1
28 . 1 1 15 15 GLN HG2 H 1 2.355 0.001 . . . . . A 15 GLN HG2 . 25033 1
29 . 1 1 15 15 GLN HG3 H 1 2.355 0.001 . . . . . A 15 GLN HG3 . 25033 1
30 . 1 1 15 15 GLN HE21 H 1 7.614 0.004 . . . . . A 15 GLN HE21 . 25033 1
31 . 1 1 15 15 GLN HE22 H 1 6.924 0.004 . . . . . A 15 GLN HE22 . 25033 1
32 . 1 1 15 15 GLN C C 13 175.494 0.000 . . . . . A 15 GLN C . 25033 1
33 . 1 1 15 15 GLN CA C 13 55.670 0.000 . . . . . A 15 GLN CA . 25033 1
34 . 1 1 15 15 GLN CB C 13 29.410 0.000 . . . . . A 15 GLN CB . 25033 1
35 . 1 1 15 15 GLN CG C 13 33.760 0.000 . . . . . A 15 GLN CG . 25033 1
36 . 1 1 15 15 GLN N N 15 121.185 0.053 . . . . . A 15 GLN N . 25033 1
37 . 1 1 15 15 GLN NE2 N 15 112.743 0.032 . . . . . A 15 GLN NE2 . 25033 1
38 . 1 1 16 16 LEU H H 1 8.289 0.005 . . . . . A 16 LEU H . 25033 1
39 . 1 1 16 16 LEU HA H 1 4.341 0.001 . . . . . A 16 LEU HA . 25033 1
40 . 1 1 16 16 LEU HB2 H 1 1.600 0.000 . . . . . A 16 LEU HB2 . 25033 1
41 . 1 1 16 16 LEU HB3 H 1 1.600 0.000 . . . . . A 16 LEU HB3 . 25033 1
42 . 1 1 16 16 LEU HG H 1 1.565 0.000 . . . . . A 16 LEU HG . 25033 1
43 . 1 1 16 16 LEU HD11 H 1 0.846 0.002 . . . . . A 16 LEU HD11 . 25033 1
44 . 1 1 16 16 LEU HD12 H 1 0.846 0.002 . . . . . A 16 LEU HD12 . 25033 1
45 . 1 1 16 16 LEU HD13 H 1 0.846 0.002 . . . . . A 16 LEU HD13 . 25033 1
46 . 1 1 16 16 LEU HD21 H 1 0.904 0.000 . . . . . A 16 LEU HD21 . 25033 1
47 . 1 1 16 16 LEU HD22 H 1 0.904 0.000 . . . . . A 16 LEU HD22 . 25033 1
48 . 1 1 16 16 LEU HD23 H 1 0.904 0.000 . . . . . A 16 LEU HD23 . 25033 1
49 . 1 1 16 16 LEU C C 13 176.942 0.000 . . . . . A 16 LEU C . 25033 1
50 . 1 1 16 16 LEU CA C 13 55.504 0.010 . . . . . A 16 LEU CA . 25033 1
51 . 1 1 16 16 LEU CB C 13 42.519 0.000 . . . . . A 16 LEU CB . 25033 1
52 . 1 1 16 16 LEU CG C 13 27.285 0.000 . . . . . A 16 LEU CG . 25033 1
53 . 1 1 16 16 LEU CD1 C 13 24.111 0.006 . . . . . A 16 LEU CD1 . 25033 1
54 . 1 1 16 16 LEU CD2 C 13 24.700 0.000 . . . . . A 16 LEU CD2 . 25033 1
55 . 1 1 16 16 LEU N N 15 123.934 0.156 . . . . . A 16 LEU N . 25033 1
56 . 1 1 17 17 ARG H H 1 8.216 0.007 . . . . . A 17 ARG H . 25033 1
57 . 1 1 17 17 ARG HA H 1 4.464 0.000 . . . . . A 17 ARG HA . 25033 1
58 . 1 1 17 17 ARG HB2 H 1 1.586 0.000 . . . . . A 17 ARG HB2 . 25033 1
59 . 1 1 17 17 ARG HB3 H 1 1.656 0.001 . . . . . A 17 ARG HB3 . 25033 1
60 . 1 1 17 17 ARG HG2 H 1 1.825 0.001 . . . . . A 17 ARG HG2 . 25033 1
61 . 1 1 17 17 ARG HG3 H 1 1.825 0.001 . . . . . A 17 ARG HG3 . 25033 1
62 . 1 1 17 17 ARG HD2 H 1 3.175 0.001 . . . . . A 17 ARG HD2 . 25033 1
63 . 1 1 17 17 ARG HD3 H 1 3.175 0.001 . . . . . A 17 ARG HD3 . 25033 1
64 . 1 1 17 17 ARG C C 13 175.829 0.000 . . . . . A 17 ARG C . 25033 1
65 . 1 1 17 17 ARG CA C 13 55.672 0.000 . . . . . A 17 ARG CA . 25033 1
66 . 1 1 17 17 ARG CB C 13 29.830 0.000 . . . . . A 17 ARG CB . 25033 1
67 . 1 1 17 17 ARG CG C 13 30.573 0.000 . . . . . A 17 ARG CG . 25033 1
68 . 1 1 17 17 ARG CD C 13 43.453 0.000 . . . . . A 17 ARG CD . 25033 1
69 . 1 1 17 17 ARG N N 15 122.044 0.035 . . . . . A 17 ARG N . 25033 1
70 . 1 1 18 18 GLN H H 1 8.573 0.013 . . . . . A 18 GLN H . 25033 1
71 . 1 1 18 18 GLN HA H 1 4.334 0.001 . . . . . A 18 GLN HA . 25033 1
72 . 1 1 18 18 GLN HB2 H 1 1.593 0.000 . . . . . A 18 GLN HB2 . 25033 1
73 . 1 1 18 18 GLN HB3 H 1 1.635 0.000 . . . . . A 18 GLN HB3 . 25033 1
74 . 1 1 18 18 GLN HG2 H 1 1.941 0.001 . . . . . A 18 GLN HG2 . 25033 1
75 . 1 1 18 18 GLN HG3 H 1 1.941 0.001 . . . . . A 18 GLN HG3 . 25033 1
76 . 1 1 18 18 GLN C C 13 172.958 0.000 . . . . . A 18 GLN C . 25033 1
77 . 1 1 18 18 GLN CA C 13 54.900 0.000 . . . . . A 18 GLN CA . 25033 1
78 . 1 1 18 18 GLN CB C 13 32.620 0.000 . . . . . A 18 GLN CB . 25033 1
79 . 1 1 18 18 GLN CG C 13 33.760 0.000 . . . . . A 18 GLN CG . 25033 1
80 . 1 1 18 18 GLN N N 15 122.488 0.028 . . . . . A 18 GLN N . 25033 1
81 . 1 1 19 19 GLN H H 1 8.146 0.003 . . . . . A 19 GLN H . 25033 1
82 . 1 1 19 19 GLN HA H 1 5.378 0.000 . . . . . A 19 GLN HA . 25033 1
83 . 1 1 19 19 GLN HB2 H 1 2.347 0.000 . . . . . A 19 GLN HB2 . 25033 1
84 . 1 1 19 19 GLN HB3 H 1 2.347 0.000 . . . . . A 19 GLN HB3 . 25033 1
85 . 1 1 19 19 GLN HG2 H 1 1.979 0.000 . . . . . A 19 GLN HG2 . 25033 1
86 . 1 1 19 19 GLN HG3 H 1 2.025 0.000 . . . . . A 19 GLN HG3 . 25033 1
87 . 1 1 19 19 GLN HE21 H 1 7.546 0.002 . . . . . A 19 GLN HE21 . 25033 1
88 . 1 1 19 19 GLN HE22 H 1 6.846 0.002 . . . . . A 19 GLN HE22 . 25033 1
89 . 1 1 19 19 GLN C C 13 176.902 0.000 . . . . . A 19 GLN C . 25033 1
90 . 1 1 19 19 GLN CA C 13 54.215 0.001 . . . . . A 19 GLN CA . 25033 1
91 . 1 1 19 19 GLN CB C 13 34.638 0.000 . . . . . A 19 GLN CB . 25033 1
92 . 1 1 19 19 GLN CG C 13 32.595 0.000 . . . . . A 19 GLN CG . 25033 1
93 . 1 1 19 19 GLN N N 15 116.301 0.044 . . . . . A 19 GLN N . 25033 1
94 . 1 1 19 19 GLN NE2 N 15 111.880 0.031 . . . . . A 19 GLN NE2 . 25033 1
95 . 1 1 20 20 GLY H H 1 8.998 0.003 . . . . . A 20 GLY H . 25033 1
96 . 1 1 20 20 GLY HA2 H 1 4.000 0.005 . . . . . A 20 GLY HA2 . 25033 1
97 . 1 1 20 20 GLY HA3 H 1 4.589 0.000 . . . . . A 20 GLY HA3 . 25033 1
98 . 1 1 20 20 GLY C C 13 170.989 0.000 . . . . . A 20 GLY C . 25033 1
99 . 1 1 20 20 GLY CA C 13 45.935 0.000 . . . . . A 20 GLY CA . 25033 1
100 . 1 1 20 20 GLY N N 15 109.745 0.021 . . . . . A 20 GLY N . 25033 1
101 . 1 1 21 21 THR H H 1 8.312 0.007 . . . . . A 21 THR H . 25033 1
102 . 1 1 21 21 THR HA H 1 5.361 0.001 . . . . . A 21 THR HA . 25033 1
103 . 1 1 21 21 THR HB H 1 3.783 0.001 . . . . . A 21 THR HB . 25033 1
104 . 1 1 21 21 THR HG21 H 1 1.119 0.003 . . . . . A 21 THR HG21 . 25033 1
105 . 1 1 21 21 THR HG22 H 1 1.119 0.003 . . . . . A 21 THR HG22 . 25033 1
106 . 1 1 21 21 THR HG23 H 1 1.119 0.003 . . . . . A 21 THR HG23 . 25033 1
107 . 1 1 21 21 THR C C 13 174.553 0.000 . . . . . A 21 THR C . 25033 1
108 . 1 1 21 21 THR CA C 13 60.025 0.000 . . . . . A 21 THR CA . 25033 1
109 . 1 1 21 21 THR CB C 13 71.720 0.000 . . . . . A 21 THR CB . 25033 1
110 . 1 1 21 21 THR CG2 C 13 21.995 0.000 . . . . . A 21 THR CG2 . 25033 1
111 . 1 1 21 21 THR N N 15 112.645 0.139 . . . . . A 21 THR N . 25033 1
112 . 1 1 22 22 VAL H H 1 9.092 0.006 . . . . . A 22 VAL H . 25033 1
113 . 1 1 22 22 VAL HA H 1 3.649 0.002 . . . . . A 22 VAL HA . 25033 1
114 . 1 1 22 22 VAL HB H 1 2.448 0.001 . . . . . A 22 VAL HB . 25033 1
115 . 1 1 22 22 VAL HG11 H 1 0.520 0.001 . . . . . A 22 VAL HG11 . 25033 1
116 . 1 1 22 22 VAL HG12 H 1 0.520 0.001 . . . . . A 22 VAL HG12 . 25033 1
117 . 1 1 22 22 VAL HG13 H 1 0.520 0.001 . . . . . A 22 VAL HG13 . 25033 1
118 . 1 1 22 22 VAL HG21 H 1 0.869 0.000 . . . . . A 22 VAL HG21 . 25033 1
119 . 1 1 22 22 VAL HG22 H 1 0.869 0.000 . . . . . A 22 VAL HG22 . 25033 1
120 . 1 1 22 22 VAL HG23 H 1 0.869 0.000 . . . . . A 22 VAL HG23 . 25033 1
121 . 1 1 22 22 VAL C C 13 175.553 0.000 . . . . . A 22 VAL C . 25033 1
122 . 1 1 22 22 VAL CA C 13 64.618 0.000 . . . . . A 22 VAL CA . 25033 1
123 . 1 1 22 22 VAL CB C 13 31.621 0.000 . . . . . A 22 VAL CB . 25033 1
124 . 1 1 22 22 VAL CG1 C 13 21.120 0.000 . . . . . A 22 VAL CG1 . 25033 1
125 . 1 1 22 22 VAL CG2 C 13 24.283 0.000 . . . . . A 22 VAL CG2 . 25033 1
126 . 1 1 22 22 VAL N N 15 125.915 0.092 . . . . . A 22 VAL N . 25033 1
127 . 1 1 23 23 LYS H H 1 9.276 0.000 . . . . . A 23 LYS H . 25033 1
128 . 1 1 23 23 LYS HA H 1 4.301 0.000 . . . . . A 23 LYS HA . 25033 1
129 . 1 1 23 23 LYS HB2 H 1 1.940 0.004 . . . . . A 23 LYS HB2 . 25033 1
130 . 1 1 23 23 LYS HB3 H 1 1.940 0.004 . . . . . A 23 LYS HB3 . 25033 1
131 . 1 1 23 23 LYS HG2 H 1 1.557 0.000 . . . . . A 23 LYS HG2 . 25033 1
132 . 1 1 23 23 LYS HG3 H 1 1.557 0.000 . . . . . A 23 LYS HG3 . 25033 1
133 . 1 1 23 23 LYS HD2 H 1 1.610 0.001 . . . . . A 23 LYS HD2 . 25033 1
134 . 1 1 23 23 LYS HD3 H 1 1.610 0.001 . . . . . A 23 LYS HD3 . 25033 1
135 . 1 1 23 23 LYS HE2 H 1 3.032 0.000 . . . . . A 23 LYS HE2 . 25033 1
136 . 1 1 23 23 LYS HE3 H 1 3.032 0.000 . . . . . A 23 LYS HE3 . 25033 1
137 . 1 1 23 23 LYS C C 13 176.301 0.000 . . . . . A 23 LYS C . 25033 1
138 . 1 1 23 23 LYS CA C 13 58.610 0.000 . . . . . A 23 LYS CA . 25033 1
139 . 1 1 23 23 LYS CB C 13 34.300 0.000 . . . . . A 23 LYS CB . 25033 1
140 . 1 1 23 23 LYS CG C 13 24.960 0.000 . . . . . A 23 LYS CG . 25033 1
141 . 1 1 23 23 LYS CD C 13 29.230 0.000 . . . . . A 23 LYS CD . 25033 1
142 . 1 1 23 23 LYS CE C 13 41.580 0.000 . . . . . A 23 LYS CE . 25033 1
143 . 1 1 23 23 LYS N N 15 135.79 0.000 . . . . . A 23 LYS N . 25033 1
144 . 1 1 24 24 TRP H H 1 7.455 0.019 . . . . . A 24 TRP H . 25033 1
145 . 1 1 24 24 TRP HA H 1 4.623 0.001 . . . . . A 24 TRP HA . 25033 1
146 . 1 1 24 24 TRP HB2 H 1 3.502 0.002 . . . . . A 24 TRP HB2 . 25033 1
147 . 1 1 24 24 TRP HB3 H 1 3.428 0.002 . . . . . A 24 TRP HB3 . 25033 1
148 . 1 1 24 24 TRP HD1 H 1 7.145 0.008 . . . . . A 24 TRP HD1 . 25033 1
149 . 1 1 24 24 TRP HE1 H 1 10.322 0.012 . . . . . A 24 TRP HE1 . 25033 1
150 . 1 1 24 24 TRP HZ2 H 1 7.633 0.002 . . . . . A 24 TRP HZ2 . 25033 1
151 . 1 1 24 24 TRP C C 13 173.628 0.000 . . . . . A 24 TRP C . 25033 1
152 . 1 1 24 24 TRP CA C 13 56.300 0.000 . . . . . A 24 TRP CA . 25033 1
153 . 1 1 24 24 TRP CB C 13 31.260 0.000 . . . . . A 24 TRP CB . 25033 1
154 . 1 1 24 24 TRP CD1 C 13 128.052 0.073 . . . . . A 24 TRP CD1 . 25033 1
155 . 1 1 24 24 TRP CZ2 C 13 115.262 0.000 . . . . . A 24 TRP CZ2 . 25033 1
156 . 1 1 24 24 TRP N N 15 111.651 0.070 . . . . . A 24 TRP N . 25033 1
157 . 1 1 24 24 TRP NE1 N 15 130.159 0.119 . . . . . A 24 TRP NE1 . 25033 1
158 . 1 1 25 25 PHE H H 1 9.074 0.009 . . . . . A 25 PHE H . 25033 1
159 . 1 1 25 25 PHE HA H 1 4.285 0.001 . . . . . A 25 PHE HA . 25033 1
160 . 1 1 25 25 PHE HB2 H 1 2.800 0.007 . . . . . A 25 PHE HB2 . 25033 1
161 . 1 1 25 25 PHE HB3 H 1 2.427 0.003 . . . . . A 25 PHE HB3 . 25033 1
162 . 1 1 25 25 PHE HD1 H 1 6.744 0.001 . . . . . A 25 PHE HD1 . 25033 1
163 . 1 1 25 25 PHE HD2 H 1 6.744 0.001 . . . . . A 25 PHE HD2 . 25033 1
164 . 1 1 25 25 PHE HE1 H 1 7.486 0.000 . . . . . A 25 PHE HE1 . 25033 1
165 . 1 1 25 25 PHE HE2 H 1 7.486 0.000 . . . . . A 25 PHE HE2 . 25033 1
166 . 1 1 25 25 PHE C C 13 172.354 0.000 . . . . . A 25 PHE C . 25033 1
167 . 1 1 25 25 PHE CA C 13 59.372 0.000 . . . . . A 25 PHE CA . 25033 1
168 . 1 1 25 25 PHE CB C 13 42.569 0.000 . . . . . A 25 PHE CB . 25033 1
169 . 1 1 25 25 PHE CD2 C 13 131.693 0.087 . . . . . A 25 PHE CD2 . 25033 1
170 . 1 1 25 25 PHE CE2 C 13 131.768 0.002 . . . . . A 25 PHE CE2 . 25033 1
171 . 1 1 25 25 PHE N N 15 121.305 0.030 . . . . . A 25 PHE N . 25033 1
172 . 1 1 26 26 ASN H H 1 8.159 0.012 . . . . . A 26 ASN H . 25033 1
173 . 1 1 26 26 ASN HA H 1 4.812 0.001 . . . . . A 26 ASN HA . 25033 1
174 . 1 1 26 26 ASN HB2 H 1 2.536 0.002 . . . . . A 26 ASN HB2 . 25033 1
175 . 1 1 26 26 ASN HB3 H 1 2.457 0.002 . . . . . A 26 ASN HB3 . 25033 1
176 . 1 1 26 26 ASN CA C 13 51.412 0.000 . . . . . A 26 ASN CA . 25033 1
177 . 1 1 26 26 ASN CB C 13 39.086 0.000 . . . . . A 26 ASN CB . 25033 1
178 . 1 1 26 26 ASN N N 15 126.976 0.092 . . . . . A 26 ASN N . 25033 1
179 . 1 1 27 27 ALA H H 1 9.036 0.020 . . . . . A 27 ALA H . 25033 1
180 . 1 1 27 27 ALA HA H 1 4.121 0.000 . . . . . A 27 ALA HA . 25033 1
181 . 1 1 27 27 ALA HB1 H 1 1.660 0.000 . . . . . A 27 ALA HB1 . 25033 1
182 . 1 1 27 27 ALA HB2 H 1 1.660 0.000 . . . . . A 27 ALA HB2 . 25033 1
183 . 1 1 27 27 ALA HB3 H 1 1.660 0.000 . . . . . A 27 ALA HB3 . 25033 1
184 . 1 1 27 27 ALA C C 13 179.031 0.000 . . . . . A 27 ALA C . 25033 1
185 . 1 1 27 27 ALA CA C 13 54.425 0.000 . . . . . A 27 ALA CA . 25033 1
186 . 1 1 27 27 ALA CB C 13 18.374 0.000 . . . . . A 27 ALA CB . 25033 1
187 . 1 1 27 27 ALA N N 15 128.245 0.123 . . . . . A 27 ALA N . 25033 1
188 . 1 1 28 28 THR H H 1 8.065 0.004 . . . . . A 28 THR H . 25033 1
189 . 1 1 28 28 THR HA H 1 4.068 0.002 . . . . . A 28 THR HA . 25033 1
190 . 1 1 28 28 THR HB H 1 4.314 0.004 . . . . . A 28 THR HB . 25033 1
191 . 1 1 28 28 THR HG21 H 1 1.255 0.000 . . . . . A 28 THR HG21 . 25033 1
192 . 1 1 28 28 THR HG22 H 1 1.255 0.000 . . . . . A 28 THR HG22 . 25033 1
193 . 1 1 28 28 THR HG23 H 1 1.255 0.000 . . . . . A 28 THR HG23 . 25033 1
194 . 1 1 28 28 THR C C 13 176.084 0.000 . . . . . A 28 THR C . 25033 1
195 . 1 1 28 28 THR CA C 13 65.820 0.000 . . . . . A 28 THR CA . 25033 1
196 . 1 1 28 28 THR CB C 13 68.291 0.000 . . . . . A 28 THR CB . 25033 1
197 . 1 1 28 28 THR CG2 C 13 21.704 0.000 . . . . . A 28 THR CG2 . 25033 1
198 . 1 1 28 28 THR N N 15 113.994 0.190 . . . . . A 28 THR N . 25033 1
199 . 1 1 29 29 LYS H H 1 7.446 0.003 . . . . . A 29 LYS H . 25033 1
200 . 1 1 29 29 LYS HA H 1 4.256 0.001 . . . . . A 29 LYS HA . 25033 1
201 . 1 1 29 29 LYS HB2 H 1 1.097 0.001 . . . . . A 29 LYS HB2 . 25033 1
202 . 1 1 29 29 LYS HB3 H 1 1.834 0.001 . . . . . A 29 LYS HB3 . 25033 1
203 . 1 1 29 29 LYS HG2 H 1 1.374 0.003 . . . . . A 29 LYS HG2 . 25033 1
204 . 1 1 29 29 LYS HG3 H 1 1.433 0.001 . . . . . A 29 LYS HG3 . 25033 1
205 . 1 1 29 29 LYS HD2 H 1 1.599 0.000 . . . . . A 29 LYS HD2 . 25033 1
206 . 1 1 29 29 LYS HD3 H 1 1.599 0.000 . . . . . A 29 LYS HD3 . 25033 1
207 . 1 1 29 29 LYS HE2 H 1 3.006 0.000 . . . . . A 29 LYS HE2 . 25033 1
208 . 1 1 29 29 LYS HE3 H 1 3.048 0.000 . . . . . A 29 LYS HE3 . 25033 1
209 . 1 1 29 29 LYS C C 13 177.201 0.000 . . . . . A 29 LYS C . 25033 1
210 . 1 1 29 29 LYS CA C 13 56.888 0.000 . . . . . A 29 LYS CA . 25033 1
211 . 1 1 29 29 LYS CB C 13 33.740 0.000 . . . . . A 29 LYS CB . 25033 1
212 . 1 1 29 29 LYS CG C 13 25.912 0.000 . . . . . A 29 LYS CG . 25033 1
213 . 1 1 29 29 LYS CD C 13 29.243 0.000 . . . . . A 29 LYS CD . 25033 1
214 . 1 1 29 29 LYS CE C 13 42.229 0.000 . . . . . A 29 LYS CE . 25033 1
215 . 1 1 29 29 LYS N N 15 118.922 0.019 . . . . . A 29 LYS N . 25033 1
216 . 1 1 30 30 GLY H H 1 8.115 0.004 . . . . . A 30 GLY H . 25033 1
217 . 1 1 30 30 GLY HA2 H 1 3.608 0.000 . . . . . A 30 GLY HA2 . 25033 1
218 . 1 1 30 30 GLY HA3 H 1 3.987 0.007 . . . . . A 30 GLY HA3 . 25033 1
219 . 1 1 30 30 GLY C C 13 172.004 0.000 . . . . . A 30 GLY C . 25033 1
220 . 1 1 30 30 GLY CA C 13 46.404 0.000 . . . . . A 30 GLY CA . 25033 1
221 . 1 1 30 30 GLY N N 15 107.601 0.182 . . . . . A 30 GLY N . 25033 1
222 . 1 1 31 31 PHE H H 1 6.594 0.015 . . . . . A 31 PHE H . 25033 1
223 . 1 1 31 31 PHE HA H 1 5.007 0.002 . . . . . A 31 PHE HA . 25033 1
224 . 1 1 31 31 PHE HB2 H 1 2.832 0.007 . . . . . A 31 PHE HB2 . 25033 1
225 . 1 1 31 31 PHE HB3 H 1 2.832 0.007 . . . . . A 31 PHE HB3 . 25033 1
226 . 1 1 31 31 PHE HD1 H 1 6.907 0.001 . . . . . A 31 PHE HD1 . 25033 1
227 . 1 1 31 31 PHE HD2 H 1 6.907 0.001 . . . . . A 31 PHE HD2 . 25033 1
228 . 1 1 31 31 PHE HE1 H 1 7.552 0.000 . . . . . A 31 PHE HE1 . 25033 1
229 . 1 1 31 31 PHE HE2 H 1 7.552 0.000 . . . . . A 31 PHE HE2 . 25033 1
230 . 1 1 31 31 PHE CA C 13 55.278 0.000 . . . . . A 31 PHE CA . 25033 1
231 . 1 1 31 31 PHE CB C 13 42.388 0.000 . . . . . A 31 PHE CB . 25033 1
232 . 1 1 31 31 PHE CD1 C 13 132.476 0.008 . . . . . A 31 PHE CD1 . 25033 1
233 . 1 1 31 31 PHE CD2 C 13 132.476 0.000 . . . . . A 31 PHE CD2 . 25033 1
234 . 1 1 31 31 PHE CE1 C 13 131.264 0.000 . . . . . A 31 PHE CE1 . 25033 1
235 . 1 1 31 31 PHE CE2 C 13 131.264 0.000 . . . . . A 31 PHE CE2 . 25033 1
236 . 1 1 31 31 PHE N N 15 112.488 0.163 . . . . . A 31 PHE N . 25033 1
237 . 1 1 32 32 GLY H H 1 8.144 0.005 . . . . . A 32 GLY H . 25033 1
238 . 1 1 32 32 GLY HA2 H 1 3.935 0.000 . . . . . A 32 GLY HA2 . 25033 1
239 . 1 1 32 32 GLY HA3 H 1 2.968 0.000 . . . . . A 32 GLY HA3 . 25033 1
240 . 1 1 32 32 GLY C C 13 170.292 0.000 . . . . . A 32 GLY C . 25033 1
241 . 1 1 32 32 GLY CA C 13 45.369 0.000 . . . . . A 32 GLY CA . 25033 1
242 . 1 1 32 32 GLY N N 15 105.986 0.054 . . . . . A 32 GLY N . 25033 1
243 . 1 1 33 33 PHE H H 1 7.971 0.011 . . . . . A 33 PHE H . 25033 1
244 . 1 1 33 33 PHE HA H 1 5.463 0.002 . . . . . A 33 PHE HA . 25033 1
245 . 1 1 33 33 PHE HB2 H 1 2.211 0.001 . . . . . A 33 PHE HB2 . 25033 1
246 . 1 1 33 33 PHE HB3 H 1 2.614 0.000 . . . . . A 33 PHE HB3 . 25033 1
247 . 1 1 33 33 PHE C C 13 175.037 0.000 . . . . . A 33 PHE C . 25033 1
248 . 1 1 33 33 PHE CA C 13 56.295 0.000 . . . . . A 33 PHE CA . 25033 1
249 . 1 1 33 33 PHE CB C 13 44.792 0.000 . . . . . A 33 PHE CB . 25033 1
250 . 1 1 33 33 PHE N N 15 115.319 0.214 . . . . . A 33 PHE N . 25033 1
251 . 1 1 34 34 ILE H H 1 9.511 0.021 . . . . . A 34 ILE H . 25033 1
252 . 1 1 34 34 ILE HA H 1 4.317 0.001 . . . . . A 34 ILE HA . 25033 1
253 . 1 1 34 34 ILE HB H 1 1.011 0.001 . . . . . A 34 ILE HB . 25033 1
254 . 1 1 34 34 ILE HG12 H 1 0.493 0.000 . . . . . A 34 ILE HG12 . 25033 1
255 . 1 1 34 34 ILE HG13 H 1 1.210 0.000 . . . . . A 34 ILE HG13 . 25033 1
256 . 1 1 34 34 ILE HG21 H 1 0.209 0.003 . . . . . A 34 ILE HG21 . 25033 1
257 . 1 1 34 34 ILE HG22 H 1 0.209 0.003 . . . . . A 34 ILE HG22 . 25033 1
258 . 1 1 34 34 ILE HG23 H 1 0.209 0.003 . . . . . A 34 ILE HG23 . 25033 1
259 . 1 1 34 34 ILE HD11 H 1 0.150 0.002 . . . . . A 34 ILE HD11 . 25033 1
260 . 1 1 34 34 ILE HD12 H 1 0.150 0.002 . . . . . A 34 ILE HD12 . 25033 1
261 . 1 1 34 34 ILE HD13 H 1 0.150 0.002 . . . . . A 34 ILE HD13 . 25033 1
262 . 1 1 34 34 ILE C C 13 174.526 0.000 . . . . . A 34 ILE C . 25033 1
263 . 1 1 34 34 ILE CA C 13 59.797 0.000 . . . . . A 34 ILE CA . 25033 1
264 . 1 1 34 34 ILE CB C 13 42.583 0.000 . . . . . A 34 ILE CB . 25033 1
265 . 1 1 34 34 ILE CG1 C 13 28.106 0.000 . . . . . A 34 ILE CG1 . 25033 1
266 . 1 1 34 34 ILE CG2 C 13 17.509 0.000 . . . . . A 34 ILE CG2 . 25033 1
267 . 1 1 34 34 ILE CD1 C 13 14.601 0.000 . . . . . A 34 ILE CD1 . 25033 1
268 . 1 1 34 34 ILE N N 15 122.140 0.074 . . . . . A 34 ILE N . 25033 1
269 . 1 1 35 35 THR H H 1 9.416 0.023 . . . . . A 35 THR H . 25033 1
270 . 1 1 35 35 THR HA H 1 5.143 0.001 . . . . . A 35 THR HA . 25033 1
271 . 1 1 35 35 THR HB H 1 3.922 0.001 . . . . . A 35 THR HB . 25033 1
272 . 1 1 35 35 THR HG21 H 1 1.350 0.000 . . . . . A 35 THR HG21 . 25033 1
273 . 1 1 35 35 THR HG22 H 1 1.350 0.000 . . . . . A 35 THR HG22 . 25033 1
274 . 1 1 35 35 THR HG23 H 1 1.350 0.000 . . . . . A 35 THR HG23 . 25033 1
275 . 1 1 35 35 THR CA C 13 59.330 0.000 . . . . . A 35 THR CA . 25033 1
276 . 1 1 35 35 THR CB C 13 70.258 0.000 . . . . . A 35 THR CB . 25033 1
277 . 1 1 35 35 THR CG2 C 13 22.310 0.000 . . . . . A 35 THR CG2 . 25033 1
278 . 1 1 35 35 THR N N 15 126.580 0.072 . . . . . A 35 THR N . 25033 1
279 . 1 1 36 36 PRO HA H 1 4.599 0.000 . . . . . A 36 PRO HA . 25033 1
280 . 1 1 36 36 PRO HB2 H 1 2.292 0.000 . . . . . A 36 PRO HB2 . 25033 1
281 . 1 1 36 36 PRO HB3 H 1 2.411 0.000 . . . . . A 36 PRO HB3 . 25033 1
282 . 1 1 36 36 PRO HG2 H 1 1.933 0.000 . . . . . A 36 PRO HG2 . 25033 1
283 . 1 1 36 36 PRO HG3 H 1 2.065 0.000 . . . . . A 36 PRO HG3 . 25033 1
284 . 1 1 36 36 PRO HD2 H 1 3.725 0.000 . . . . . A 36 PRO HD2 . 25033 1
285 . 1 1 36 36 PRO HD3 H 1 4.204 0.000 . . . . . A 36 PRO HD3 . 25033 1
286 . 1 1 36 36 PRO C C 13 177.390 0.000 . . . . . A 36 PRO C . 25033 1
287 . 1 1 36 36 PRO CA C 13 63.220 0.000 . . . . . A 36 PRO CA . 25033 1
288 . 1 1 36 36 PRO CB C 13 32.470 0.000 . . . . . A 36 PRO CB . 25033 1
289 . 1 1 36 36 PRO CG C 13 27.580 0.000 . . . . . A 36 PRO CG . 25033 1
290 . 1 1 36 36 PRO CD C 13 52.690 0.000 . . . . . A 36 PRO CD . 25033 1
291 . 1 1 37 37 GLY H H 1 9.349 0.004 . . . . . A 37 GLY H . 25033 1
292 . 1 1 37 37 GLY HA2 H 1 3.602 0.001 . . . . . A 37 GLY HA2 . 25033 1
293 . 1 1 37 37 GLY HA3 H 1 3.995 0.000 . . . . . A 37 GLY HA3 . 25033 1
294 . 1 1 37 37 GLY C C 13 169.261 0.000 . . . . . A 37 GLY C . 25033 1
295 . 1 1 37 37 GLY CA C 13 46.457 0.000 . . . . . A 37 GLY CA . 25033 1
296 . 1 1 37 37 GLY N N 15 112.033 0.039 . . . . . A 37 GLY N . 25033 1
297 . 1 1 38 38 GLY H H 1 8.756 0.004 . . . . . A 38 GLY H . 25033 1
298 . 1 1 38 38 GLY C C 13 175.177 0.000 . . . . . A 38 GLY C . 25033 1
299 . 1 1 38 38 GLY N N 15 109.050 0.112 . . . . . A 38 GLY N . 25033 1
300 . 1 1 39 39 GLY H H 1 7.725 0.004 . . . . . A 39 GLY H . 25033 1
301 . 1 1 39 39 GLY HA2 H 1 3.995 0.001 . . . . . A 39 GLY HA2 . 25033 1
302 . 1 1 39 39 GLY HA3 H 1 4.556 0.000 . . . . . A 39 GLY HA3 . 25033 1
303 . 1 1 39 39 GLY C C 13 173.870 0.000 . . . . . A 39 GLY C . 25033 1
304 . 1 1 39 39 GLY CA C 13 44.258 0.000 . . . . . A 39 GLY CA . 25033 1
305 . 1 1 39 39 GLY N N 15 107.730 0.043 . . . . . A 39 GLY N . 25033 1
306 . 1 1 40 40 GLY H H 1 8.096 0.006 . . . . . A 40 GLY H . 25033 1
307 . 1 1 40 40 GLY HA2 H 1 4.227 0.001 . . . . . A 40 GLY HA2 . 25033 1
308 . 1 1 40 40 GLY HA3 H 1 3.923 0.001 . . . . . A 40 GLY HA3 . 25033 1
309 . 1 1 40 40 GLY C C 13 173.067 0.000 . . . . . A 40 GLY C . 25033 1
310 . 1 1 40 40 GLY CA C 13 43.760 0.000 . . . . . A 40 GLY CA . 25033 1
311 . 1 1 40 40 GLY N N 15 107.183 0.028 . . . . . A 40 GLY N . 25033 1
312 . 1 1 41 41 GLU H H 1 8.199 0.005 . . . . . A 41 GLU H . 25033 1
313 . 1 1 41 41 GLU HA H 1 4.178 0.000 . . . . . A 41 GLU HA . 25033 1
314 . 1 1 41 41 GLU HB2 H 1 1.985 0.001 . . . . . A 41 GLU HB2 . 25033 1
315 . 1 1 41 41 GLU HB3 H 1 2.102 0.003 . . . . . A 41 GLU HB3 . 25033 1
316 . 1 1 41 41 GLU HG2 H 1 2.414 0.000 . . . . . A 41 GLU HG2 . 25033 1
317 . 1 1 41 41 GLU HG3 H 1 2.414 0.000 . . . . . A 41 GLU HG3 . 25033 1
318 . 1 1 41 41 GLU C C 13 175.900 0.000 . . . . . A 41 GLU C . 25033 1
319 . 1 1 41 41 GLU CA C 13 56.377 0.000 . . . . . A 41 GLU CA . 25033 1
320 . 1 1 41 41 GLU CB C 13 30.600 0.000 . . . . . A 41 GLU CB . 25033 1
321 . 1 1 41 41 GLU CG C 13 36.543 0.000 . . . . . A 41 GLU CG . 25033 1
322 . 1 1 41 41 GLU N N 15 119.455 0.045 . . . . . A 41 GLU N . 25033 1
323 . 1 1 42 42 ASP H H 1 8.277 0.009 . . . . . A 42 ASP H . 25033 1
324 . 1 1 42 42 ASP HA H 1 4.857 0.004 . . . . . A 42 ASP HA . 25033 1
325 . 1 1 42 42 ASP HB2 H 1 2.411 0.002 . . . . . A 42 ASP HB2 . 25033 1
326 . 1 1 42 42 ASP HB3 H 1 2.411 0.002 . . . . . A 42 ASP HB3 . 25033 1
327 . 1 1 42 42 ASP C C 13 176.474 0.000 . . . . . A 42 ASP C . 25033 1
328 . 1 1 42 42 ASP CA C 13 55.441 0.000 . . . . . A 42 ASP CA . 25033 1
329 . 1 1 42 42 ASP CB C 13 41.488 0.000 . . . . . A 42 ASP CB . 25033 1
330 . 1 1 42 42 ASP N N 15 119.784 0.083 . . . . . A 42 ASP N . 25033 1
331 . 1 1 43 43 LEU H H 1 9.423 0.005 . . . . . A 43 LEU H . 25033 1
332 . 1 1 43 43 LEU HA H 1 4.687 0.001 . . . . . A 43 LEU HA . 25033 1
333 . 1 1 43 43 LEU HB2 H 1 1.266 0.001 . . . . . A 43 LEU HB2 . 25033 1
334 . 1 1 43 43 LEU HB3 H 1 1.317 0.001 . . . . . A 43 LEU HB3 . 25033 1
335 . 1 1 43 43 LEU HG H 1 1.629 0.000 . . . . . A 43 LEU HG . 25033 1
336 . 1 1 43 43 LEU HD11 H 1 0.695 0.002 . . . . . A 43 LEU HD11 . 25033 1
337 . 1 1 43 43 LEU HD12 H 1 0.695 0.002 . . . . . A 43 LEU HD12 . 25033 1
338 . 1 1 43 43 LEU HD13 H 1 0.695 0.002 . . . . . A 43 LEU HD13 . 25033 1
339 . 1 1 43 43 LEU HD21 H 1 0.719 0.000 . . . . . A 43 LEU HD21 . 25033 1
340 . 1 1 43 43 LEU HD22 H 1 0.719 0.000 . . . . . A 43 LEU HD22 . 25033 1
341 . 1 1 43 43 LEU HD23 H 1 0.719 0.000 . . . . . A 43 LEU HD23 . 25033 1
342 . 1 1 43 43 LEU C C 13 175.759 0.000 . . . . . A 43 LEU C . 25033 1
343 . 1 1 43 43 LEU CA C 13 53.304 0.000 . . . . . A 43 LEU CA . 25033 1
344 . 1 1 43 43 LEU CB C 13 45.449 0.000 . . . . . A 43 LEU CB . 25033 1
345 . 1 1 43 43 LEU CG C 13 27.149 0.000 . . . . . A 43 LEU CG . 25033 1
346 . 1 1 43 43 LEU CD1 C 13 27.511 0.000 . . . . . A 43 LEU CD1 . 25033 1
347 . 1 1 43 43 LEU CD2 C 13 25.896 0.000 . . . . . A 43 LEU CD2 . 25033 1
348 . 1 1 43 43 LEU N N 15 122.515 0.144 . . . . . A 43 LEU N . 25033 1
349 . 1 1 44 44 PHE H H 1 8.465 0.008 . . . . . A 44 PHE H . 25033 1
350 . 1 1 44 44 PHE HA H 1 3.922 0.002 . . . . . A 44 PHE HA . 25033 1
351 . 1 1 44 44 PHE HB2 H 1 3.029 0.002 . . . . . A 44 PHE HB2 . 25033 1
352 . 1 1 44 44 PHE HB3 H 1 2.777 0.001 . . . . . A 44 PHE HB3 . 25033 1
353 . 1 1 44 44 PHE HD1 H 1 6.910 0.000 . . . . . A 44 PHE HD1 . 25033 1
354 . 1 1 44 44 PHE HD2 H 1 6.910 0.000 . . . . . A 44 PHE HD2 . 25033 1
355 . 1 1 44 44 PHE HE1 H 1 7.481 0.000 . . . . . A 44 PHE HE1 . 25033 1
356 . 1 1 44 44 PHE HE2 H 1 7.481 0.000 . . . . . A 44 PHE HE2 . 25033 1
357 . 1 1 44 44 PHE C C 13 172.844 0.000 . . . . . A 44 PHE C . 25033 1
358 . 1 1 44 44 PHE CA C 13 57.880 0.000 . . . . . A 44 PHE CA . 25033 1
359 . 1 1 44 44 PHE CB C 13 40.350 0.000 . . . . . A 44 PHE CB . 25033 1
360 . 1 1 44 44 PHE N N 15 125.962 0.055 . . . . . A 44 PHE N . 25033 1
361 . 1 1 45 45 VAL H H 1 7.715 0.005 . . . . . A 45 VAL H . 25033 1
362 . 1 1 45 45 VAL HA H 1 4.657 0.002 . . . . . A 45 VAL HA . 25033 1
363 . 1 1 45 45 VAL HB H 1 1.584 0.001 . . . . . A 45 VAL HB . 25033 1
364 . 1 1 45 45 VAL HG11 H 1 0.478 0.000 . . . . . A 45 VAL HG11 . 25033 1
365 . 1 1 45 45 VAL HG12 H 1 0.478 0.000 . . . . . A 45 VAL HG12 . 25033 1
366 . 1 1 45 45 VAL HG13 H 1 0.478 0.000 . . . . . A 45 VAL HG13 . 25033 1
367 . 1 1 45 45 VAL HG21 H 1 0.679 0.000 . . . . . A 45 VAL HG21 . 25033 1
368 . 1 1 45 45 VAL HG22 H 1 0.679 0.000 . . . . . A 45 VAL HG22 . 25033 1
369 . 1 1 45 45 VAL HG23 H 1 0.679 0.000 . . . . . A 45 VAL HG23 . 25033 1
370 . 1 1 45 45 VAL C C 13 177.433 0.000 . . . . . A 45 VAL C . 25033 1
371 . 1 1 45 45 VAL CA C 13 58.460 0.000 . . . . . A 45 VAL CA . 25033 1
372 . 1 1 45 45 VAL CB C 13 34.884 0.000 . . . . . A 45 VAL CB . 25033 1
373 . 1 1 45 45 VAL CG1 C 13 18.277 0.000 . . . . . A 45 VAL CG1 . 25033 1
374 . 1 1 45 45 VAL CG2 C 13 22.890 0.000 . . . . . A 45 VAL CG2 . 25033 1
375 . 1 1 45 45 VAL N N 15 123.552 0.072 . . . . . A 45 VAL N . 25033 1
376 . 1 1 46 46 HIS H H 1 9.104 0.015 . . . . . A 46 HIS H . 25033 1
377 . 1 1 46 46 HIS HA H 1 4.825 0.002 . . . . . A 46 HIS HA . 25033 1
378 . 1 1 46 46 HIS HB2 H 1 3.118 0.002 . . . . . A 46 HIS HB2 . 25033 1
379 . 1 1 46 46 HIS HB3 H 1 3.118 0.002 . . . . . A 46 HIS HB3 . 25033 1
380 . 1 1 46 46 HIS C C 13 176.469 0.000 . . . . . A 46 HIS C . 25033 1
381 . 1 1 46 46 HIS CA C 13 55.929 0.000 . . . . . A 46 HIS CA . 25033 1
382 . 1 1 46 46 HIS CB C 13 34.399 0.000 . . . . . A 46 HIS CB . 25033 1
383 . 1 1 46 46 HIS N N 15 127.300 0.203 . . . . . A 46 HIS N . 25033 1
384 . 1 1 47 47 GLN H H 1 8.352 0.004 . . . . . A 47 GLN H . 25033 1
385 . 1 1 47 47 GLN N N 15 125.105 0.060 . . . . . A 47 GLN N . 25033 1
386 . 1 1 48 48 THR HA H 1 4.310 0.000 . . . . . A 48 THR HA . 25033 1
387 . 1 1 48 48 THR HB H 1 4.395 0.001 . . . . . A 48 THR HB . 25033 1
388 . 1 1 48 48 THR HG21 H 1 1.472 0.001 . . . . . A 48 THR HG21 . 25033 1
389 . 1 1 48 48 THR HG22 H 1 1.472 0.001 . . . . . A 48 THR HG22 . 25033 1
390 . 1 1 48 48 THR HG23 H 1 1.472 0.001 . . . . . A 48 THR HG23 . 25033 1
391 . 1 1 48 48 THR C C 13 175.568 0.000 . . . . . A 48 THR C . 25033 1
392 . 1 1 48 48 THR CA C 13 64.770 0.001 . . . . . A 48 THR CA . 25033 1
393 . 1 1 48 48 THR CB C 13 70.054 0.000 . . . . . A 48 THR CB . 25033 1
394 . 1 1 48 48 THR CG2 C 13 22.498 0.000 . . . . . A 48 THR CG2 . 25033 1
395 . 1 1 49 49 ASN H H 1 8.452 0.004 . . . . . A 49 ASN H . 25033 1
396 . 1 1 49 49 ASN HA H 1 5.160 0.000 . . . . . A 49 ASN HA . 25033 1
397 . 1 1 49 49 ASN HB2 H 1 3.529 0.001 . . . . . A 49 ASN HB2 . 25033 1
398 . 1 1 49 49 ASN HB3 H 1 2.874 0.000 . . . . . A 49 ASN HB3 . 25033 1
399 . 1 1 49 49 ASN HD21 H 1 7.238 0.002 . . . . . A 49 ASN HD21 . 25033 1
400 . 1 1 49 49 ASN HD22 H 1 8.164 0.004 . . . . . A 49 ASN HD22 . 25033 1
401 . 1 1 49 49 ASN C C 13 172.914 0.000 . . . . . A 49 ASN C . 25033 1
402 . 1 1 49 49 ASN CA C 13 54.351 0.000 . . . . . A 49 ASN CA . 25033 1
403 . 1 1 49 49 ASN CB C 13 40.527 0.000 . . . . . A 49 ASN CB . 25033 1
404 . 1 1 49 49 ASN N N 15 118.142 0.043 . . . . . A 49 ASN N . 25033 1
405 . 1 1 49 49 ASN ND2 N 15 110.371 0.046 . . . . . A 49 ASN ND2 . 25033 1
406 . 1 1 50 50 ILE H H 1 7.354 0.002 . . . . . A 50 ILE H . 25033 1
407 . 1 1 50 50 ILE HA H 1 4.112 0.001 . . . . . A 50 ILE HA . 25033 1
408 . 1 1 50 50 ILE HB H 1 1.852 0.001 . . . . . A 50 ILE HB . 25033 1
409 . 1 1 50 50 ILE HG12 H 1 1.625 0.013 . . . . . A 50 ILE HG12 . 25033 1
410 . 1 1 50 50 ILE HG13 H 1 1.625 0.013 . . . . . A 50 ILE HG13 . 25033 1
411 . 1 1 50 50 ILE HG21 H 1 0.670 0.002 . . . . . A 50 ILE HG21 . 25033 1
412 . 1 1 50 50 ILE HG22 H 1 0.670 0.002 . . . . . A 50 ILE HG22 . 25033 1
413 . 1 1 50 50 ILE HG23 H 1 0.670 0.002 . . . . . A 50 ILE HG23 . 25033 1
414 . 1 1 50 50 ILE HD11 H 1 0.497 0.001 . . . . . A 50 ILE HD11 . 25033 1
415 . 1 1 50 50 ILE HD12 H 1 0.497 0.001 . . . . . A 50 ILE HD12 . 25033 1
416 . 1 1 50 50 ILE HD13 H 1 0.497 0.001 . . . . . A 50 ILE HD13 . 25033 1
417 . 1 1 50 50 ILE CA C 13 61.606 0.000 . . . . . A 50 ILE CA . 25033 1
418 . 1 1 50 50 ILE CB C 13 38.362 0.000 . . . . . A 50 ILE CB . 25033 1
419 . 1 1 50 50 ILE CG1 C 13 27.422 0.000 . . . . . A 50 ILE CG1 . 25033 1
420 . 1 1 50 50 ILE CG2 C 13 17.530 0.000 . . . . . A 50 ILE CG2 . 25033 1
421 . 1 1 50 50 ILE CD1 C 13 14.470 0.000 . . . . . A 50 ILE CD1 . 25033 1
422 . 1 1 50 50 ILE N N 15 119.226 0.027 . . . . . A 50 ILE N . 25033 1
423 . 1 1 51 51 ASN H H 1 9.266 0.000 . . . . . A 51 ASN H . 25033 1
424 . 1 1 51 51 ASN C C 13 174.614 0.000 . . . . . A 51 ASN C . 25033 1
425 . 1 1 51 51 ASN N N 15 128.460 0.000 . . . . . A 51 ASN N . 25033 1
426 . 1 1 52 52 SER H H 1 7.973 0.003 . . . . . A 52 SER H . 25033 1
427 . 1 1 52 52 SER HA H 1 4.413 0.004 . . . . . A 52 SER HA . 25033 1
428 . 1 1 52 52 SER HB2 H 1 3.787 0.000 . . . . . A 52 SER HB2 . 25033 1
429 . 1 1 52 52 SER HB3 H 1 3.827 0.000 . . . . . A 52 SER HB3 . 25033 1
430 . 1 1 52 52 SER C C 13 174.139 0.000 . . . . . A 52 SER C . 25033 1
431 . 1 1 52 52 SER CA C 13 58.378 0.000 . . . . . A 52 SER CA . 25033 1
432 . 1 1 52 52 SER CB C 13 64.371 0.000 . . . . . A 52 SER CB . 25033 1
433 . 1 1 52 52 SER N N 15 117.246 0.033 . . . . . A 52 SER N . 25033 1
434 . 1 1 53 53 GLU H H 1 8.641 0.004 . . . . . A 53 GLU H . 25033 1
435 . 1 1 53 53 GLU HA H 1 4.298 0.000 . . . . . A 53 GLU HA . 25033 1
436 . 1 1 53 53 GLU HB2 H 1 1.958 0.000 . . . . . A 53 GLU HB2 . 25033 1
437 . 1 1 53 53 GLU HB3 H 1 2.078 0.000 . . . . . A 53 GLU HB3 . 25033 1
438 . 1 1 53 53 GLU HG2 H 1 2.277 0.001 . . . . . A 53 GLU HG2 . 25033 1
439 . 1 1 53 53 GLU HG3 H 1 2.277 0.001 . . . . . A 53 GLU HG3 . 25033 1
440 . 1 1 53 53 GLU C C 13 176.960 0.000 . . . . . A 53 GLU C . 25033 1
441 . 1 1 53 53 GLU CA C 13 57.270 0.000 . . . . . A 53 GLU CA . 25033 1
442 . 1 1 53 53 GLU CB C 13 29.861 0.000 . . . . . A 53 GLU CB . 25033 1
443 . 1 1 53 53 GLU CG C 13 36.700 0.000 . . . . . A 53 GLU CG . 25033 1
444 . 1 1 53 53 GLU N N 15 123.628 0.071 . . . . . A 53 GLU N . 25033 1
445 . 1 1 54 54 GLY H H 1 8.225 0.004 . . . . . A 54 GLY H . 25033 1
446 . 1 1 54 54 GLY HA2 H 1 3.795 0.000 . . . . . A 54 GLY HA2 . 25033 1
447 . 1 1 54 54 GLY HA3 H 1 4.352 0.001 . . . . . A 54 GLY HA3 . 25033 1
448 . 1 1 54 54 GLY CA C 13 44.600 0.000 . . . . . A 54 GLY CA . 25033 1
449 . 1 1 54 54 GLY N N 15 110.282 0.043 . . . . . A 54 GLY N . 25033 1
450 . 1 1 55 55 PHE HA H 1 4.820 0.001 . . . . . A 55 PHE HA . 25033 1
451 . 1 1 55 55 PHE HB2 H 1 2.611 0.000 . . . . . A 55 PHE HB2 . 25033 1
452 . 1 1 55 55 PHE HB3 H 1 2.801 0.000 . . . . . A 55 PHE HB3 . 25033 1
453 . 1 1 55 55 PHE C C 13 175.836 0.000 . . . . . A 55 PHE C . 25033 1
454 . 1 1 55 55 PHE CA C 13 52.690 0.000 . . . . . A 55 PHE CA . 25033 1
455 . 1 1 55 55 PHE CB C 13 38.095 0.000 . . . . . A 55 PHE CB . 25033 1
456 . 1 1 56 56 ARG H H 1 8.153 0.003 . . . . . A 56 ARG H . 25033 1
457 . 1 1 56 56 ARG HA H 1 4.264 0.002 . . . . . A 56 ARG HA . 25033 1
458 . 1 1 56 56 ARG HB2 H 1 1.502 0.001 . . . . . A 56 ARG HB2 . 25033 1
459 . 1 1 56 56 ARG HB3 H 1 1.657 0.000 . . . . . A 56 ARG HB3 . 25033 1
460 . 1 1 56 56 ARG HG2 H 1 1.137 0.000 . . . . . A 56 ARG HG2 . 25033 1
461 . 1 1 56 56 ARG HG3 H 1 1.458 0.001 . . . . . A 56 ARG HG3 . 25033 1
462 . 1 1 56 56 ARG HD2 H 1 2.789 0.000 . . . . . A 56 ARG HD2 . 25033 1
463 . 1 1 56 56 ARG HD3 H 1 3.101 0.001 . . . . . A 56 ARG HD3 . 25033 1
464 . 1 1 56 56 ARG C C 13 175.618 0.000 . . . . . A 56 ARG C . 25033 1
465 . 1 1 56 56 ARG CA C 13 55.510 0.000 . . . . . A 56 ARG CA . 25033 1
466 . 1 1 56 56 ARG CB C 13 32.020 0.000 . . . . . A 56 ARG CB . 25033 1
467 . 1 1 56 56 ARG CG C 13 27.010 0.000 . . . . . A 56 ARG CG . 25033 1
468 . 1 1 56 56 ARG CD C 13 43.860 0.000 . . . . . A 56 ARG CD . 25033 1
469 . 1 1 56 56 ARG N N 15 120.907 0.050 . . . . . A 56 ARG N . 25033 1
470 . 1 1 57 57 SER H H 1 7.834 0.009 . . . . . A 57 SER H . 25033 1
471 . 1 1 57 57 SER N N 15 123.117 0.044 . . . . . A 57 SER N . 25033 1
472 . 1 1 58 58 LEU HA H 1 4.280 0.001 . . . . . A 58 LEU HA . 25033 1
473 . 1 1 58 58 LEU HB2 H 1 0.445 0.001 . . . . . A 58 LEU HB2 . 25033 1
474 . 1 1 58 58 LEU HB3 H 1 0.935 0.000 . . . . . A 58 LEU HB3 . 25033 1
475 . 1 1 58 58 LEU HG H 1 0.763 0.000 . . . . . A 58 LEU HG . 25033 1
476 . 1 1 58 58 LEU HD11 H 1 0.352 0.000 . . . . . A 58 LEU HD11 . 25033 1
477 . 1 1 58 58 LEU HD12 H 1 0.352 0.000 . . . . . A 58 LEU HD12 . 25033 1
478 . 1 1 58 58 LEU HD13 H 1 0.352 0.000 . . . . . A 58 LEU HD13 . 25033 1
479 . 1 1 58 58 LEU HD21 H 1 0.266 0.000 . . . . . A 58 LEU HD21 . 25033 1
480 . 1 1 58 58 LEU HD22 H 1 0.266 0.000 . . . . . A 58 LEU HD22 . 25033 1
481 . 1 1 58 58 LEU HD23 H 1 0.266 0.000 . . . . . A 58 LEU HD23 . 25033 1
482 . 1 1 58 58 LEU C C 13 174.842 0.000 . . . . . A 58 LEU C . 25033 1
483 . 1 1 58 58 LEU CA C 13 53.760 0.000 . . . . . A 58 LEU CA . 25033 1
484 . 1 1 58 58 LEU CB C 13 42.580 0.000 . . . . . A 58 LEU CB . 25033 1
485 . 1 1 58 58 LEU CG C 13 26.600 0.000 . . . . . A 58 LEU CG . 25033 1
486 . 1 1 58 58 LEU CD1 C 13 21.930 0.000 . . . . . A 58 LEU CD1 . 25033 1
487 . 1 1 58 58 LEU CD2 C 13 25.250 0.000 . . . . . A 58 LEU CD2 . 25033 1
488 . 1 1 59 59 ARG H H 1 8.529 0.003 . . . . . A 59 ARG H . 25033 1
489 . 1 1 59 59 ARG HA H 1 4.585 0.001 . . . . . A 59 ARG HA . 25033 1
490 . 1 1 59 59 ARG HB2 H 1 1.635 0.002 . . . . . A 59 ARG HB2 . 25033 1
491 . 1 1 59 59 ARG HB3 H 1 1.790 0.002 . . . . . A 59 ARG HB3 . 25033 1
492 . 1 1 59 59 ARG HG2 H 1 1.589 0.000 . . . . . A 59 ARG HG2 . 25033 1
493 . 1 1 59 59 ARG HG3 H 1 1.589 0.000 . . . . . A 59 ARG HG3 . 25033 1
494 . 1 1 59 59 ARG HD2 H 1 3.140 0.000 . . . . . A 59 ARG HD2 . 25033 1
495 . 1 1 59 59 ARG HD3 H 1 3.193 0.000 . . . . . A 59 ARG HD3 . 25033 1
496 . 1 1 59 59 ARG C C 13 175.256 0.000 . . . . . A 59 ARG C . 25033 1
497 . 1 1 59 59 ARG CA C 13 54.112 0.000 . . . . . A 59 ARG CA . 25033 1
498 . 1 1 59 59 ARG CB C 13 32.970 0.000 . . . . . A 59 ARG CB . 25033 1
499 . 1 1 59 59 ARG CG C 13 27.120 0.000 . . . . . A 59 ARG CG . 25033 1
500 . 1 1 59 59 ARG CD C 13 43.440 0.000 . . . . . A 59 ARG CD . 25033 1
501 . 1 1 59 59 ARG N N 15 119.557 0.020 . . . . . A 59 ARG N . 25033 1
502 . 1 1 60 60 GLU H H 1 8.691 0.006 . . . . . A 60 GLU H . 25033 1
503 . 1 1 60 60 GLU HA H 1 3.581 0.005 . . . . . A 60 GLU HA . 25033 1
504 . 1 1 60 60 GLU HB2 H 1 2.120 0.002 . . . . . A 60 GLU HB2 . 25033 1
505 . 1 1 60 60 GLU HB3 H 1 2.028 0.003 . . . . . A 60 GLU HB3 . 25033 1
506 . 1 1 60 60 GLU HG2 H 1 2.322 0.001 . . . . . A 60 GLU HG2 . 25033 1
507 . 1 1 60 60 GLU HG3 H 1 2.563 0.001 . . . . . A 60 GLU HG3 . 25033 1
508 . 1 1 60 60 GLU C C 13 177.281 0.000 . . . . . A 60 GLU C . 25033 1
509 . 1 1 60 60 GLU CA C 13 58.301 0.000 . . . . . A 60 GLU CA . 25033 1
510 . 1 1 60 60 GLU CB C 13 29.261 0.000 . . . . . A 60 GLU CB . 25033 1
511 . 1 1 60 60 GLU CG C 13 36.110 0.000 . . . . . A 60 GLU CG . 25033 1
512 . 1 1 60 60 GLU N N 15 121.597 0.111 . . . . . A 60 GLU N . 25033 1
513 . 1 1 61 61 GLY H H 1 9.151 0.007 . . . . . A 61 GLY H . 25033 1
514 . 1 1 61 61 GLY HA2 H 1 3.582 0.000 . . . . . A 61 GLY HA2 . 25033 1
515 . 1 1 61 61 GLY HA3 H 1 4.355 0.002 . . . . . A 61 GLY HA3 . 25033 1
516 . 1 1 61 61 GLY C C 13 174.068 0.000 . . . . . A 61 GLY C . 25033 1
517 . 1 1 61 61 GLY CA C 13 45.243 0.000 . . . . . A 61 GLY CA . 25033 1
518 . 1 1 61 61 GLY N N 15 113.554 0.053 . . . . . A 61 GLY N . 25033 1
519 . 1 1 62 62 GLU H H 1 7.889 0.003 . . . . . A 62 GLU H . 25033 1
520 . 1 1 62 62 GLU HA H 1 4.204 0.001 . . . . . A 62 GLU HA . 25033 1
521 . 1 1 62 62 GLU HB2 H 1 2.128 0.001 . . . . . A 62 GLU HB2 . 25033 1
522 . 1 1 62 62 GLU HB3 H 1 1.909 0.000 . . . . . A 62 GLU HB3 . 25033 1
523 . 1 1 62 62 GLU HG2 H 1 2.235 0.001 . . . . . A 62 GLU HG2 . 25033 1
524 . 1 1 62 62 GLU HG3 H 1 2.235 0.001 . . . . . A 62 GLU HG3 . 25033 1
525 . 1 1 62 62 GLU C C 13 175.439 0.000 . . . . . A 62 GLU C . 25033 1
526 . 1 1 62 62 GLU CA C 13 57.342 0.000 . . . . . A 62 GLU CA . 25033 1
527 . 1 1 62 62 GLU CB C 13 30.925 0.000 . . . . . A 62 GLU CB . 25033 1
528 . 1 1 62 62 GLU CG C 13 36.988 0.000 . . . . . A 62 GLU CG . 25033 1
529 . 1 1 62 62 GLU N N 15 121.639 0.042 . . . . . A 62 GLU N . 25033 1
530 . 1 1 63 63 VAL H H 1 8.477 0.004 . . . . . A 63 VAL H . 25033 1
531 . 1 1 63 63 VAL HA H 1 4.748 0.000 . . . . . A 63 VAL HA . 25033 1
532 . 1 1 63 63 VAL HB H 1 1.993 0.000 . . . . . A 63 VAL HB . 25033 1
533 . 1 1 63 63 VAL HG11 H 1 1.043 0.000 . . . . . A 63 VAL HG11 . 25033 1
534 . 1 1 63 63 VAL HG12 H 1 1.043 0.000 . . . . . A 63 VAL HG12 . 25033 1
535 . 1 1 63 63 VAL HG13 H 1 1.043 0.000 . . . . . A 63 VAL HG13 . 25033 1
536 . 1 1 63 63 VAL HG21 H 1 0.981 0.000 . . . . . A 63 VAL HG21 . 25033 1
537 . 1 1 63 63 VAL HG22 H 1 0.981 0.000 . . . . . A 63 VAL HG22 . 25033 1
538 . 1 1 63 63 VAL HG23 H 1 0.981 0.000 . . . . . A 63 VAL HG23 . 25033 1
539 . 1 1 63 63 VAL C C 13 176.639 0.000 . . . . . A 63 VAL C . 25033 1
540 . 1 1 63 63 VAL CA C 13 62.631 0.000 . . . . . A 63 VAL CA . 25033 1
541 . 1 1 63 63 VAL CB C 13 32.357 0.000 . . . . . A 63 VAL CB . 25033 1
542 . 1 1 63 63 VAL CG1 C 13 21.610 0.001 . . . . . A 63 VAL CG1 . 25033 1
543 . 1 1 63 63 VAL CG2 C 13 21.615 0.000 . . . . . A 63 VAL CG2 . 25033 1
544 . 1 1 63 63 VAL N N 15 125.003 0.051 . . . . . A 63 VAL N . 25033 1
545 . 1 1 64 64 VAL H H 1 8.686 0.007 . . . . . A 64 VAL H . 25033 1
546 . 1 1 64 64 VAL HA H 1 5.004 0.001 . . . . . A 64 VAL HA . 25033 1
547 . 1 1 64 64 VAL HB H 1 2.188 0.001 . . . . . A 64 VAL HB . 25033 1
548 . 1 1 64 64 VAL HG11 H 1 0.628 0.001 . . . . . A 64 VAL HG11 . 25033 1
549 . 1 1 64 64 VAL HG12 H 1 0.628 0.001 . . . . . A 64 VAL HG12 . 25033 1
550 . 1 1 64 64 VAL HG13 H 1 0.628 0.001 . . . . . A 64 VAL HG13 . 25033 1
551 . 1 1 64 64 VAL HG21 H 1 0.551 0.000 . . . . . A 64 VAL HG21 . 25033 1
552 . 1 1 64 64 VAL HG22 H 1 0.551 0.000 . . . . . A 64 VAL HG22 . 25033 1
553 . 1 1 64 64 VAL HG23 H 1 0.551 0.000 . . . . . A 64 VAL HG23 . 25033 1
554 . 1 1 64 64 VAL C C 13 173.790 0.000 . . . . . A 64 VAL C . 25033 1
555 . 1 1 64 64 VAL CA C 13 58.609 0.000 . . . . . A 64 VAL CA . 25033 1
556 . 1 1 64 64 VAL CB C 13 36.360 0.000 . . . . . A 64 VAL CB . 25033 1
557 . 1 1 64 64 VAL CG1 C 13 22.679 0.003 . . . . . A 64 VAL CG1 . 25033 1
558 . 1 1 64 64 VAL CG2 C 13 18.060 0.000 . . . . . A 64 VAL CG2 . 25033 1
559 . 1 1 64 64 VAL N N 15 120.113 0.045 . . . . . A 64 VAL N . 25033 1
560 . 1 1 65 65 GLU H H 1 9.003 0.014 . . . . . A 65 GLU H . 25033 1
561 . 1 1 65 65 GLU HA H 1 5.447 0.000 . . . . . A 65 GLU HA . 25033 1
562 . 1 1 65 65 GLU HB2 H 1 1.886 0.000 . . . . . A 65 GLU HB2 . 25033 1
563 . 1 1 65 65 GLU HB3 H 1 1.937 0.000 . . . . . A 65 GLU HB3 . 25033 1
564 . 1 1 65 65 GLU HG2 H 1 2.209 0.001 . . . . . A 65 GLU HG2 . 25033 1
565 . 1 1 65 65 GLU HG3 H 1 2.087 0.002 . . . . . A 65 GLU HG3 . 25033 1
566 . 1 1 65 65 GLU C C 13 175.584 0.000 . . . . . A 65 GLU C . 25033 1
567 . 1 1 65 65 GLU CA C 13 54.390 0.000 . . . . . A 65 GLU CA . 25033 1
568 . 1 1 65 65 GLU CB C 13 34.003 0.000 . . . . . A 65 GLU CB . 25033 1
569 . 1 1 65 65 GLU CG C 13 37.755 0.000 . . . . . A 65 GLU CG . 25033 1
570 . 1 1 65 65 GLU N N 15 120.433 0.043 . . . . . A 65 GLU N . 25033 1
571 . 1 1 66 66 PHE H H 1 8.172 0.006 . . . . . A 66 PHE H . 25033 1
572 . 1 1 66 66 PHE HA H 1 5.061 0.001 . . . . . A 66 PHE HA . 25033 1
573 . 1 1 66 66 PHE HB2 H 1 3.253 0.002 . . . . . A 66 PHE HB2 . 25033 1
574 . 1 1 66 66 PHE HB3 H 1 3.056 0.003 . . . . . A 66 PHE HB3 . 25033 1
575 . 1 1 66 66 PHE HD1 H 1 6.689 0.001 . . . . . A 66 PHE HD1 . 25033 1
576 . 1 1 66 66 PHE HD2 H 1 6.689 0.001 . . . . . A 66 PHE HD2 . 25033 1
577 . 1 1 66 66 PHE HE1 H 1 6.770 0.000 . . . . . A 66 PHE HE1 . 25033 1
578 . 1 1 66 66 PHE HE2 H 1 6.770 0.000 . . . . . A 66 PHE HE2 . 25033 1
579 . 1 1 66 66 PHE HZ H 1 7.283 0.000 . . . . . A 66 PHE HZ . 25033 1
580 . 1 1 66 66 PHE C C 13 173.001 0.000 . . . . . A 66 PHE C . 25033 1
581 . 1 1 66 66 PHE CA C 13 56.857 0.000 . . . . . A 66 PHE CA . 25033 1
582 . 1 1 66 66 PHE CB C 13 41.432 0.000 . . . . . A 66 PHE CB . 25033 1
583 . 1 1 66 66 PHE CD1 C 13 131.970 0.000 . . . . . A 66 PHE CD1 . 25033 1
584 . 1 1 66 66 PHE CD2 C 13 131.970 0.000 . . . . . A 66 PHE CD2 . 25033 1
585 . 1 1 66 66 PHE CE1 C 13 128.785 0.000 . . . . . A 66 PHE CE1 . 25033 1
586 . 1 1 66 66 PHE CE2 C 13 128.785 0.000 . . . . . A 66 PHE CE2 . 25033 1
587 . 1 1 66 66 PHE CZ C 13 129.861 0.000 . . . . . A 66 PHE CZ . 25033 1
588 . 1 1 66 66 PHE N N 15 116.104 0.039 . . . . . A 66 PHE N . 25033 1
589 . 1 1 67 67 GLU H H 1 8.668 0.010 . . . . . A 67 GLU H . 25033 1
590 . 1 1 67 67 GLU HA H 1 4.872 0.002 . . . . . A 67 GLU HA . 25033 1
591 . 1 1 67 67 GLU HB2 H 1 2.135 0.001 . . . . . A 67 GLU HB2 . 25033 1
592 . 1 1 67 67 GLU HB3 H 1 1.860 0.001 . . . . . A 67 GLU HB3 . 25033 1
593 . 1 1 67 67 GLU HG2 H 1 2.195 0.000 . . . . . A 67 GLU HG2 . 25033 1
594 . 1 1 67 67 GLU HG3 H 1 2.343 0.000 . . . . . A 67 GLU HG3 . 25033 1
595 . 1 1 67 67 GLU C C 13 175.327 0.000 . . . . . A 67 GLU C . 25033 1
596 . 1 1 67 67 GLU CA C 13 54.641 0.000 . . . . . A 67 GLU CA . 25033 1
597 . 1 1 67 67 GLU CB C 13 33.020 0.000 . . . . . A 67 GLU CB . 25033 1
598 . 1 1 67 67 GLU CG C 13 37.360 0.000 . . . . . A 67 GLU CG . 25033 1
599 . 1 1 67 67 GLU N N 15 117.574 0.042 . . . . . A 67 GLU N . 25033 1
600 . 1 1 68 68 VAL H H 1 8.748 0.003 . . . . . A 68 VAL H . 25033 1
601 . 1 1 68 68 VAL HA H 1 5.012 0.003 . . . . . A 68 VAL HA . 25033 1
602 . 1 1 68 68 VAL HB H 1 2.007 0.001 . . . . . A 68 VAL HB . 25033 1
603 . 1 1 68 68 VAL HG11 H 1 0.976 0.000 . . . . . A 68 VAL HG11 . 25033 1
604 . 1 1 68 68 VAL HG12 H 1 0.976 0.000 . . . . . A 68 VAL HG12 . 25033 1
605 . 1 1 68 68 VAL HG13 H 1 0.976 0.000 . . . . . A 68 VAL HG13 . 25033 1
606 . 1 1 68 68 VAL HG21 H 1 1.120 0.002 . . . . . A 68 VAL HG21 . 25033 1
607 . 1 1 68 68 VAL HG22 H 1 1.120 0.002 . . . . . A 68 VAL HG22 . 25033 1
608 . 1 1 68 68 VAL HG23 H 1 1.120 0.002 . . . . . A 68 VAL HG23 . 25033 1
609 . 1 1 68 68 VAL C C 13 176.140 0.000 . . . . . A 68 VAL C . 25033 1
610 . 1 1 68 68 VAL CA C 13 62.338 0.000 . . . . . A 68 VAL CA . 25033 1
611 . 1 1 68 68 VAL CB C 13 34.006 0.000 . . . . . A 68 VAL CB . 25033 1
612 . 1 1 68 68 VAL CG1 C 13 21.620 0.000 . . . . . A 68 VAL CG1 . 25033 1
613 . 1 1 68 68 VAL CG2 C 13 22.440 0.000 . . . . . A 68 VAL CG2 . 25033 1
614 . 1 1 68 68 VAL N N 15 120.881 0.083 . . . . . A 68 VAL N . 25033 1
615 . 1 1 69 69 GLU H H 1 9.070 0.011 . . . . . A 69 GLU H . 25033 1
616 . 1 1 69 69 GLU HA H 1 4.705 0.001 . . . . . A 69 GLU HA . 25033 1
617 . 1 1 69 69 GLU HB2 H 1 1.838 0.000 . . . . . A 69 GLU HB2 . 25033 1
618 . 1 1 69 69 GLU HB3 H 1 1.972 0.001 . . . . . A 69 GLU HB3 . 25033 1
619 . 1 1 69 69 GLU HG2 H 1 2.199 0.000 . . . . . A 69 GLU HG2 . 25033 1
620 . 1 1 69 69 GLU HG3 H 1 2.126 0.000 . . . . . A 69 GLU HG3 . 25033 1
621 . 1 1 69 69 GLU C C 13 174.573 0.000 . . . . . A 69 GLU C . 25033 1
622 . 1 1 69 69 GLU CA C 13 54.953 0.000 . . . . . A 69 GLU CA . 25033 1
623 . 1 1 69 69 GLU CB C 13 34.290 0.000 . . . . . A 69 GLU CB . 25033 1
624 . 1 1 69 69 GLU CG C 13 36.780 0.000 . . . . . A 69 GLU CG . 25033 1
625 . 1 1 69 69 GLU N N 15 128.110 0.070 . . . . . A 69 GLU N . 25033 1
626 . 1 1 70 70 ALA H H 1 8.671 0.008 . . . . . A 70 ALA H . 25033 1
627 . 1 1 70 70 ALA HA H 1 5.004 0.000 . . . . . A 70 ALA HA . 25033 1
628 . 1 1 70 70 ALA HB1 H 1 0.688 0.000 . . . . . A 70 ALA HB1 . 25033 1
629 . 1 1 70 70 ALA HB2 H 1 0.688 0.000 . . . . . A 70 ALA HB2 . 25033 1
630 . 1 1 70 70 ALA HB3 H 1 0.688 0.000 . . . . . A 70 ALA HB3 . 25033 1
631 . 1 1 70 70 ALA C C 13 178.073 0.000 . . . . . A 70 ALA C . 25033 1
632 . 1 1 70 70 ALA CA C 13 50.959 0.000 . . . . . A 70 ALA CA . 25033 1
633 . 1 1 70 70 ALA CB C 13 19.489 0.000 . . . . . A 70 ALA CB . 25033 1
634 . 1 1 70 70 ALA N N 15 127.944 0.055 . . . . . A 70 ALA N . 25033 1
635 . 1 1 71 71 GLY H H 1 8.445 0.022 . . . . . A 71 GLY H . 25033 1
636 . 1 1 71 71 GLY HA2 H 1 3.919 0.000 . . . . . A 71 GLY HA2 . 25033 1
637 . 1 1 71 71 GLY HA3 H 1 4.231 0.000 . . . . . A 71 GLY HA3 . 25033 1
638 . 1 1 71 71 GLY CA C 13 44.016 0.000 . . . . . A 71 GLY CA . 25033 1
639 . 1 1 71 71 GLY N N 15 110.340 0.035 . . . . . A 71 GLY N . 25033 1
640 . 1 1 72 72 PRO HA H 1 4.417 0.002 . . . . . A 72 PRO HA . 25033 1
641 . 1 1 72 72 PRO HB2 H 1 1.970 0.000 . . . . . A 72 PRO HB2 . 25033 1
642 . 1 1 72 72 PRO HB3 H 1 2.293 0.000 . . . . . A 72 PRO HB3 . 25033 1
643 . 1 1 72 72 PRO HG2 H 1 1.971 0.000 . . . . . A 72 PRO HG2 . 25033 1
644 . 1 1 72 72 PRO HG3 H 1 1.971 0.000 . . . . . A 72 PRO HG3 . 25033 1
645 . 1 1 72 72 PRO HD2 H 1 3.667 0.004 . . . . . A 72 PRO HD2 . 25033 1
646 . 1 1 72 72 PRO HD3 H 1 3.667 0.004 . . . . . A 72 PRO HD3 . 25033 1
647 . 1 1 72 72 PRO C C 13 176.835 0.000 . . . . . A 72 PRO C . 25033 1
648 . 1 1 72 72 PRO CA C 13 64.160 0.000 . . . . . A 72 PRO CA . 25033 1
649 . 1 1 72 72 PRO CB C 13 31.880 0.000 . . . . . A 72 PRO CB . 25033 1
650 . 1 1 72 72 PRO CG C 13 26.742 0.000 . . . . . A 72 PRO CG . 25033 1
651 . 1 1 72 72 PRO CD C 13 50.110 0.000 . . . . . A 72 PRO CD . 25033 1
652 . 1 1 73 73 ASP H H 1 8.248 0.027 . . . . . A 73 ASP H . 25033 1
653 . 1 1 73 73 ASP HA H 1 4.515 0.001 . . . . . A 73 ASP HA . 25033 1
654 . 1 1 73 73 ASP HB2 H 1 2.682 0.000 . . . . . A 73 ASP HB2 . 25033 1
655 . 1 1 73 73 ASP HB3 H 1 2.866 0.000 . . . . . A 73 ASP HB3 . 25033 1
656 . 1 1 73 73 ASP C C 13 176.775 0.000 . . . . . A 73 ASP C . 25033 1
657 . 1 1 73 73 ASP CA C 13 53.547 0.000 . . . . . A 73 ASP CA . 25033 1
658 . 1 1 73 73 ASP CB C 13 40.234 0.000 . . . . . A 73 ASP CB . 25033 1
659 . 1 1 73 73 ASP N N 15 116.498 0.039 . . . . . A 73 ASP N . 25033 1
660 . 1 1 74 74 GLY H H 1 8.153 0.004 . . . . . A 74 GLY H . 25033 1
661 . 1 1 74 74 GLY HA2 H 1 3.701 0.001 . . . . . A 74 GLY HA2 . 25033 1
662 . 1 1 74 74 GLY HA3 H 1 4.209 0.001 . . . . . A 74 GLY HA3 . 25033 1
663 . 1 1 74 74 GLY C C 13 174.331 0.000 . . . . . A 74 GLY C . 25033 1
664 . 1 1 74 74 GLY CA C 13 45.578 0.000 . . . . . A 74 GLY CA . 25033 1
665 . 1 1 74 74 GLY N N 15 107.369 0.123 . . . . . A 74 GLY N . 25033 1
666 . 1 1 75 75 ARG H H 1 7.670 0.013 . . . . . A 75 ARG H . 25033 1
667 . 1 1 75 75 ARG HA H 1 4.542 0.000 . . . . . A 75 ARG HA . 25033 1
668 . 1 1 75 75 ARG HB2 H 1 1.876 0.007 . . . . . A 75 ARG HB2 . 25033 1
669 . 1 1 75 75 ARG HB3 H 1 1.813 0.000 . . . . . A 75 ARG HB3 . 25033 1
670 . 1 1 75 75 ARG HG2 H 1 1.655 0.001 . . . . . A 75 ARG HG2 . 25033 1
671 . 1 1 75 75 ARG HG3 H 1 1.614 0.000 . . . . . A 75 ARG HG3 . 25033 1
672 . 1 1 75 75 ARG HD2 H 1 3.125 0.000 . . . . . A 75 ARG HD2 . 25033 1
673 . 1 1 75 75 ARG HD3 H 1 3.192 0.004 . . . . . A 75 ARG HD3 . 25033 1
674 . 1 1 75 75 ARG C C 13 176.652 0.000 . . . . . A 75 ARG C . 25033 1
675 . 1 1 75 75 ARG CA C 13 55.658 0.000 . . . . . A 75 ARG CA . 25033 1
676 . 1 1 75 75 ARG CB C 13 30.909 0.000 . . . . . A 75 ARG CB . 25033 1
677 . 1 1 75 75 ARG CG C 13 27.072 0.000 . . . . . A 75 ARG CG . 25033 1
678 . 1 1 75 75 ARG CD C 13 43.150 0.000 . . . . . A 75 ARG CD . 25033 1
679 . 1 1 75 75 ARG N N 15 120.942 0.052 . . . . . A 75 ARG N . 25033 1
680 . 1 1 76 76 SER H H 1 8.808 0.025 . . . . . A 76 SER H . 25033 1
681 . 1 1 76 76 SER HA H 1 5.035 0.001 . . . . . A 76 SER HA . 25033 1
682 . 1 1 76 76 SER HB2 H 1 3.695 0.000 . . . . . A 76 SER HB2 . 25033 1
683 . 1 1 76 76 SER HB3 H 1 3.751 0.000 . . . . . A 76 SER HB3 . 25033 1
684 . 1 1 76 76 SER C C 13 172.816 0.000 . . . . . A 76 SER C . 25033 1
685 . 1 1 76 76 SER CA C 13 59.080 0.000 . . . . . A 76 SER CA . 25033 1
686 . 1 1 76 76 SER CB C 13 64.850 0.000 . . . . . A 76 SER CB . 25033 1
687 . 1 1 76 76 SER N N 15 120.181 0.094 . . . . . A 76 SER N . 25033 1
688 . 1 1 77 77 LYS H H 1 8.982 0.013 . . . . . A 77 LYS H . 25033 1
689 . 1 1 77 77 LYS HA H 1 5.174 0.000 . . . . . A 77 LYS HA . 25033 1
690 . 1 1 77 77 LYS HB2 H 1 1.984 0.000 . . . . . A 77 LYS HB2 . 25033 1
691 . 1 1 77 77 LYS HB3 H 1 1.876 0.002 . . . . . A 77 LYS HB3 . 25033 1
692 . 1 1 77 77 LYS HG2 H 1 1.448 0.000 . . . . . A 77 LYS HG2 . 25033 1
693 . 1 1 77 77 LYS HG3 H 1 1.284 0.001 . . . . . A 77 LYS HG3 . 25033 1
694 . 1 1 77 77 LYS HD2 H 1 1.750 0.001 . . . . . A 77 LYS HD2 . 25033 1
695 . 1 1 77 77 LYS HD3 H 1 1.668 0.000 . . . . . A 77 LYS HD3 . 25033 1
696 . 1 1 77 77 LYS HE2 H 1 2.831 0.001 . . . . . A 77 LYS HE2 . 25033 1
697 . 1 1 77 77 LYS HE3 H 1 2.831 0.001 . . . . . A 77 LYS HE3 . 25033 1
698 . 1 1 77 77 LYS C C 13 173.706 0.000 . . . . . A 77 LYS C . 25033 1
699 . 1 1 77 77 LYS CA C 13 54.599 0.000 . . . . . A 77 LYS CA . 25033 1
700 . 1 1 77 77 LYS CB C 13 36.035 0.000 . . . . . A 77 LYS CB . 25033 1
701 . 1 1 77 77 LYS CG C 13 24.227 0.000 . . . . . A 77 LYS CG . 25033 1
702 . 1 1 77 77 LYS CD C 13 29.828 0.000 . . . . . A 77 LYS CD . 25033 1
703 . 1 1 77 77 LYS CE C 13 41.975 0.000 . . . . . A 77 LYS CE . 25033 1
704 . 1 1 77 77 LYS N N 15 121.202 0.090 . . . . . A 77 LYS N . 25033 1
705 . 1 1 78 78 ALA H H 1 8.706 0.015 . . . . . A 78 ALA H . 25033 1
706 . 1 1 78 78 ALA HA H 1 5.004 0.001 . . . . . A 78 ALA HA . 25033 1
707 . 1 1 78 78 ALA HB1 H 1 0.688 0.001 . . . . . A 78 ALA HB1 . 25033 1
708 . 1 1 78 78 ALA HB2 H 1 0.688 0.001 . . . . . A 78 ALA HB2 . 25033 1
709 . 1 1 78 78 ALA HB3 H 1 0.688 0.001 . . . . . A 78 ALA HB3 . 25033 1
710 . 1 1 78 78 ALA C C 13 175.979 0.000 . . . . . A 78 ALA C . 25033 1
711 . 1 1 78 78 ALA CA C 13 50.445 0.000 . . . . . A 78 ALA CA . 25033 1
712 . 1 1 78 78 ALA CB C 13 20.136 0.000 . . . . . A 78 ALA CB . 25033 1
713 . 1 1 78 78 ALA N N 15 124.064 0.137 . . . . . A 78 ALA N . 25033 1
714 . 1 1 79 79 VAL H H 1 9.165 0.005 . . . . . A 79 VAL H . 25033 1
715 . 1 1 79 79 VAL HA H 1 4.843 0.002 . . . . . A 79 VAL HA . 25033 1
716 . 1 1 79 79 VAL HB H 1 2.229 0.002 . . . . . A 79 VAL HB . 25033 1
717 . 1 1 79 79 VAL HG11 H 1 0.756 0.000 . . . . . A 79 VAL HG11 . 25033 1
718 . 1 1 79 79 VAL HG12 H 1 0.756 0.000 . . . . . A 79 VAL HG12 . 25033 1
719 . 1 1 79 79 VAL HG13 H 1 0.756 0.000 . . . . . A 79 VAL HG13 . 25033 1
720 . 1 1 79 79 VAL HG21 H 1 0.827 0.000 . . . . . A 79 VAL HG21 . 25033 1
721 . 1 1 79 79 VAL HG22 H 1 0.827 0.000 . . . . . A 79 VAL HG22 . 25033 1
722 . 1 1 79 79 VAL HG23 H 1 0.827 0.000 . . . . . A 79 VAL HG23 . 25033 1
723 . 1 1 79 79 VAL C C 13 174.744 0.000 . . . . . A 79 VAL C . 25033 1
724 . 1 1 79 79 VAL CA C 13 59.073 0.000 . . . . . A 79 VAL CA . 25033 1
725 . 1 1 79 79 VAL CB C 13 35.596 0.000 . . . . . A 79 VAL CB . 25033 1
726 . 1 1 79 79 VAL CG1 C 13 19.208 0.001 . . . . . A 79 VAL CG1 . 25033 1
727 . 1 1 79 79 VAL CG2 C 13 21.759 0.000 . . . . . A 79 VAL CG2 . 25033 1
728 . 1 1 79 79 VAL N N 15 113.264 0.105 . . . . . A 79 VAL N . 25033 1
729 . 1 1 80 80 ASN H H 1 8.923 0.008 . . . . . A 80 ASN H . 25033 1
730 . 1 1 80 80 ASN HA H 1 4.356 0.002 . . . . . A 80 ASN HA . 25033 1
731 . 1 1 80 80 ASN HB2 H 1 2.659 0.003 . . . . . A 80 ASN HB2 . 25033 1
732 . 1 1 80 80 ASN HB3 H 1 3.055 0.001 . . . . . A 80 ASN HB3 . 25033 1
733 . 1 1 80 80 ASN HD21 H 1 7.859 0.005 . . . . . A 80 ASN HD21 . 25033 1
734 . 1 1 80 80 ASN HD22 H 1 6.806 0.004 . . . . . A 80 ASN HD22 . 25033 1
735 . 1 1 80 80 ASN C C 13 175.391 0.000 . . . . . A 80 ASN C . 25033 1
736 . 1 1 80 80 ASN CA C 13 53.734 0.000 . . . . . A 80 ASN CA . 25033 1
737 . 1 1 80 80 ASN CB C 13 37.121 0.000 . . . . . A 80 ASN CB . 25033 1
738 . 1 1 80 80 ASN N N 15 120.084 0.049 . . . . . A 80 ASN N . 25033 1
739 . 1 1 80 80 ASN ND2 N 15 113.279 0.021 . . . . . A 80 ASN ND2 . 25033 1
740 . 1 1 81 81 VAL H H 1 8.282 0.006 . . . . . A 81 VAL H . 25033 1
741 . 1 1 81 81 VAL HA H 1 4.747 0.001 . . . . . A 81 VAL HA . 25033 1
742 . 1 1 81 81 VAL HB H 1 1.917 0.001 . . . . . A 81 VAL HB . 25033 1
743 . 1 1 81 81 VAL HG11 H 1 0.687 0.001 . . . . . A 81 VAL HG11 . 25033 1
744 . 1 1 81 81 VAL HG12 H 1 0.687 0.001 . . . . . A 81 VAL HG12 . 25033 1
745 . 1 1 81 81 VAL HG13 H 1 0.687 0.001 . . . . . A 81 VAL HG13 . 25033 1
746 . 1 1 81 81 VAL HG21 H 1 0.792 0.000 . . . . . A 81 VAL HG21 . 25033 1
747 . 1 1 81 81 VAL HG22 H 1 0.792 0.000 . . . . . A 81 VAL HG22 . 25033 1
748 . 1 1 81 81 VAL HG23 H 1 0.792 0.000 . . . . . A 81 VAL HG23 . 25033 1
749 . 1 1 81 81 VAL C C 13 176.340 0.000 . . . . . A 81 VAL C . 25033 1
750 . 1 1 81 81 VAL CA C 13 63.160 0.000 . . . . . A 81 VAL CA . 25033 1
751 . 1 1 81 81 VAL CB C 13 32.130 0.000 . . . . . A 81 VAL CB . 25033 1
752 . 1 1 81 81 VAL CG1 C 13 21.730 0.000 . . . . . A 81 VAL CG1 . 25033 1
753 . 1 1 81 81 VAL CG2 C 13 21.730 0.000 . . . . . A 81 VAL CG2 . 25033 1
754 . 1 1 81 81 VAL N N 15 119.178 0.020 . . . . . A 81 VAL N . 25033 1
755 . 1 1 82 82 THR H H 1 9.198 0.006 . . . . . A 82 THR H . 25033 1
756 . 1 1 82 82 THR HA H 1 4.336 0.000 . . . . . A 82 THR HA . 25033 1
757 . 1 1 82 82 THR HB H 1 4.187 0.000 . . . . . A 82 THR HB . 25033 1
758 . 1 1 82 82 THR HG21 H 1 1.163 0.001 . . . . . A 82 THR HG21 . 25033 1
759 . 1 1 82 82 THR HG22 H 1 1.163 0.001 . . . . . A 82 THR HG22 . 25033 1
760 . 1 1 82 82 THR HG23 H 1 1.163 0.001 . . . . . A 82 THR HG23 . 25033 1
761 . 1 1 82 82 THR CA C 13 63.515 0.000 . . . . . A 82 THR CA . 25033 1
762 . 1 1 82 82 THR CB C 13 71.769 0.000 . . . . . A 82 THR CB . 25033 1
763 . 1 1 82 82 THR CG2 C 13 21.810 0.000 . . . . . A 82 THR CG2 . 25033 1
764 . 1 1 82 82 THR N N 15 125.434 0.041 . . . . . A 82 THR N . 25033 1
stop_
save_