Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 34785
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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 $chem_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 S2B pulse sequence with MOCCA-mixing between carbons' . . . 34785 1
2 '5D S2B combined with a simultaneous 4D HCCH' . . . 34785 1
3 '15 time-shared 15N/13C-edited H-RFDR-h(N/C)H RFDR pulse sequence with 1H-1H homonuclear mixing times from 150 us to 1.9 ms' . . . 34785 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID
_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 7 7 GLU H H 1 8.491 0.017 . 1 . . . . A 7 GLU H . 34785 1
2 . 1 . 1 7 7 GLU HA H 1 4.453 0.056 . 1 . . . . A 7 GLU HA . 34785 1
3 . 1 . 1 7 7 GLU C C 13 167.004 0 . 1 . . . . A 7 GLU C . 34785 1
4 . 1 . 1 7 7 GLU CA C 13 55.837 0.105 . 1 . . . . A 7 GLU CA . 34785 1
5 . 1 . 1 7 7 GLU CB C 13 30.714 0.132 . 1 . . . . A 7 GLU CB . 34785 1
6 . 1 . 1 7 7 GLU N N 15 120.825 0.099 . 1 . . . . A 7 GLU N . 34785 1
7 . 1 . 1 8 8 LEU H H 1 8.137 0.011 . 1 . . . . A 8 LEU H . 34785 1
8 . 1 . 1 8 8 LEU HA H 1 5.467 0.015 . 1 . . . . A 8 LEU HA . 34785 1
9 . 1 . 1 8 8 LEU HB2 H 1 1.046 0.016 . 2 . . . . A 8 LEU HB2 . 34785 1
10 . 1 . 1 8 8 LEU HB3 H 1 1.267 0.047 . 2 . . . . A 8 LEU HB3 . 34785 1
11 . 1 . 1 8 8 LEU HG H 1 1.151 0.021 . 1 . . . . A 8 LEU HG . 34785 1
12 . 1 . 1 8 8 LEU HD11 H 1 -0.297 0.025 . 2 . . . . A 8 LEU HD11 . 34785 1
13 . 1 . 1 8 8 LEU HD12 H 1 -0.297 0.025 . 2 . . . . A 8 LEU HD12 . 34785 1
14 . 1 . 1 8 8 LEU HD13 H 1 -0.297 0.025 . 2 . . . . A 8 LEU HD13 . 34785 1
15 . 1 . 1 8 8 LEU HD21 H 1 0.709 0.017 . 2 . . . . A 8 LEU HD21 . 34785 1
16 . 1 . 1 8 8 LEU HD22 H 1 0.709 0.017 . 2 . . . . A 8 LEU HD22 . 34785 1
17 . 1 . 1 8 8 LEU HD23 H 1 0.709 0.017 . 2 . . . . A 8 LEU HD23 . 34785 1
18 . 1 . 1 8 8 LEU C C 13 169.413 0 . 1 . . . . A 8 LEU C . 34785 1
19 . 1 . 1 8 8 LEU CA C 13 52.865 0.096 . 1 . . . . A 8 LEU CA . 34785 1
20 . 1 . 1 8 8 LEU CB C 13 45.65 0.304 . 1 . . . . A 8 LEU CB . 34785 1
21 . 1 . 1 8 8 LEU CG C 13 26.191 0.206 . 1 . . . . A 8 LEU CG . 34785 1
22 . 1 . 1 8 8 LEU CD1 C 13 22.365 0.13 . 2 . . . . A 8 LEU CD1 . 34785 1
23 . 1 . 1 8 8 LEU CD2 C 13 23.248 0.141 . 2 . . . . A 8 LEU CD2 . 34785 1
24 . 1 . 1 8 8 LEU N N 15 120.583 0.132 . 1 . . . . A 8 LEU N . 34785 1
25 . 1 . 1 9 9 VAL H H 1 9.137 0.018 . 1 . . . . A 9 VAL H . 34785 1
26 . 1 . 1 9 9 VAL HA H 1 5.34 0.021 . 1 . . . . A 9 VAL HA . 34785 1
27 . 1 . 1 9 9 VAL HB H 1 2.129 0.017 . 1 . . . . A 9 VAL HB . 34785 1
28 . 1 . 1 9 9 VAL HG11 H 1 0.91 0.011 . 2 . . . . A 9 VAL HG11 . 34785 1
29 . 1 . 1 9 9 VAL HG12 H 1 0.91 0.011 . 2 . . . . A 9 VAL HG12 . 34785 1
30 . 1 . 1 9 9 VAL HG13 H 1 0.91 0.011 . 2 . . . . A 9 VAL HG13 . 34785 1
31 . 1 . 1 9 9 VAL HG21 H 1 1.139 0.017 . 2 . . . . A 9 VAL HG21 . 34785 1
32 . 1 . 1 9 9 VAL HG22 H 1 1.139 0.017 . 2 . . . . A 9 VAL HG22 . 34785 1
33 . 1 . 1 9 9 VAL HG23 H 1 1.139 0.017 . 2 . . . . A 9 VAL HG23 . 34785 1
34 . 1 . 1 9 9 VAL C C 13 165.137 0 . 1 . . . . A 9 VAL C . 34785 1
35 . 1 . 1 9 9 VAL CA C 13 57.512 0.098 . 1 . . . . A 9 VAL CA . 34785 1
36 . 1 . 1 9 9 VAL CB C 13 35.557 0.115 . 1 . . . . A 9 VAL CB . 34785 1
37 . 1 . 1 9 9 VAL CG1 C 13 20.56 0.175 . 2 . . . . A 9 VAL CG1 . 34785 1
38 . 1 . 1 9 9 VAL CG2 C 13 23.698 0.146 . 2 . . . . A 9 VAL CG2 . 34785 1
39 . 1 . 1 9 9 VAL N N 15 111.098 0.139 . 1 . . . . A 9 VAL N . 34785 1
40 . 1 . 1 10 10 LEU H H 1 9.208 0.027 . 1 . . . . A 10 LEU H . 34785 1
41 . 1 . 1 10 10 LEU HA H 1 5.243 0.012 . 1 . . . . A 10 LEU HA . 34785 1
42 . 1 . 1 10 10 LEU HB2 H 1 1.531 0.021 . 2 . . . . A 10 LEU HB2 . 34785 1
43 . 1 . 1 10 10 LEU HB3 H 1 1.971 0.06 . 2 . . . . A 10 LEU HB3 . 34785 1
44 . 1 . 1 10 10 LEU HG H 1 1.326 0.02 . 1 . . . . A 10 LEU HG . 34785 1
45 . 1 . 1 10 10 LEU HD11 H 1 0.942 0.022 . 2 . . . . A 10 LEU HD11 . 34785 1
46 . 1 . 1 10 10 LEU HD12 H 1 0.942 0.022 . 2 . . . . A 10 LEU HD12 . 34785 1
47 . 1 . 1 10 10 LEU HD13 H 1 0.942 0.022 . 2 . . . . A 10 LEU HD13 . 34785 1
48 . 1 . 1 10 10 LEU HD21 H 1 0.966 0.015 . 2 . . . . A 10 LEU HD21 . 34785 1
49 . 1 . 1 10 10 LEU HD22 H 1 0.966 0.015 . 2 . . . . A 10 LEU HD22 . 34785 1
50 . 1 . 1 10 10 LEU HD23 H 1 0.966 0.015 . 2 . . . . A 10 LEU HD23 . 34785 1
51 . 1 . 1 10 10 LEU C C 13 168.963 0 . 1 . . . . A 10 LEU C . 34785 1
52 . 1 . 1 10 10 LEU CA C 13 52.609 0.123 . 1 . . . . A 10 LEU CA . 34785 1
53 . 1 . 1 10 10 LEU CB C 13 46.385 0.078 . 1 . . . . A 10 LEU CB . 34785 1
54 . 1 . 1 10 10 LEU CG C 13 27.082 0.058 . 1 . . . . A 10 LEU CG . 34785 1
55 . 1 . 1 10 10 LEU CD1 C 13 24.001 0.091 . 2 . . . . A 10 LEU CD1 . 34785 1
56 . 1 . 1 10 10 LEU CD2 C 13 26.463 0.12 . 2 . . . . A 10 LEU CD2 . 34785 1
57 . 1 . 1 10 10 LEU N N 15 124.009 0.147 . 1 . . . . A 10 LEU N . 34785 1
58 . 1 . 1 11 11 ALA H H 1 9.516 0.014 . 1 . . . . A 11 ALA H . 34785 1
59 . 1 . 1 11 11 ALA HA H 1 4.701 0.019 . 1 . . . . A 11 ALA HA . 34785 1
60 . 1 . 1 11 11 ALA HB1 H 1 1.777 0.025 . 1 . . . . A 11 ALA HB1 . 34785 1
61 . 1 . 1 11 11 ALA HB2 H 1 1.777 0.025 . 1 . . . . A 11 ALA HB2 . 34785 1
62 . 1 . 1 11 11 ALA HB3 H 1 1.777 0.025 . 1 . . . . A 11 ALA HB3 . 34785 1
63 . 1 . 1 11 11 ALA C C 13 170.401 0 . 1 . . . . A 11 ALA C . 34785 1
64 . 1 . 1 11 11 ALA CA C 13 52.589 0.119 . 1 . . . . A 11 ALA CA . 34785 1
65 . 1 . 1 11 11 ALA CB C 13 19.392 0.137 . 1 . . . . A 11 ALA CB . 34785 1
66 . 1 . 1 11 11 ALA N N 15 128.064 0.09 . 1 . . . . A 11 ALA N . 34785 1
67 . 1 . 1 12 12 LEU H H 1 9.503 0.022 . 1 . . . . A 12 LEU H . 34785 1
68 . 1 . 1 12 12 LEU HA H 1 3.955 0.018 . 1 . . . . A 12 LEU HA . 34785 1
69 . 1 . 1 12 12 LEU HB2 H 1 0.727 0.014 . 2 . . . . A 12 LEU HB2 . 34785 1
70 . 1 . 1 12 12 LEU HB3 H 1 1.373 0.028 . 2 . . . . A 12 LEU HB3 . 34785 1
71 . 1 . 1 12 12 LEU HG H 1 1.573 0.015 . 1 . . . . A 12 LEU HG . 34785 1
72 . 1 . 1 12 12 LEU HD11 H 1 0.749 0.023 . 2 . . . . A 12 LEU HD11 . 34785 1
73 . 1 . 1 12 12 LEU HD12 H 1 0.749 0.023 . 2 . . . . A 12 LEU HD12 . 34785 1
74 . 1 . 1 12 12 LEU HD13 H 1 0.749 0.023 . 2 . . . . A 12 LEU HD13 . 34785 1
75 . 1 . 1 12 12 LEU HD21 H 1 0.876 0.014 . 2 . . . . A 12 LEU HD21 . 34785 1
76 . 1 . 1 12 12 LEU HD22 H 1 0.876 0.014 . 2 . . . . A 12 LEU HD22 . 34785 1
77 . 1 . 1 12 12 LEU HD23 H 1 0.876 0.014 . 2 . . . . A 12 LEU HD23 . 34785 1
78 . 1 . 1 12 12 LEU C C 13 167.419 0 . 1 . . . . A 12 LEU C . 34785 1
79 . 1 . 1 12 12 LEU CA C 13 55.752 0.116 . 1 . . . . A 12 LEU CA . 34785 1
80 . 1 . 1 12 12 LEU CB C 13 42.861 0.086 . 1 . . . . A 12 LEU CB . 34785 1
81 . 1 . 1 12 12 LEU CG C 13 26.491 0.103 . 1 . . . . A 12 LEU CG . 34785 1
82 . 1 . 1 12 12 LEU CD1 C 13 21.612 0.163 . 2 . . . . A 12 LEU CD1 . 34785 1
83 . 1 . 1 12 12 LEU CD2 C 13 25.422 0.123 . 2 . . . . A 12 LEU CD2 . 34785 1
84 . 1 . 1 12 12 LEU N N 15 128.35 0.15 . 1 . . . . A 12 LEU N . 34785 1
85 . 1 . 1 13 13 TYR H H 1 7.193 0.021 . 1 . . . . A 13 TYR H . 34785 1
86 . 1 . 1 13 13 TYR HA H 1 4.699 0.023 . 1 . . . . A 13 TYR HA . 34785 1
87 . 1 . 1 13 13 TYR HB2 H 1 1.962 0.037 . 2 . . . . A 13 TYR HB2 . 34785 1
88 . 1 . 1 13 13 TYR HB3 H 1 3.328 0.011 . 2 . . . . A 13 TYR HB3 . 34785 1
89 . 1 . 1 13 13 TYR C C 13 166.136 0 . 1 . . . . A 13 TYR C . 34785 1
90 . 1 . 1 13 13 TYR CA C 13 55.252 0.196 . 1 . . . . A 13 TYR CA . 34785 1
91 . 1 . 1 13 13 TYR CB C 13 43.429 0.217 . 1 . . . . A 13 TYR CB . 34785 1
92 . 1 . 1 13 13 TYR N N 15 110.147 0.089 . 1 . . . . A 13 TYR N . 34785 1
93 . 1 . 1 14 14 ASP H H 1 8.634 0.023 . 1 . . . . A 14 ASP H . 34785 1
94 . 1 . 1 14 14 ASP HA H 1 4.745 0.022 . 1 . . . . A 14 ASP HA . 34785 1
95 . 1 . 1 14 14 ASP HB2 H 1 2.753 0.021 . 2 . . . . A 14 ASP HB2 . 34785 1
96 . 1 . 1 14 14 ASP HB3 H 1 2.968 0.013 . 2 . . . . A 14 ASP HB3 . 34785 1
97 . 1 . 1 14 14 ASP C C 13 168.926 0 . 1 . . . . A 14 ASP C . 34785 1
98 . 1 . 1 14 14 ASP CA C 13 54.673 0.16 . 1 . . . . A 14 ASP CA . 34785 1
99 . 1 . 1 14 14 ASP CB C 13 41.735 0.117 . 1 . . . . A 14 ASP CB . 34785 1
100 . 1 . 1 14 14 ASP N N 15 117.458 0.131 . 1 . . . . A 14 ASP N . 34785 1
101 . 1 . 1 15 15 TYR H H 1 8.724 0.033 . 1 . . . . A 15 TYR H . 34785 1
102 . 1 . 1 15 15 TYR HA H 1 4.727 0.016 . 1 . . . . A 15 TYR HA . 34785 1
103 . 1 . 1 15 15 TYR HB2 H 1 3.206 0.019 . 2 . . . . A 15 TYR HB2 . 34785 1
104 . 1 . 1 15 15 TYR HB3 H 1 3.206 0.019 . 2 . . . . A 15 TYR HB3 . 34785 1
105 . 1 . 1 15 15 TYR C C 13 165.167 0 . 1 . . . . A 15 TYR C . 34785 1
106 . 1 . 1 15 15 TYR CA C 13 60.127 0.164 . 1 . . . . A 15 TYR CA . 34785 1
107 . 1 . 1 15 15 TYR CB C 13 43.511 0.134 . 1 . . . . A 15 TYR CB . 34785 1
108 . 1 . 1 15 15 TYR N N 15 118.456 0.206 . 1 . . . . A 15 TYR N . 34785 1
109 . 1 . 1 16 16 GLN H H 1 7.881 0.016 . 1 . . . . A 16 GLN H . 34785 1
110 . 1 . 1 16 16 GLN HA H 1 4.641 0.018 . 1 . . . . A 16 GLN HA . 34785 1
111 . 1 . 1 16 16 GLN HB2 H 1 1.906 0.031 . 2 . . . . A 16 GLN HB2 . 34785 1
112 . 1 . 1 16 16 GLN HB3 H 1 1.906 0.031 . 2 . . . . A 16 GLN HB3 . 34785 1
113 . 1 . 1 16 16 GLN HG2 H 1 2.408 0.011 . 2 . . . . A 16 GLN HG2 . 34785 1
114 . 1 . 1 16 16 GLN HG3 H 1 2.408 0.011 . 2 . . . . A 16 GLN HG3 . 34785 1
115 . 1 . 1 16 16 GLN C C 13 166.539 0 . 1 . . . . A 16 GLN C . 34785 1
116 . 1 . 1 16 16 GLN CA C 13 54.1 0.161 . 1 . . . . A 16 GLN CA . 34785 1
117 . 1 . 1 16 16 GLN CB C 13 29.065 0.089 . 1 . . . . A 16 GLN CB . 34785 1
118 . 1 . 1 16 16 GLN CG C 13 33.714 0.11 . 1 . . . . A 16 GLN CG . 34785 1
119 . 1 . 1 16 16 GLN N N 15 126.589 0.128 . 1 . . . . A 16 GLN N . 34785 1
120 . 1 . 1 17 17 GLU H H 1 7.948 0.021 . 1 . . . . A 17 GLU H . 34785 1
121 . 1 . 1 17 17 GLU HA H 1 4.463 0.025 . 1 . . . . A 17 GLU HA . 34785 1
122 . 1 . 1 17 17 GLU HB2 H 1 1.742 0.011 . 2 . . . . A 17 GLU HB2 . 34785 1
123 . 1 . 1 17 17 GLU HB3 H 1 2.102 0.016 . 2 . . . . A 17 GLU HB3 . 34785 1
124 . 1 . 1 17 17 GLU HG2 H 1 2.029 0.017 . 2 . . . . A 17 GLU HG2 . 34785 1
125 . 1 . 1 17 17 GLU HG3 H 1 2.188 0.021 . 2 . . . . A 17 GLU HG3 . 34785 1
126 . 1 . 1 17 17 GLU C C 13 168.206 0 . 1 . . . . A 17 GLU C . 34785 1
127 . 1 . 1 17 17 GLU CA C 13 55.832 0.1 . 1 . . . . A 17 GLU CA . 34785 1
128 . 1 . 1 17 17 GLU CB C 13 30.993 0.242 . 1 . . . . A 17 GLU CB . 34785 1
129 . 1 . 1 17 17 GLU CG C 13 34.926 0.172 . 1 . . . . A 17 GLU CG . 34785 1
130 . 1 . 1 17 17 GLU N N 15 122.739 0.108 . 1 . . . . A 17 GLU N . 34785 1
131 . 1 . 1 18 18 LYS H H 1 8.896 0.026 . 1 . . . . A 18 LYS H . 34785 1
132 . 1 . 1 18 18 LYS HA H 1 4.603 0.016 . 1 . . . . A 18 LYS HA . 34785 1
133 . 1 . 1 18 18 LYS HB2 H 1 2.049 0.022 . 2 . . . . A 18 LYS HB2 . 34785 1
134 . 1 . 1 18 18 LYS HB3 H 1 2.226 0.02 . 2 . . . . A 18 LYS HB3 . 34785 1
135 . 1 . 1 18 18 LYS HG2 H 1 1.615 0.033 . 2 . . . . A 18 LYS HG2 . 34785 1
136 . 1 . 1 18 18 LYS HG3 H 1 1.79 0.033 . 2 . . . . A 18 LYS HG3 . 34785 1
137 . 1 . 1 18 18 LYS C C 13 167.005 0 . 1 . . . . A 18 LYS C . 34785 1
138 . 1 . 1 18 18 LYS CA C 13 54.623 0.177 . 1 . . . . A 18 LYS CA . 34785 1
139 . 1 . 1 18 18 LYS CB C 13 33.984 0.109 . 1 . . . . A 18 LYS CB . 34785 1
140 . 1 . 1 18 18 LYS CG C 13 23.962 0.179 . 1 . . . . A 18 LYS CG . 34785 1
141 . 1 . 1 18 18 LYS CD C 13 29.61 0 . 1 . . . . A 18 LYS CD . 34785 1
142 . 1 . 1 18 18 LYS N N 15 120.015 0.347 . 1 . . . . A 18 LYS N . 34785 1
143 . 1 . 1 19 19 SER H H 1 7.422 0.024 . 1 . . . . A 19 SER H . 34785 1
144 . 1 . 1 19 19 SER HA H 1 4.131 0.023 . 1 . . . . A 19 SER HA . 34785 1
145 . 1 . 1 19 19 SER HB2 H 1 3.357 0.02 . 2 . . . . A 19 SER HB2 . 34785 1
146 . 1 . 1 19 19 SER HB3 H 1 3.526 0.026 . 2 . . . . A 19 SER HB3 . 34785 1
147 . 1 . 1 19 19 SER C C 13 165.628 0 . 1 . . . . A 19 SER C . 34785 1
148 . 1 . 1 19 19 SER CA C 13 56.589 0.135 . 1 . . . . A 19 SER CA . 34785 1
149 . 1 . 1 19 19 SER CB C 13 63.38 0.106 . 1 . . . . A 19 SER CB . 34785 1
150 . 1 . 1 19 19 SER N N 15 111.416 0.12 . 1 . . . . A 19 SER N . 34785 1
151 . 1 . 1 20 20 PRO HA H 1 4.528 0.017 . 1 . . . . A 20 PRO HA . 34785 1
152 . 1 . 1 20 20 PRO HB2 H 1 2.09 0.016 . 2 . . . . A 20 PRO HB2 . 34785 1
153 . 1 . 1 20 20 PRO HB3 H 1 2.57 0.013 . 2 . . . . A 20 PRO HB3 . 34785 1
154 . 1 . 1 20 20 PRO HG2 H 1 1.43 0.016 . 2 . . . . A 20 PRO HG2 . 34785 1
155 . 1 . 1 20 20 PRO HG3 H 1 1.906 0.012 . 2 . . . . A 20 PRO HG3 . 34785 1
156 . 1 . 1 20 20 PRO HD2 H 1 1.693 0.013 . 2 . . . . A 20 PRO HD2 . 34785 1
157 . 1 . 1 20 20 PRO HD3 H 1 2.717 0.021 . 2 . . . . A 20 PRO HD3 . 34785 1
158 . 1 . 1 20 20 PRO C C 13 169.452 0 . 1 . . . . A 20 PRO C . 34785 1
159 . 1 . 1 20 20 PRO CA C 13 65.202 0.137 . 1 . . . . A 20 PRO CA . 34785 1
160 . 1 . 1 20 20 PRO CB C 13 31.626 0.11 . 1 . . . . A 20 PRO CB . 34785 1
161 . 1 . 1 20 20 PRO CG C 13 27.129 0.15 . 1 . . . . A 20 PRO CG . 34785 1
162 . 1 . 1 20 20 PRO CD C 13 49.937 0.08 . 1 . . . . A 20 PRO CD . 34785 1
163 . 1 . 1 21 21 ARG H H 1 8.062 0.156 . 1 . . . . A 21 ARG H . 34785 1
164 . 1 . 1 21 21 ARG C C 13 169.166 0 . 1 . . . . A 21 ARG C . 34785 1
165 . 1 . 1 21 21 ARG CA C 13 55.418 0 . 1 . . . . A 21 ARG CA . 34785 1
166 . 1 . 1 21 21 ARG CB C 13 28.482 0 . 1 . . . . A 21 ARG CB . 34785 1
167 . 1 . 1 21 21 ARG N N 15 112.629 0.129 . 1 . . . . A 21 ARG N . 34785 1
168 . 1 . 1 22 22 GLU H H 1 7.944 0.015 . 1 . . . . A 22 GLU H . 34785 1
169 . 1 . 1 22 22 GLU HA H 1 5.443 0.021 . 1 . . . . A 22 GLU HA . 34785 1
170 . 1 . 1 22 22 GLU HB2 H 1 1.978 0.025 . 2 . . . . A 22 GLU HB2 . 34785 1
171 . 1 . 1 22 22 GLU HB3 H 1 2.167 0.037 . 2 . . . . A 22 GLU HB3 . 34785 1
172 . 1 . 1 22 22 GLU HG2 H 1 2.228 0.053 . 2 . . . . A 22 GLU HG2 . 34785 1
173 . 1 . 1 22 22 GLU HG3 H 1 2.507 0.017 . 2 . . . . A 22 GLU HG3 . 34785 1
174 . 1 . 1 22 22 GLU C C 13 167.195 0 . 1 . . . . A 22 GLU C . 34785 1
175 . 1 . 1 22 22 GLU CA C 13 55.842 0.155 . 1 . . . . A 22 GLU CA . 34785 1
176 . 1 . 1 22 22 GLU CB C 13 33.608 0.131 . 1 . . . . A 22 GLU CB . 34785 1
177 . 1 . 1 22 22 GLU CG C 13 37.271 0.133 . 1 . . . . A 22 GLU CG . 34785 1
178 . 1 . 1 22 22 GLU N N 15 122.905 0.106 . 1 . . . . A 22 GLU N . 34785 1
179 . 1 . 1 23 23 VAL H H 1 7.753 0.03 . 1 . . . . A 23 VAL H . 34785 1
180 . 1 . 1 23 23 VAL HA H 1 4.733 0.011 . 1 . . . . A 23 VAL HA . 34785 1
181 . 1 . 1 23 23 VAL HB H 1 2.018 0.023 . 1 . . . . A 23 VAL HB . 34785 1
182 . 1 . 1 23 23 VAL HG11 H 1 0.711 0.026 . 2 . . . . A 23 VAL HG11 . 34785 1
183 . 1 . 1 23 23 VAL HG12 H 1 0.711 0.026 . 2 . . . . A 23 VAL HG12 . 34785 1
184 . 1 . 1 23 23 VAL HG13 H 1 0.711 0.026 . 2 . . . . A 23 VAL HG13 . 34785 1
185 . 1 . 1 23 23 VAL HG21 H 1 0.73 0.025 . 2 . . . . A 23 VAL HG21 . 34785 1
186 . 1 . 1 23 23 VAL HG22 H 1 0.73 0.025 . 2 . . . . A 23 VAL HG22 . 34785 1
187 . 1 . 1 23 23 VAL HG23 H 1 0.73 0.025 . 2 . . . . A 23 VAL HG23 . 34785 1
188 . 1 . 1 23 23 VAL C C 13 164.438 0 . 1 . . . . A 23 VAL C . 34785 1
189 . 1 . 1 23 23 VAL CA C 13 59.301 0.146 . 1 . . . . A 23 VAL CA . 34785 1
190 . 1 . 1 23 23 VAL CB C 13 35.263 0.147 . 1 . . . . A 23 VAL CB . 34785 1
191 . 1 . 1 23 23 VAL CG1 C 13 19.767 0.118 . 2 . . . . A 23 VAL CG1 . 34785 1
192 . 1 . 1 23 23 VAL CG2 C 13 21.45 0.126 . 2 . . . . A 23 VAL CG2 . 34785 1
193 . 1 . 1 23 23 VAL N N 15 112.079 0.244 . 1 . . . . A 23 VAL N . 34785 1
194 . 1 . 1 24 24 THR H H 1 6.593 0.034 . 1 . . . . A 24 THR H . 34785 1
195 . 1 . 1 24 24 THR HA H 1 5.399 0.007 . 1 . . . . A 24 THR HA . 34785 1
196 . 1 . 1 24 24 THR HB H 1 4.03 0.02 . 1 . . . . A 24 THR HB . 34785 1
197 . 1 . 1 24 24 THR HG21 H 1 1.506 0.015 . 1 . . . . A 24 THR HG21 . 34785 1
198 . 1 . 1 24 24 THR HG22 H 1 1.506 0.015 . 1 . . . . A 24 THR HG22 . 34785 1
199 . 1 . 1 24 24 THR HG23 H 1 1.506 0.015 . 1 . . . . A 24 THR HG23 . 34785 1
200 . 1 . 1 24 24 THR C C 13 166.672 0 . 1 . . . . A 24 THR C . 34785 1
201 . 1 . 1 24 24 THR CA C 13 61.927 0.073 . 1 . . . . A 24 THR CA . 34785 1
202 . 1 . 1 24 24 THR CB C 13 71.525 0.091 . 1 . . . . A 24 THR CB . 34785 1
203 . 1 . 1 24 24 THR CG2 C 13 21.319 0.189 . 1 . . . . A 24 THR CG2 . 34785 1
204 . 1 . 1 24 24 THR N N 15 116.957 0.113 . 1 . . . . A 24 THR N . 34785 1
205 . 1 . 1 25 25 MET H H 1 9.627 0.021 . 1 . . . . A 25 MET H . 34785 1
206 . 1 . 1 25 25 MET HA H 1 5.149 0.009 . 1 . . . . A 25 MET HA . 34785 1
207 . 1 . 1 25 25 MET HB2 H 1 1.895 0.014 . 2 . . . . A 25 MET HB2 . 34785 1
208 . 1 . 1 25 25 MET HB3 H 1 2.344 0.028 . 2 . . . . A 25 MET HB3 . 34785 1
209 . 1 . 1 25 25 MET HG2 H 1 2.347 0.025 . 2 . . . . A 25 MET HG2 . 34785 1
210 . 1 . 1 25 25 MET HG3 H 1 2.747 0.018 . 2 . . . . A 25 MET HG3 . 34785 1
211 . 1 . 1 25 25 MET HE1 H 1 2.384 0.021 . 1 . . . . A 25 MET HE1 . 34785 1
212 . 1 . 1 25 25 MET HE2 H 1 2.384 0.021 . 1 . . . . A 25 MET HE2 . 34785 1
213 . 1 . 1 25 25 MET HE3 H 1 2.384 0.021 . 1 . . . . A 25 MET HE3 . 34785 1
214 . 1 . 1 25 25 MET C C 13 165.891 0 . 1 . . . . A 25 MET C . 34785 1
215 . 1 . 1 25 25 MET CA C 13 53.73 0.075 . 1 . . . . A 25 MET CA . 34785 1
216 . 1 . 1 25 25 MET CB C 13 36.261 0.123 . 1 . . . . A 25 MET CB . 34785 1
217 . 1 . 1 25 25 MET CG C 13 31.513 0.179 . 1 . . . . A 25 MET CG . 34785 1
218 . 1 . 1 25 25 MET CE C 13 19.264 0.132 . 1 . . . . A 25 MET CE . 34785 1
219 . 1 . 1 25 25 MET N N 15 121.475 0.125 . 1 . . . . A 25 MET N . 34785 1
220 . 1 . 1 26 26 LYS H H 1 9.288 0.017 . 1 . . . . A 26 LYS H . 34785 1
221 . 1 . 1 26 26 LYS HA H 1 5.067 0.017 . 1 . . . . A 26 LYS HA . 34785 1
222 . 1 . 1 26 26 LYS HB2 H 1 1.887 0.022 . 2 . . . . A 26 LYS HB2 . 34785 1
223 . 1 . 1 26 26 LYS HB3 H 1 1.887 0.022 . 2 . . . . A 26 LYS HB3 . 34785 1
224 . 1 . 1 26 26 LYS HG2 H 1 1.532 0.021 . 2 . . . . A 26 LYS HG2 . 34785 1
225 . 1 . 1 26 26 LYS HG3 H 1 1.532 0.021 . 2 . . . . A 26 LYS HG3 . 34785 1
226 . 1 . 1 26 26 LYS HD2 H 1 1.86 0.042 . 2 . . . . A 26 LYS HD2 . 34785 1
227 . 1 . 1 26 26 LYS HD3 H 1 1.86 0.042 . 2 . . . . A 26 LYS HD3 . 34785 1
228 . 1 . 1 26 26 LYS HE2 H 1 2.611 0 . 2 . . . . A 26 LYS HE2 . 34785 1
229 . 1 . 1 26 26 LYS HE3 H 1 3.15 0.007 . 2 . . . . A 26 LYS HE3 . 34785 1
230 . 1 . 1 26 26 LYS C C 13 167.456 0 . 1 . . . . A 26 LYS C . 34785 1
231 . 1 . 1 26 26 LYS CA C 13 53.36 0.23 . 1 . . . . A 26 LYS CA . 34785 1
232 . 1 . 1 26 26 LYS CB C 13 33.982 0.13 . 1 . . . . A 26 LYS CB . 34785 1
233 . 1 . 1 26 26 LYS CG C 13 24.227 0.203 . 1 . . . . A 26 LYS CG . 34785 1
234 . 1 . 1 26 26 LYS CD C 13 28.839 0.306 . 1 . . . . A 26 LYS CD . 34785 1
235 . 1 . 1 26 26 LYS CE C 13 41.958 0.188 . 1 . . . . A 26 LYS CE . 34785 1
236 . 1 . 1 26 26 LYS N N 15 125.123 0.153 . 1 . . . . A 26 LYS N . 34785 1
237 . 1 . 1 27 27 LYS H H 1 9.282 0.024 . 1 . . . . A 27 LYS H . 34785 1
238 . 1 . 1 27 27 LYS HA H 1 3.387 0.022 . 1 . . . . A 27 LYS HA . 34785 1
239 . 1 . 1 27 27 LYS HB2 H 1 1.227 0.027 . 2 . . . . A 27 LYS HB2 . 34785 1
240 . 1 . 1 27 27 LYS HB3 H 1 1.666 0.041 . 2 . . . . A 27 LYS HB3 . 34785 1
241 . 1 . 1 27 27 LYS HG2 H 1 1.211 0.029 . 2 . . . . A 27 LYS HG2 . 34785 1
242 . 1 . 1 27 27 LYS HG3 H 1 1.211 0.029 . 2 . . . . A 27 LYS HG3 . 34785 1
243 . 1 . 1 27 27 LYS HD2 H 1 1.771 0.02 . 2 . . . . A 27 LYS HD2 . 34785 1
244 . 1 . 1 27 27 LYS HD3 H 1 1.771 0.02 . 2 . . . . A 27 LYS HD3 . 34785 1
245 . 1 . 1 27 27 LYS HE2 H 1 3.101 0.022 . 2 . . . . A 27 LYS HE2 . 34785 1
246 . 1 . 1 27 27 LYS HE3 H 1 3.101 0.022 . 2 . . . . A 27 LYS HE3 . 34785 1
247 . 1 . 1 27 27 LYS C C 13 170.336 0 . 1 . . . . A 27 LYS C . 34785 1
248 . 1 . 1 27 27 LYS CA C 13 58.33 0.099 . 1 . . . . A 27 LYS CA . 34785 1
249 . 1 . 1 27 27 LYS CB C 13 32.247 0.125 . 1 . . . . A 27 LYS CB . 34785 1
250 . 1 . 1 27 27 LYS CG C 13 24.071 0.12 . 1 . . . . A 27 LYS CG . 34785 1
251 . 1 . 1 27 27 LYS CD C 13 29.456 0.093 . 1 . . . . A 27 LYS CD . 34785 1
252 . 1 . 1 27 27 LYS CE C 13 41.764 0.147 . 1 . . . . A 27 LYS CE . 34785 1
253 . 1 . 1 27 27 LYS N N 15 122.348 0.104 . 1 . . . . A 27 LYS N . 34785 1
254 . 1 . 1 28 28 GLY H H 1 9.143 0.016 . 1 . . . . A 28 GLY H . 34785 1
255 . 1 . 1 28 28 GLY HA2 H 1 3.626 0.019 . 2 . . . . A 28 GLY HA2 . 34785 1
256 . 1 . 1 28 28 GLY HA3 H 1 4.545 0.018 . 2 . . . . A 28 GLY HA3 . 34785 1
257 . 1 . 1 28 28 GLY C C 13 166.055 0 . 1 . . . . A 28 GLY C . 34785 1
258 . 1 . 1 28 28 GLY CA C 13 44.924 0.124 . 1 . . . . A 28 GLY CA . 34785 1
259 . 1 . 1 28 28 GLY N N 15 117.018 0.126 . 1 . . . . A 28 GLY N . 34785 1
260 . 1 . 1 29 29 ASP H H 1 8.645 0.017 . 1 . . . . A 29 ASP H . 34785 1
261 . 1 . 1 29 29 ASP HA H 1 4.892 0.014 . 1 . . . . A 29 ASP HA . 34785 1
262 . 1 . 1 29 29 ASP HB2 H 1 2.571 0.014 . 2 . . . . A 29 ASP HB2 . 34785 1
263 . 1 . 1 29 29 ASP HB3 H 1 3.069 0.024 . 2 . . . . A 29 ASP HB3 . 34785 1
264 . 1 . 1 29 29 ASP C C 13 167.622 0 . 1 . . . . A 29 ASP C . 34785 1
265 . 1 . 1 29 29 ASP CA C 13 55.106 0.116 . 1 . . . . A 29 ASP CA . 34785 1
266 . 1 . 1 29 29 ASP CB C 13 42.015 0.128 . 1 . . . . A 29 ASP CB . 34785 1
267 . 1 . 1 29 29 ASP N N 15 122.382 0.142 . 1 . . . . A 29 ASP N . 34785 1
268 . 1 . 1 30 30 ILE H H 1 8.876 0.019 . 1 . . . . A 30 ILE H . 34785 1
269 . 1 . 1 30 30 ILE HA H 1 5.097 0.009 . 1 . . . . A 30 ILE HA . 34785 1
270 . 1 . 1 30 30 ILE HB H 1 2.475 0.018 . 1 . . . . A 30 ILE HB . 34785 1
271 . 1 . 1 30 30 ILE HG12 H 1 1.721 0.022 . 2 . . . . A 30 ILE HG12 . 34785 1
272 . 1 . 1 30 30 ILE HG13 H 1 1.721 0.022 . 2 . . . . A 30 ILE HG13 . 34785 1
273 . 1 . 1 30 30 ILE HG21 H 1 0.883 0.026 . 1 . . . . A 30 ILE HG21 . 34785 1
274 . 1 . 1 30 30 ILE HG22 H 1 0.883 0.026 . 1 . . . . A 30 ILE HG22 . 34785 1
275 . 1 . 1 30 30 ILE HG23 H 1 0.883 0.026 . 1 . . . . A 30 ILE HG23 . 34785 1
276 . 1 . 1 30 30 ILE HD11 H 1 1.104 0.009 . 1 . . . . A 30 ILE HD11 . 34785 1
277 . 1 . 1 30 30 ILE HD12 H 1 1.104 0.009 . 1 . . . . A 30 ILE HD12 . 34785 1
278 . 1 . 1 30 30 ILE HD13 H 1 1.104 0.009 . 1 . . . . A 30 ILE HD13 . 34785 1
279 . 1 . 1 30 30 ILE C C 13 169.146 0 . 1 . . . . A 30 ILE C . 34785 1
280 . 1 . 1 30 30 ILE CA C 13 58.014 0.091 . 1 . . . . A 30 ILE CA . 34785 1
281 . 1 . 1 30 30 ILE CB C 13 35.532 0.09 . 1 . . . . A 30 ILE CB . 34785 1
282 . 1 . 1 30 30 ILE CG1 C 13 26.502 0.223 . 1 . . . . A 30 ILE CG1 . 34785 1
283 . 1 . 1 30 30 ILE CG2 C 13 17.753 0.084 . 1 . . . . A 30 ILE CG2 . 34785 1
284 . 1 . 1 30 30 ILE CD1 C 13 11.008 0.071 . 1 . . . . A 30 ILE CD1 . 34785 1
285 . 1 . 1 30 30 ILE N N 15 120.11 0.175 . 1 . . . . A 30 ILE N . 34785 1
286 . 1 . 1 31 31 LEU H H 1 9.775 0.012 . 1 . . . . A 31 LEU H . 34785 1
287 . 1 . 1 31 31 LEU HA H 1 5.156 0.01 . 1 . . . . A 31 LEU HA . 34785 1
288 . 1 . 1 31 31 LEU HB2 H 1 1.594 0.024 . 2 . . . . A 31 LEU HB2 . 34785 1
289 . 1 . 1 31 31 LEU HB3 H 1 1.766 0.036 . 2 . . . . A 31 LEU HB3 . 34785 1
290 . 1 . 1 31 31 LEU HG H 1 1.828 0.012 . 1 . . . . A 31 LEU HG . 34785 1
291 . 1 . 1 31 31 LEU HD11 H 1 0.932 0.004 . 2 . . . . A 31 LEU HD11 . 34785 1
292 . 1 . 1 31 31 LEU HD12 H 1 0.932 0.004 . 2 . . . . A 31 LEU HD12 . 34785 1
293 . 1 . 1 31 31 LEU HD13 H 1 0.932 0.004 . 2 . . . . A 31 LEU HD13 . 34785 1
294 . 1 . 1 31 31 LEU HD21 H 1 1.084 0.012 . 2 . . . . A 31 LEU HD21 . 34785 1
295 . 1 . 1 31 31 LEU HD22 H 1 1.084 0.012 . 2 . . . . A 31 LEU HD22 . 34785 1
296 . 1 . 1 31 31 LEU HD23 H 1 1.084 0.012 . 2 . . . . A 31 LEU HD23 . 34785 1
297 . 1 . 1 31 31 LEU C C 13 168.979 0 . 1 . . . . A 31 LEU C . 34785 1
298 . 1 . 1 31 31 LEU CA C 13 52.88 0.063 . 1 . . . . A 31 LEU CA . 34785 1
299 . 1 . 1 31 31 LEU CB C 13 42.593 0.152 . 1 . . . . A 31 LEU CB . 34785 1
300 . 1 . 1 31 31 LEU CG C 13 27.389 0.104 . 1 . . . . A 31 LEU CG . 34785 1
301 . 1 . 1 31 31 LEU CD1 C 13 26.42 0.153 . 2 . . . . A 31 LEU CD1 . 34785 1
302 . 1 . 1 31 31 LEU CD2 C 13 27.288 0.117 . 2 . . . . A 31 LEU CD2 . 34785 1
303 . 1 . 1 31 31 LEU N N 15 128.782 0.132 . 1 . . . . A 31 LEU N . 34785 1
304 . 1 . 1 32 32 THR H H 1 8.409 0.016 . 1 . . . . A 32 THR H . 34785 1
305 . 1 . 1 32 32 THR HA H 1 4.754 0.016 . 1 . . . . A 32 THR HA . 34785 1
306 . 1 . 1 32 32 THR HB H 1 4.325 0.014 . 1 . . . . A 32 THR HB . 34785 1
307 . 1 . 1 32 32 THR HG21 H 1 1.351 0.016 . 1 . . . . A 32 THR HG21 . 34785 1
308 . 1 . 1 32 32 THR HG22 H 1 1.351 0.016 . 1 . . . . A 32 THR HG22 . 34785 1
309 . 1 . 1 32 32 THR HG23 H 1 1.351 0.016 . 1 . . . . A 32 THR HG23 . 34785 1
310 . 1 . 1 32 32 THR C C 13 166.092 0 . 1 . . . . A 32 THR C . 34785 1
311 . 1 . 1 32 32 THR CA C 13 62.681 0.095 . 1 . . . . A 32 THR CA . 34785 1
312 . 1 . 1 32 32 THR CB C 13 69.294 0.096 . 1 . . . . A 32 THR CB . 34785 1
313 . 1 . 1 32 32 THR CG2 C 13 22.79 0.158 . 1 . . . . A 32 THR CG2 . 34785 1
314 . 1 . 1 32 32 THR N N 15 119.155 0.138 . 1 . . . . A 32 THR N . 34785 1
315 . 1 . 1 33 33 LEU H H 1 9.123 0.015 . 1 . . . . A 33 LEU H . 34785 1
316 . 1 . 1 33 33 LEU HA H 1 4.405 0.018 . 1 . . . . A 33 LEU HA . 34785 1
317 . 1 . 1 33 33 LEU HB2 H 1 1.092 0.022 . 2 . . . . A 33 LEU HB2 . 34785 1
318 . 1 . 1 33 33 LEU HB3 H 1 1.896 0.012 . 2 . . . . A 33 LEU HB3 . 34785 1
319 . 1 . 1 33 33 LEU HG H 1 1.315 0.017 . 1 . . . . A 33 LEU HG . 34785 1
320 . 1 . 1 33 33 LEU HD11 H 1 0.469 0.022 . 2 . . . . A 33 LEU HD11 . 34785 1
321 . 1 . 1 33 33 LEU HD12 H 1 0.469 0.022 . 2 . . . . A 33 LEU HD12 . 34785 1
322 . 1 . 1 33 33 LEU HD13 H 1 0.469 0.022 . 2 . . . . A 33 LEU HD13 . 34785 1
323 . 1 . 1 33 33 LEU HD21 H 1 0.803 0.03 . 2 . . . . A 33 LEU HD21 . 34785 1
324 . 1 . 1 33 33 LEU HD22 H 1 0.803 0.03 . 2 . . . . A 33 LEU HD22 . 34785 1
325 . 1 . 1 33 33 LEU HD23 H 1 0.803 0.03 . 2 . . . . A 33 LEU HD23 . 34785 1
326 . 1 . 1 33 33 LEU C C 13 166.965 0 . 1 . . . . A 33 LEU C . 34785 1
327 . 1 . 1 33 33 LEU CA C 13 54.902 0.115 . 1 . . . . A 33 LEU CA . 34785 1
328 . 1 . 1 33 33 LEU CB C 13 42.899 0.09 . 1 . . . . A 33 LEU CB . 34785 1
329 . 1 . 1 33 33 LEU CG C 13 26.519 0.125 . 1 . . . . A 33 LEU CG . 34785 1
330 . 1 . 1 33 33 LEU CD1 C 13 23.693 0.07 . 2 . . . . A 33 LEU CD1 . 34785 1
331 . 1 . 1 33 33 LEU CD2 C 13 25.301 0.169 . 2 . . . . A 33 LEU CD2 . 34785 1
332 . 1 . 1 33 33 LEU N N 15 130.518 0.111 . 1 . . . . A 33 LEU N . 34785 1
333 . 1 . 1 34 34 LEU H H 1 9.18 0.029 . 1 . . . . A 34 LEU H . 34785 1
334 . 1 . 1 34 34 LEU HA H 1 4.687 0.019 . 1 . . . . A 34 LEU HA . 34785 1
335 . 1 . 1 34 34 LEU HB2 H 1 1.595 0.042 . 2 . . . . A 34 LEU HB2 . 34785 1
336 . 1 . 1 34 34 LEU HB3 H 1 1.595 0.042 . 2 . . . . A 34 LEU HB3 . 34785 1
337 . 1 . 1 34 34 LEU HG H 1 1.611 0.022 . 1 . . . . A 34 LEU HG . 34785 1
338 . 1 . 1 34 34 LEU HD11 H 1 0.773 0.035 . 2 . . . . A 34 LEU HD11 . 34785 1
339 . 1 . 1 34 34 LEU HD12 H 1 0.773 0.035 . 2 . . . . A 34 LEU HD12 . 34785 1
340 . 1 . 1 34 34 LEU HD13 H 1 0.773 0.035 . 2 . . . . A 34 LEU HD13 . 34785 1
341 . 1 . 1 34 34 LEU HD21 H 1 0.824 0.012 . 2 . . . . A 34 LEU HD21 . 34785 1
342 . 1 . 1 34 34 LEU HD22 H 1 0.824 0.012 . 2 . . . . A 34 LEU HD22 . 34785 1
343 . 1 . 1 34 34 LEU HD23 H 1 0.824 0.012 . 2 . . . . A 34 LEU HD23 . 34785 1
344 . 1 . 1 34 34 LEU C C 13 169.912 0 . 1 . . . . A 34 LEU C . 34785 1
345 . 1 . 1 34 34 LEU CA C 13 54.864 0.118 . 1 . . . . A 34 LEU CA . 34785 1
346 . 1 . 1 34 34 LEU CB C 13 42.902 0.092 . 1 . . . . A 34 LEU CB . 34785 1
347 . 1 . 1 34 34 LEU CG C 13 26.61 0.135 . 1 . . . . A 34 LEU CG . 34785 1
348 . 1 . 1 34 34 LEU CD1 C 13 22.052 0.164 . 2 . . . . A 34 LEU CD1 . 34785 1
349 . 1 . 1 34 34 LEU CD2 C 13 25.687 0.128 . 2 . . . . A 34 LEU CD2 . 34785 1
350 . 1 . 1 34 34 LEU N N 15 125.83 0.113 . 1 . . . . A 34 LEU N . 34785 1
351 . 1 . 1 35 35 ASN H H 1 7.678 0.022 . 1 . . . . A 35 ASN H . 34785 1
352 . 1 . 1 35 35 ASN HA H 1 4.901 0.009 . 1 . . . . A 35 ASN HA . 34785 1
353 . 1 . 1 35 35 ASN HB2 H 1 2.735 0.023 . 2 . . . . A 35 ASN HB2 . 34785 1
354 . 1 . 1 35 35 ASN HB3 H 1 2.97 0.007 . 2 . . . . A 35 ASN HB3 . 34785 1
355 . 1 . 1 35 35 ASN HD21 H 1 7.042 0.043 . 1 . . . . A 35 ASN HD21 . 34785 1
356 . 1 . 1 35 35 ASN HD22 H 1 8.253 0.027 . 1 . . . . A 35 ASN HD22 . 34785 1
357 . 1 . 1 35 35 ASN C C 13 166.994 0 . 1 . . . . A 35 ASN C . 34785 1
358 . 1 . 1 35 35 ASN CA C 13 54.029 0.094 . 1 . . . . A 35 ASN CA . 34785 1
359 . 1 . 1 35 35 ASN CB C 13 40.399 0.105 . 1 . . . . A 35 ASN CB . 34785 1
360 . 1 . 1 35 35 ASN CG C 13 168.166 0 . 1 . . . . A 35 ASN CG . 34785 1
361 . 1 . 1 35 35 ASN N N 15 114.192 0.101 . 1 . . . . A 35 ASN N . 34785 1
362 . 1 . 1 35 35 ASN ND2 N 15 116.678 0.152 . 1 . . . . A 35 ASN ND2 . 34785 1
363 . 1 . 1 36 36 SER H H 1 9.564 0.03 . 1 . . . . A 36 SER H . 34785 1
364 . 1 . 1 36 36 SER HA H 1 4.142 0.022 . 1 . . . . A 36 SER HA . 34785 1
365 . 1 . 1 36 36 SER HB2 H 1 2.081 0.023 . 2 . . . . A 36 SER HB2 . 34785 1
366 . 1 . 1 36 36 SER HB3 H 1 2.915 0.023 . 2 . . . . A 36 SER HB3 . 34785 1
367 . 1 . 1 36 36 SER C C 13 166.111 0 . 1 . . . . A 36 SER C . 34785 1
368 . 1 . 1 36 36 SER CA C 13 56.744 0.124 . 1 . . . . A 36 SER CA . 34785 1
369 . 1 . 1 36 36 SER CB C 13 61.882 0.09 . 1 . . . . A 36 SER CB . 34785 1
370 . 1 . 1 36 36 SER N N 15 125.255 0.205 . 1 . . . . A 36 SER N . 34785 1
371 . 1 . 1 37 37 THR H H 1 8.409 0.023 . 1 . . . . A 37 THR H . 34785 1
372 . 1 . 1 37 37 THR HA H 1 4.22 0.012 . 1 . . . . A 37 THR HA . 34785 1
373 . 1 . 1 37 37 THR HB H 1 4.456 0.018 . 1 . . . . A 37 THR HB . 34785 1
374 . 1 . 1 37 37 THR HG21 H 1 1.581 0.016 . 1 . . . . A 37 THR HG21 . 34785 1
375 . 1 . 1 37 37 THR HG22 H 1 1.581 0.016 . 1 . . . . A 37 THR HG22 . 34785 1
376 . 1 . 1 37 37 THR HG23 H 1 1.581 0.016 . 1 . . . . A 37 THR HG23 . 34785 1
377 . 1 . 1 37 37 THR C C 13 168.3 0 . 1 . . . . A 37 THR C . 34785 1
378 . 1 . 1 37 37 THR CA C 13 64.828 0.101 . 1 . . . . A 37 THR CA . 34785 1
379 . 1 . 1 37 37 THR CB C 13 70.458 0.118 . 1 . . . . A 37 THR CB . 34785 1
380 . 1 . 1 37 37 THR CG2 C 13 22.403 0.145 . 1 . . . . A 37 THR CG2 . 34785 1
381 . 1 . 1 37 37 THR N N 15 112.905 0.105 . 1 . . . . A 37 THR N . 34785 1
382 . 1 . 1 38 38 ASN H H 1 9.576 0.021 . 1 . . . . A 38 ASN H . 34785 1
383 . 1 . 1 38 38 ASN HA H 1 5.169 0.017 . 1 . . . . A 38 ASN HA . 34785 1
384 . 1 . 1 38 38 ASN HB2 H 1 3.213 0.029 . 2 . . . . A 38 ASN HB2 . 34785 1
385 . 1 . 1 38 38 ASN HB3 H 1 4.015 0.041 . 2 . . . . A 38 ASN HB3 . 34785 1
386 . 1 . 1 38 38 ASN C C 13 167.266 0 . 1 . . . . A 38 ASN C . 34785 1
387 . 1 . 1 38 38 ASN CA C 13 54.05 0.166 . 1 . . . . A 38 ASN CA . 34785 1
388 . 1 . 1 38 38 ASN CB C 13 41.336 0.092 . 1 . . . . A 38 ASN CB . 34785 1
389 . 1 . 1 38 38 ASN N N 15 126.039 0.077 . 1 . . . . A 38 ASN N . 34785 1
390 . 1 . 1 39 39 LYS H H 1 8.862 0.025 . 1 . . . . A 39 LYS H . 34785 1
391 . 1 . 1 39 39 LYS HA H 1 4.36 0.013 . 1 . . . . A 39 LYS HA . 34785 1
392 . 1 . 1 39 39 LYS HB2 H 1 1.928 0.02 . 2 . . . . A 39 LYS HB2 . 34785 1
393 . 1 . 1 39 39 LYS HB3 H 1 1.928 0.02 . 2 . . . . A 39 LYS HB3 . 34785 1
394 . 1 . 1 39 39 LYS HG2 H 1 1.473 0.023 . 2 . . . . A 39 LYS HG2 . 34785 1
395 . 1 . 1 39 39 LYS HG3 H 1 1.473 0.023 . 2 . . . . A 39 LYS HG3 . 34785 1
396 . 1 . 1 39 39 LYS HD2 H 1 1.786 0.013 . 2 . . . . A 39 LYS HD2 . 34785 1
397 . 1 . 1 39 39 LYS HD3 H 1 1.786 0.013 . 2 . . . . A 39 LYS HD3 . 34785 1
398 . 1 . 1 39 39 LYS HE2 H 1 3.12 0.015 . 2 . . . . A 39 LYS HE2 . 34785 1
399 . 1 . 1 39 39 LYS HE3 H 1 3.12 0.015 . 2 . . . . A 39 LYS HE3 . 34785 1
400 . 1 . 1 39 39 LYS C C 13 168.728 0 . 1 . . . . A 39 LYS C . 34785 1
401 . 1 . 1 39 39 LYS CA C 13 58.319 0.083 . 1 . . . . A 39 LYS CA . 34785 1
402 . 1 . 1 39 39 LYS CB C 13 32.767 0.089 . 1 . . . . A 39 LYS CB . 34785 1
403 . 1 . 1 39 39 LYS CG C 13 23.644 0.114 . 1 . . . . A 39 LYS CG . 34785 1
404 . 1 . 1 39 39 LYS CD C 13 29.344 0.111 . 1 . . . . A 39 LYS CD . 34785 1
405 . 1 . 1 39 39 LYS CE C 13 41.822 0.16 . 1 . . . . A 39 LYS CE . 34785 1
406 . 1 . 1 39 39 LYS N N 15 121.645 0.13 . 1 . . . . A 39 LYS N . 34785 1
407 . 1 . 1 40 40 ASP H H 1 8.17 0.022 . 1 . . . . A 40 ASP H . 34785 1
408 . 1 . 1 40 40 ASP HA H 1 4.686 0.022 . 1 . . . . A 40 ASP HA . 34785 1
409 . 1 . 1 40 40 ASP HB2 H 1 2.232 0.02 . 2 . . . . A 40 ASP HB2 . 34785 1
410 . 1 . 1 40 40 ASP HB3 H 1 2.855 0.018 . 2 . . . . A 40 ASP HB3 . 34785 1
411 . 1 . 1 40 40 ASP C C 13 169.531 0 . 1 . . . . A 40 ASP C . 34785 1
412 . 1 . 1 40 40 ASP CA C 13 55.513 0.09 . 1 . . . . A 40 ASP CA . 34785 1
413 . 1 . 1 40 40 ASP CB C 13 44.149 0.086 . 1 . . . . A 40 ASP CB . 34785 1
414 . 1 . 1 40 40 ASP N N 15 115.801 0.149 . 1 . . . . A 40 ASP N . 34785 1
415 . 1 . 1 41 41 TRP H H 1 8.663 0.014 . 1 . . . . A 41 TRP H . 34785 1
416 . 1 . 1 41 41 TRP HA H 1 5.112 0.009 . 1 . . . . A 41 TRP HA . 34785 1
417 . 1 . 1 41 41 TRP HB2 H 1 2.722 0.006 . 2 . . . . A 41 TRP HB2 . 34785 1
418 . 1 . 1 41 41 TRP HB3 H 1 3.064 0.011 . 2 . . . . A 41 TRP HB3 . 34785 1
419 . 1 . 1 41 41 TRP HE1 H 1 10.211 0.02 . 1 . . . . A 41 TRP HE1 . 34785 1
420 . 1 . 1 41 41 TRP C C 13 166.773 0 . 1 . . . . A 41 TRP C . 34785 1
421 . 1 . 1 41 41 TRP CA C 13 55.911 0.073 . 1 . . . . A 41 TRP CA . 34785 1
422 . 1 . 1 41 41 TRP CB C 13 32.361 0.084 . 1 . . . . A 41 TRP CB . 34785 1
423 . 1 . 1 41 41 TRP N N 15 122.818 0.139 . 1 . . . . A 41 TRP N . 34785 1
424 . 1 . 1 41 41 TRP NE1 N 15 128.812 0.094 . 1 . . . . A 41 TRP NE1 . 34785 1
425 . 1 . 1 42 42 TRP H H 1 9.491 0.018 . 1 . . . . A 42 TRP H . 34785 1
426 . 1 . 1 42 42 TRP HA H 1 5.712 0.021 . 1 . . . . A 42 TRP HA . 34785 1
427 . 1 . 1 42 42 TRP HB2 H 1 2.816 0.026 . 2 . . . . A 42 TRP HB2 . 34785 1
428 . 1 . 1 42 42 TRP HB3 H 1 3.116 0.015 . 2 . . . . A 42 TRP HB3 . 34785 1
429 . 1 . 1 42 42 TRP HE1 H 1 9.567 0.017 . 1 . . . . A 42 TRP HE1 . 34785 1
430 . 1 . 1 42 42 TRP C C 13 166.766 0 . 1 . . . . A 42 TRP C . 34785 1
431 . 1 . 1 42 42 TRP CA C 13 53.635 0.154 . 1 . . . . A 42 TRP CA . 34785 1
432 . 1 . 1 42 42 TRP CB C 13 31.608 0.146 . 1 . . . . A 42 TRP CB . 34785 1
433 . 1 . 1 42 42 TRP N N 15 124.213 0.109 . 1 . . . . A 42 TRP N . 34785 1
434 . 1 . 1 42 42 TRP NE1 N 15 130.137 0.087 . 1 . . . . A 42 TRP NE1 . 34785 1
435 . 1 . 1 43 43 LYS H H 1 9.176 0.03 . 1 . . . . A 43 LYS H . 34785 1
436 . 1 . 1 43 43 LYS HA H 1 4.401 0.021 . 1 . . . . A 43 LYS HA . 34785 1
437 . 1 . 1 43 43 LYS HB2 H 1 1.133 0.008 . 2 . . . . A 43 LYS HB2 . 34785 1
438 . 1 . 1 43 43 LYS HB3 H 1 1.133 0.008 . 2 . . . . A 43 LYS HB3 . 34785 1
439 . 1 . 1 43 43 LYS HG2 H 1 0.27 0.027 . 2 . . . . A 43 LYS HG2 . 34785 1
440 . 1 . 1 43 43 LYS HG3 H 1 1.017 0.024 . 2 . . . . A 43 LYS HG3 . 34785 1
441 . 1 . 1 43 43 LYS HD2 H 1 1.457 0.017 . 2 . . . . A 43 LYS HD2 . 34785 1
442 . 1 . 1 43 43 LYS HD3 H 1 1.457 0.017 . 2 . . . . A 43 LYS HD3 . 34785 1
443 . 1 . 1 43 43 LYS HE2 H 1 2.721 0.036 . 2 . . . . A 43 LYS HE2 . 34785 1
444 . 1 . 1 43 43 LYS HE3 H 1 2.721 0.036 . 2 . . . . A 43 LYS HE3 . 34785 1
445 . 1 . 1 43 43 LYS C C 13 167.942 0 . 1 . . . . A 43 LYS C . 34785 1
446 . 1 . 1 43 43 LYS CA C 13 54.993 0.163 . 1 . . . . A 43 LYS CA . 34785 1
447 . 1 . 1 43 43 LYS CB C 13 34.58 0.039 . 1 . . . . A 43 LYS CB . 34785 1
448 . 1 . 1 43 43 LYS CG C 13 26.06 0.152 . 1 . . . . A 43 LYS CG . 34785 1
449 . 1 . 1 43 43 LYS CD C 13 29.31 0.068 . 1 . . . . A 43 LYS CD . 34785 1
450 . 1 . 1 43 43 LYS CE C 13 41.726 0.143 . 1 . . . . A 43 LYS CE . 34785 1
451 . 1 . 1 43 43 LYS N N 15 123.88 0.189 . 1 . . . . A 43 LYS N . 34785 1
452 . 1 . 1 44 44 VAL H H 1 9.725 0.013 . 1 . . . . A 44 VAL H . 34785 1
453 . 1 . 1 44 44 VAL HA H 1 5.469 0.017 . 1 . . . . A 44 VAL HA . 34785 1
454 . 1 . 1 44 44 VAL HB H 1 2.256 0.03 . 1 . . . . A 44 VAL HB . 34785 1
455 . 1 . 1 44 44 VAL HG11 H 1 0.902 0.017 . 2 . . . . A 44 VAL HG11 . 34785 1
456 . 1 . 1 44 44 VAL HG12 H 1 0.902 0.017 . 2 . . . . A 44 VAL HG12 . 34785 1
457 . 1 . 1 44 44 VAL HG13 H 1 0.902 0.017 . 2 . . . . A 44 VAL HG13 . 34785 1
458 . 1 . 1 44 44 VAL HG21 H 1 0.903 0.021 . 2 . . . . A 44 VAL HG21 . 34785 1
459 . 1 . 1 44 44 VAL HG22 H 1 0.903 0.021 . 2 . . . . A 44 VAL HG22 . 34785 1
460 . 1 . 1 44 44 VAL HG23 H 1 0.903 0.021 . 2 . . . . A 44 VAL HG23 . 34785 1
461 . 1 . 1 44 44 VAL C C 13 165.684 0 . 1 . . . . A 44 VAL C . 34785 1
462 . 1 . 1 44 44 VAL CA C 13 58.868 0.092 . 1 . . . . A 44 VAL CA . 34785 1
463 . 1 . 1 44 44 VAL CB C 13 36.472 0.144 . 1 . . . . A 44 VAL CB . 34785 1
464 . 1 . 1 44 44 VAL CG1 C 13 18.425 0.1 . 2 . . . . A 44 VAL CG1 . 34785 1
465 . 1 . 1 44 44 VAL CG2 C 13 20.777 0.176 . 2 . . . . A 44 VAL CG2 . 34785 1
466 . 1 . 1 44 44 VAL N N 15 122.499 0.109 . 1 . . . . A 44 VAL N . 34785 1
467 . 1 . 1 45 45 GLU H H 1 9.078 0.025 . 1 . . . . A 45 GLU H . 34785 1
468 . 1 . 1 45 45 GLU HA H 1 5.43 0.014 . 1 . . . . A 45 GLU HA . 34785 1
469 . 1 . 1 45 45 GLU HB2 H 1 1.956 0.013 . 2 . . . . A 45 GLU HB2 . 34785 1
470 . 1 . 1 45 45 GLU HB3 H 1 1.956 0.013 . 2 . . . . A 45 GLU HB3 . 34785 1
471 . 1 . 1 45 45 GLU HG2 H 1 2.289 0.028 . 2 . . . . A 45 GLU HG2 . 34785 1
472 . 1 . 1 45 45 GLU HG3 H 1 2.289 0.028 . 2 . . . . A 45 GLU HG3 . 34785 1
473 . 1 . 1 45 45 GLU C C 13 167.648 0 . 1 . . . . A 45 GLU C . 34785 1
474 . 1 . 1 45 45 GLU CA C 13 54.595 0.092 . 1 . . . . A 45 GLU CA . 34785 1
475 . 1 . 1 45 45 GLU CB C 13 33.762 0.087 . 1 . . . . A 45 GLU CB . 34785 1
476 . 1 . 1 45 45 GLU CG C 13 37.375 0.118 . 1 . . . . A 45 GLU CG . 34785 1
477 . 1 . 1 45 45 GLU N N 15 120.093 0.113 . 1 . . . . A 45 GLU N . 34785 1
478 . 1 . 1 46 46 VAL H H 1 9.079 0.031 . 1 . . . . A 46 VAL H . 34785 1
479 . 1 . 1 46 46 VAL C C 13 167.806 0 . 1 . . . . A 46 VAL C . 34785 1
480 . 1 . 1 46 46 VAL CA C 13 60.424 0 . 1 . . . . A 46 VAL CA . 34785 1
481 . 1 . 1 46 46 VAL CB C 13 33.996 0 . 1 . . . . A 46 VAL CB . 34785 1
482 . 1 . 1 46 46 VAL CG1 C 13 19.589 0 . 2 . . . . A 46 VAL CG1 . 34785 1
483 . 1 . 1 46 46 VAL CG2 C 13 21.107 0 . 2 . . . . A 46 VAL CG2 . 34785 1
484 . 1 . 1 46 46 VAL N N 15 125.913 0.123 . 1 . . . . A 46 VAL N . 34785 1
485 . 1 . 1 47 47 ASN HD21 H 1 7.365 0.014 . 1 . . . . A 47 ASN HD21 . 34785 1
486 . 1 . 1 47 47 ASN HD22 H 1 7.879 0.016 . 1 . . . . A 47 ASN HD22 . 34785 1
487 . 1 . 1 47 47 ASN ND2 N 15 114.553 0.197 . 1 . . . . A 47 ASN ND2 . 34785 1
488 . 1 . 1 48 48 ASP C C 13 167.682 0 . 1 . . . . A 48 ASP C . 34785 1
489 . 1 . 1 49 49 ARG H H 1 8.265 0.022 . 1 . . . . A 49 ARG H . 34785 1
490 . 1 . 1 49 49 ARG HA H 1 4.848 0.009 . 1 . . . . A 49 ARG HA . 34785 1
491 . 1 . 1 49 49 ARG HB2 H 1 1.954 0.014 . 2 . . . . A 49 ARG HB2 . 34785 1
492 . 1 . 1 49 49 ARG HB3 H 1 2.111 0.017 . 2 . . . . A 49 ARG HB3 . 34785 1
493 . 1 . 1 49 49 ARG HG2 H 1 1.758 0.018 . 2 . . . . A 49 ARG HG2 . 34785 1
494 . 1 . 1 49 49 ARG HG3 H 1 2.025 0.016 . 2 . . . . A 49 ARG HG3 . 34785 1
495 . 1 . 1 49 49 ARG HD2 H 1 3.405 0.012 . 2 . . . . A 49 ARG HD2 . 34785 1
496 . 1 . 1 49 49 ARG HD3 H 1 3.567 0.009 . 2 . . . . A 49 ARG HD3 . 34785 1
497 . 1 . 1 49 49 ARG C C 13 167.086 0 . 1 . . . . A 49 ARG C . 34785 1
498 . 1 . 1 49 49 ARG CA C 13 55.229 0.054 . 1 . . . . A 49 ARG CA . 34785 1
499 . 1 . 1 49 49 ARG CB C 13 33.882 0.104 . 1 . . . . A 49 ARG CB . 34785 1
500 . 1 . 1 49 49 ARG CG C 13 27.147 0.152 . 1 . . . . A 49 ARG CG . 34785 1
501 . 1 . 1 49 49 ARG CD C 13 43.628 0.065 . 1 . . . . A 49 ARG CD . 34785 1
502 . 1 . 1 49 49 ARG N N 15 119.678 0.121 . 1 . . . . A 49 ARG N . 34785 1
503 . 1 . 1 50 50 GLN H H 1 8.609 0.023 . 1 . . . . A 50 GLN H . 34785 1
504 . 1 . 1 50 50 GLN HA H 1 5.754 0.008 . 1 . . . . A 50 GLN HA . 34785 1
505 . 1 . 1 50 50 GLN HB2 H 1 1.686 0.027 . 2 . . . . A 50 GLN HB2 . 34785 1
506 . 1 . 1 50 50 GLN HB3 H 1 2.076 0.021 . 2 . . . . A 50 GLN HB3 . 34785 1
507 . 1 . 1 50 50 GLN HG2 H 1 2.322 0.018 . 2 . . . . A 50 GLN HG2 . 34785 1
508 . 1 . 1 50 50 GLN HG3 H 1 2.574 0.013 . 2 . . . . A 50 GLN HG3 . 34785 1
509 . 1 . 1 50 50 GLN HE21 H 1 6.887 0.006 . 1 . . . . A 50 GLN HE21 . 34785 1
510 . 1 . 1 50 50 GLN HE22 H 1 8.033 0.039 . 1 . . . . A 50 GLN HE22 . 34785 1
511 . 1 . 1 50 50 GLN C C 13 168.449 0 . 1 . . . . A 50 GLN C . 34785 1
512 . 1 . 1 50 50 GLN CA C 13 53.223 0.074 . 1 . . . . A 50 GLN CA . 34785 1
513 . 1 . 1 50 50 GLN CB C 13 31.294 0.154 . 1 . . . . A 50 GLN CB . 34785 1
514 . 1 . 1 50 50 GLN CG C 13 33.483 0.155 . 1 . . . . A 50 GLN CG . 34785 1
515 . 1 . 1 50 50 GLN CD C 13 172.315 0 . 1 . . . . A 50 GLN CD . 34785 1
516 . 1 . 1 50 50 GLN N N 15 116.921 0.177 . 1 . . . . A 50 GLN N . 34785 1
517 . 1 . 1 50 50 GLN NE2 N 15 111.944 0.155 . 1 . . . . A 50 GLN NE2 . 34785 1
518 . 1 . 1 51 51 GLY H H 1 8.947 0.024 . 1 . . . . A 51 GLY H . 34785 1
519 . 1 . 1 51 51 GLY HA2 H 1 3.976 0.02 . 2 . . . . A 51 GLY HA2 . 34785 1
520 . 1 . 1 51 51 GLY HA3 H 1 4.252 0.013 . 2 . . . . A 51 GLY HA3 . 34785 1
521 . 1 . 1 51 51 GLY C C 13 163.029 0 . 1 . . . . A 51 GLY C . 34785 1
522 . 1 . 1 51 51 GLY CA C 13 45.672 0.087 . 1 . . . . A 51 GLY CA . 34785 1
523 . 1 . 1 51 51 GLY N N 15 107.418 0.076 . 1 . . . . A 51 GLY N . 34785 1
524 . 1 . 1 52 52 PHE H H 1 9.449 0.024 . 1 . . . . A 52 PHE H . 34785 1
525 . 1 . 1 52 52 PHE HA H 1 5.732 0.026 . 1 . . . . A 52 PHE HA . 34785 1
526 . 1 . 1 52 52 PHE HB2 H 1 2.682 0.023 . 2 . . . . A 52 PHE HB2 . 34785 1
527 . 1 . 1 52 52 PHE HB3 H 1 3.36 0.005 . 2 . . . . A 52 PHE HB3 . 34785 1
528 . 1 . 1 52 52 PHE C C 13 167.887 0 . 1 . . . . A 52 PHE C . 34785 1
529 . 1 . 1 52 52 PHE CA C 13 58.966 0.112 . 1 . . . . A 52 PHE CA . 34785 1
530 . 1 . 1 52 52 PHE CB C 13 42.285 0.123 . 1 . . . . A 52 PHE CB . 34785 1
531 . 1 . 1 52 52 PHE N N 15 119.058 0.102 . 1 . . . . A 52 PHE N . 34785 1
532 . 1 . 1 53 53 VAL H H 1 9.087 0.019 . 1 . . . . A 53 VAL H . 34785 1
533 . 1 . 1 53 53 VAL HA H 1 4.958 0.013 . 1 . . . . A 53 VAL HA . 34785 1
534 . 1 . 1 53 53 VAL HB H 1 1.97 0.004 . 1 . . . . A 53 VAL HB . 34785 1
535 . 1 . 1 53 53 VAL HG11 H 1 0.741 0.016 . 2 . . . . A 53 VAL HG11 . 34785 1
536 . 1 . 1 53 53 VAL HG12 H 1 0.741 0.016 . 2 . . . . A 53 VAL HG12 . 34785 1
537 . 1 . 1 53 53 VAL HG13 H 1 0.741 0.016 . 2 . . . . A 53 VAL HG13 . 34785 1
538 . 1 . 1 53 53 VAL HG21 H 1 1.197 0.013 . 2 . . . . A 53 VAL HG21 . 34785 1
539 . 1 . 1 53 53 VAL HG22 H 1 1.197 0.013 . 2 . . . . A 53 VAL HG22 . 34785 1
540 . 1 . 1 53 53 VAL HG23 H 1 1.197 0.013 . 2 . . . . A 53 VAL HG23 . 34785 1
541 . 1 . 1 53 53 VAL C C 13 165.036 0 . 1 . . . . A 53 VAL C . 34785 1
542 . 1 . 1 53 53 VAL CA C 13 58.128 0.089 . 1 . . . . A 53 VAL CA . 34785 1
543 . 1 . 1 53 53 VAL CB C 13 33.538 0.051 . 1 . . . . A 53 VAL CB . 34785 1
544 . 1 . 1 53 53 VAL CG1 C 13 16.947 0.117 . 2 . . . . A 53 VAL CG1 . 34785 1
545 . 1 . 1 53 53 VAL CG2 C 13 22.182 0.148 . 2 . . . . A 53 VAL CG2 . 34785 1
546 . 1 . 1 53 53 VAL N N 15 110.548 0.167 . 1 . . . . A 53 VAL N . 34785 1
547 . 1 . 1 54 54 PRO HA H 1 3.497 0.021 . 1 . . . . A 54 PRO HA . 34785 1
548 . 1 . 1 54 54 PRO HB2 H 1 0.381 0.029 . 2 . . . . A 54 PRO HB2 . 34785 1
549 . 1 . 1 54 54 PRO HB3 H 1 1.142 0.029 . 2 . . . . A 54 PRO HB3 . 34785 1
550 . 1 . 1 54 54 PRO HG2 H 1 0.364 0.047 . 2 . . . . A 54 PRO HG2 . 34785 1
551 . 1 . 1 54 54 PRO HG3 H 1 0.7 0.041 . 2 . . . . A 54 PRO HG3 . 34785 1
552 . 1 . 1 54 54 PRO HD2 H 1 2.355 0.046 . 2 . . . . A 54 PRO HD2 . 34785 1
553 . 1 . 1 54 54 PRO HD3 H 1 2.62 0.039 . 2 . . . . A 54 PRO HD3 . 34785 1
554 . 1 . 1 54 54 PRO C C 13 169.978 0 . 1 . . . . A 54 PRO C . 34785 1
555 . 1 . 1 54 54 PRO CA C 13 61.675 0.13 . 1 . . . . A 54 PRO CA . 34785 1
556 . 1 . 1 54 54 PRO CB C 13 29.906 0.099 . 1 . . . . A 54 PRO CB . 34785 1
557 . 1 . 1 54 54 PRO CG C 13 27.903 0.192 . 1 . . . . A 54 PRO CG . 34785 1
558 . 1 . 1 54 54 PRO CD C 13 49.946 0.109 . 1 . . . . A 54 PRO CD . 34785 1
559 . 1 . 1 55 55 ALA H H 1 7.723 0.016 . 1 . . . . A 55 ALA H . 34785 1
560 . 1 . 1 55 55 ALA HA H 1 2.754 0.014 . 1 . . . . A 55 ALA HA . 34785 1
561 . 1 . 1 55 55 ALA HB1 H 1 -0.108 0.015 . 1 . . . . A 55 ALA HB1 . 34785 1
562 . 1 . 1 55 55 ALA HB2 H 1 -0.108 0.015 . 1 . . . . A 55 ALA HB2 . 34785 1
563 . 1 . 1 55 55 ALA HB3 H 1 -0.108 0.015 . 1 . . . . A 55 ALA HB3 . 34785 1
564 . 1 . 1 55 55 ALA C C 13 171.248 0 . 1 . . . . A 55 ALA C . 34785 1
565 . 1 . 1 55 55 ALA CA C 13 54.244 0.119 . 1 . . . . A 55 ALA CA . 34785 1
566 . 1 . 1 55 55 ALA CB C 13 15.387 0.138 . 1 . . . . A 55 ALA CB . 34785 1
567 . 1 . 1 55 55 ALA N N 15 129.752 0.088 . 1 . . . . A 55 ALA N . 34785 1
568 . 1 . 1 56 56 ALA H H 1 8.633 0.046 . 1 . . . . A 56 ALA H . 34785 1
569 . 1 . 1 56 56 ALA HA H 1 4.064 0.012 . 1 . . . . A 56 ALA HA . 34785 1
570 . 1 . 1 56 56 ALA HB1 H 1 1.272 0.022 . 1 . . . . A 56 ALA HB1 . 34785 1
571 . 1 . 1 56 56 ALA HB2 H 1 1.272 0.022 . 1 . . . . A 56 ALA HB2 . 34785 1
572 . 1 . 1 56 56 ALA HB3 H 1 1.272 0.022 . 1 . . . . A 56 ALA HB3 . 34785 1
573 . 1 . 1 56 56 ALA C C 13 170.278 0 . 1 . . . . A 56 ALA C . 34785 1
574 . 1 . 1 56 56 ALA CA C 13 53.066 0.151 . 1 . . . . A 56 ALA CA . 34785 1
575 . 1 . 1 56 56 ALA CB C 13 17.799 0.138 . 1 . . . . A 56 ALA CB . 34785 1
576 . 1 . 1 56 56 ALA N N 15 114.474 0.149 . 1 . . . . A 56 ALA N . 34785 1
577 . 1 . 1 57 57 TYR H H 1 7.425 0.022 . 1 . . . . A 57 TYR H . 34785 1
578 . 1 . 1 57 57 TYR HA H 1 5.032 0.002 . 1 . . . . A 57 TYR HA . 34785 1
579 . 1 . 1 57 57 TYR HB2 H 1 3.1 0.019 . 2 . . . . A 57 TYR HB2 . 34785 1
580 . 1 . 1 57 57 TYR HB3 H 1 3.784 0.014 . 2 . . . . A 57 TYR HB3 . 34785 1
581 . 1 . 1 57 57 TYR C C 13 166.664 0 . 1 . . . . A 57 TYR C . 34785 1
582 . 1 . 1 57 57 TYR CA C 13 54.357 0.183 . 1 . . . . A 57 TYR CA . 34785 1
583 . 1 . 1 57 57 TYR CB C 13 37.214 0.197 . 1 . . . . A 57 TYR CB . 34785 1
584 . 1 . 1 57 57 TYR N N 15 112.966 0.117 . 1 . . . . A 57 TYR N . 34785 1
585 . 1 . 1 58 58 VAL H H 1 7.669 0.017 . 1 . . . . A 58 VAL H . 34785 1
586 . 1 . 1 58 58 VAL HA H 1 5.695 0.017 . 1 . . . . A 58 VAL HA . 34785 1
587 . 1 . 1 58 58 VAL HB H 1 1.987 0.008 . 1 . . . . A 58 VAL HB . 34785 1
588 . 1 . 1 58 58 VAL HG11 H 1 0.879 0.015 . 2 . . . . A 58 VAL HG11 . 34785 1
589 . 1 . 1 58 58 VAL HG12 H 1 0.879 0.015 . 2 . . . . A 58 VAL HG12 . 34785 1
590 . 1 . 1 58 58 VAL HG13 H 1 0.879 0.015 . 2 . . . . A 58 VAL HG13 . 34785 1
591 . 1 . 1 58 58 VAL HG21 H 1 0.896 0.021 . 2 . . . . A 58 VAL HG21 . 34785 1
592 . 1 . 1 58 58 VAL HG22 H 1 0.896 0.021 . 2 . . . . A 58 VAL HG22 . 34785 1
593 . 1 . 1 58 58 VAL HG23 H 1 0.896 0.021 . 2 . . . . A 58 VAL HG23 . 34785 1
594 . 1 . 1 58 58 VAL C C 13 166.15 0 . 1 . . . . A 58 VAL C . 34785 1
595 . 1 . 1 58 58 VAL CA C 13 57.933 0.11 . 1 . . . . A 58 VAL CA . 34785 1
596 . 1 . 1 58 58 VAL CB C 13 35.37 0.056 . 1 . . . . A 58 VAL CB . 34785 1
597 . 1 . 1 58 58 VAL CG1 C 13 19.466 0.121 . 2 . . . . A 58 VAL CG1 . 34785 1
598 . 1 . 1 58 58 VAL CG2 C 13 22.129 0.173 . 2 . . . . A 58 VAL CG2 . 34785 1
599 . 1 . 1 58 58 VAL N N 15 111.382 0.172 . 1 . . . . A 58 VAL N . 34785 1
600 . 1 . 1 59 59 LYS H H 1 8.921 0.021 . 1 . . . . A 59 LYS H . 34785 1
601 . 1 . 1 59 59 LYS HA H 1 5.018 0.015 . 1 . . . . A 59 LYS HA . 34785 1
602 . 1 . 1 59 59 LYS HB2 H 1 1.851 0.014 . 2 . . . . A 59 LYS HB2 . 34785 1
603 . 1 . 1 59 59 LYS HB3 H 1 1.851 0.014 . 2 . . . . A 59 LYS HB3 . 34785 1
604 . 1 . 1 59 59 LYS HG2 H 1 1.596 0.014 . 2 . . . . A 59 LYS HG2 . 34785 1
605 . 1 . 1 59 59 LYS HG3 H 1 1.596 0.014 . 2 . . . . A 59 LYS HG3 . 34785 1
606 . 1 . 1 59 59 LYS HD2 H 1 1.852 0.012 . 2 . . . . A 59 LYS HD2 . 34785 1
607 . 1 . 1 59 59 LYS HD3 H 1 1.852 0.012 . 2 . . . . A 59 LYS HD3 . 34785 1
608 . 1 . 1 59 59 LYS HE2 H 1 3.157 0.011 . 2 . . . . A 59 LYS HE2 . 34785 1
609 . 1 . 1 59 59 LYS HE3 H 1 3.157 0.011 . 2 . . . . A 59 LYS HE3 . 34785 1
610 . 1 . 1 59 59 LYS C C 13 168.746 0 . 1 . . . . A 59 LYS C . 34785 1
611 . 1 . 1 59 59 LYS CA C 13 53.954 0.052 . 1 . . . . A 59 LYS CA . 34785 1
612 . 1 . 1 59 59 LYS CB C 13 36.906 0.084 . 1 . . . . A 59 LYS CB . 34785 1
613 . 1 . 1 59 59 LYS CG C 13 24.347 0.093 . 1 . . . . A 59 LYS CG . 34785 1
614 . 1 . 1 59 59 LYS CD C 13 29.416 0.12 . 1 . . . . A 59 LYS CD . 34785 1
615 . 1 . 1 59 59 LYS CE C 13 42.233 0.135 . 1 . . . . A 59 LYS CE . 34785 1
616 . 1 . 1 59 59 LYS N N 15 119.802 0.212 . 1 . . . . A 59 LYS N . 34785 1
617 . 1 . 1 60 60 LYS H H 1 9.494 0.026 . 1 . . . . A 60 LYS H . 34785 1
618 . 1 . 1 60 60 LYS HA H 1 4.555 0.018 . 1 . . . . A 60 LYS HA . 34785 1
619 . 1 . 1 60 60 LYS HB2 H 1 1.968 0.019 . 2 . . . . A 60 LYS HB2 . 34785 1
620 . 1 . 1 60 60 LYS HB3 H 1 2.134 0.007 . 2 . . . . A 60 LYS HB3 . 34785 1
621 . 1 . 1 60 60 LYS HG2 H 1 1.489 0.02 . 2 . . . . A 60 LYS HG2 . 34785 1
622 . 1 . 1 60 60 LYS HG3 H 1 1.804 0.011 . 2 . . . . A 60 LYS HG3 . 34785 1
623 . 1 . 1 60 60 LYS HD2 H 1 1.774 0.021 . 2 . . . . A 60 LYS HD2 . 34785 1
624 . 1 . 1 60 60 LYS HD3 H 1 1.774 0.021 . 2 . . . . A 60 LYS HD3 . 34785 1
625 . 1 . 1 60 60 LYS HE2 H 1 2.725 0.034 . 2 . . . . A 60 LYS HE2 . 34785 1
626 . 1 . 1 60 60 LYS HE3 H 1 2.966 0.022 . 2 . . . . A 60 LYS HE3 . 34785 1
627 . 1 . 1 60 60 LYS C C 13 168.893 0 . 1 . . . . A 60 LYS C . 34785 1
628 . 1 . 1 60 60 LYS CA C 13 58.266 0.08 . 1 . . . . A 60 LYS CA . 34785 1
629 . 1 . 1 60 60 LYS CB C 13 32.875 0.146 . 1 . . . . A 60 LYS CB . 34785 1
630 . 1 . 1 60 60 LYS CG C 13 25.75 0.129 . 1 . . . . A 60 LYS CG . 34785 1
631 . 1 . 1 60 60 LYS CD C 13 29.524 0.178 . 1 . . . . A 60 LYS CD . 34785 1
632 . 1 . 1 60 60 LYS CE C 13 41.687 0.139 . 1 . . . . A 60 LYS CE . 34785 1
633 . 1 . 1 60 60 LYS N N 15 127.103 0.143 . 1 . . . . A 60 LYS N . 34785 1
634 . 1 . 1 61 61 LEU H H 1 8.402 0.02 . 1 . . . . A 61 LEU H . 34785 1
635 . 1 . 1 61 61 LEU HA H 1 4.671 0.013 . 1 . . . . A 61 LEU HA . 34785 1
636 . 1 . 1 61 61 LEU HB2 H 1 1.43 0.02 . 2 . . . . A 61 LEU HB2 . 34785 1
637 . 1 . 1 61 61 LEU HB3 H 1 1.741 0.018 . 2 . . . . A 61 LEU HB3 . 34785 1
638 . 1 . 1 61 61 LEU HG H 1 1.789 0.015 . 1 . . . . A 61 LEU HG . 34785 1
639 . 1 . 1 61 61 LEU HD11 H 1 0.995 0.021 . 2 . . . . A 61 LEU HD11 . 34785 1
640 . 1 . 1 61 61 LEU HD12 H 1 0.995 0.021 . 2 . . . . A 61 LEU HD12 . 34785 1
641 . 1 . 1 61 61 LEU HD13 H 1 0.995 0.021 . 2 . . . . A 61 LEU HD13 . 34785 1
642 . 1 . 1 61 61 LEU HD21 H 1 0.997 0.017 . 2 . . . . A 61 LEU HD21 . 34785 1
643 . 1 . 1 61 61 LEU HD22 H 1 0.997 0.017 . 2 . . . . A 61 LEU HD22 . 34785 1
644 . 1 . 1 61 61 LEU HD23 H 1 0.997 0.017 . 2 . . . . A 61 LEU HD23 . 34785 1
645 . 1 . 1 61 61 LEU C C 13 167.907 0 . 1 . . . . A 61 LEU C . 34785 1
646 . 1 . 1 61 61 LEU CA C 13 53.952 0.084 . 1 . . . . A 61 LEU CA . 34785 1
647 . 1 . 1 61 61 LEU CB C 13 41.615 0.202 . 1 . . . . A 61 LEU CB . 34785 1
648 . 1 . 1 61 61 LEU CG C 13 26.484 0.132 . 1 . . . . A 61 LEU CG . 34785 1
649 . 1 . 1 61 61 LEU CD1 C 13 22.777 0.099 . 2 . . . . A 61 LEU CD1 . 34785 1
650 . 1 . 1 61 61 LEU CD2 C 13 26.44 0.203 . 2 . . . . A 61 LEU CD2 . 34785 1
651 . 1 . 1 61 61 LEU N N 15 125.903 0.125 . 1 . . . . A 61 LEU N . 34785 1
652 . 1 . 1 62 62 ASP H H 1 8.178 0.031 . 1 . . . . A 62 ASP H . 34785 1
653 . 1 . 1 62 62 ASP CA C 13 55.92 0 . 1 . . . . A 62 ASP CA . 34785 1
654 . 1 . 1 62 62 ASP CB C 13 42.715 0 . 1 . . . . A 62 ASP CB . 34785 1
655 . 1 . 1 62 62 ASP N N 15 128.463 0.081 . 1 . . . . A 62 ASP N . 34785 1
stop_
save_