Content for NMR-STAR saveframe, assigned_chemical_shifts_2
save_assigned_chemical_shifts_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2
_Assigned_chem_shift_list.Entry_ID 53572
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name 'spNC-4 chemical shift assignments'
_Assigned_chem_shift_list.Sample_condition_list_ID 2
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2
_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 'C-terminal fragment of spNC-4'
_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
5 '2D hNH' . . . 53572 2
6 '2D hCH' . . . 53572 2
7 '3D hCANH' . . . 53572 2
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $software_1 . . 53572 2
2 $software_2 . . 53572 2
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 . 2 . 2 2 2 GLY C C 13 169.823 0.063 . 1 . . . . . 113B GLY C . 53572 2
2 . 2 . 2 2 2 GLY CA C 13 43.068 0.048 . 1 . . . . . 113B GLY CA . 53572 2
3 . 2 . 2 3 3 ILE H H 1 8.017 0.036 . 1 . . . . . 114 ILE H . 53572 2
4 . 2 . 2 3 3 ILE HA H 1 4.582 0.022 . 1 . . . . . 114 ILE HA . 53572 2
5 . 2 . 2 3 3 ILE C C 13 176.041 0.081 . 1 . . . . . 114 ILE C . 53572 2
6 . 2 . 2 3 3 ILE CA C 13 60.831 0.122 . 1 . . . . . 114 ILE CA . 53572 2
7 . 2 . 2 3 3 ILE CB C 13 38.769 0.104 . 1 . . . . . 114 ILE CB . 53572 2
8 . 2 . 2 3 3 ILE CG1 C 13 26.846 0 . 1 . . . . . 114 ILE CG1 . 53572 2
9 . 2 . 2 3 3 ILE CG2 C 13 17.04 0.024 . 1 . . . . . 114 ILE CG2 . 53572 2
10 . 2 . 2 3 3 ILE N N 15 117.235 0.219 . 1 . . . . . 114 ILE N . 53572 2
11 . 2 . 2 4 4 GLU H H 1 8.382 0.003 . 1 . . . . . 115 GLU H . 53572 2
12 . 2 . 2 4 4 GLU HA H 1 4.429 0.027 . 1 . . . . . 115 GLU HA . 53572 2
13 . 2 . 2 4 4 GLU C C 13 174.719 0.069 . 1 . . . . . 115 GLU C . 53572 2
14 . 2 . 2 4 4 GLU CA C 13 55.859 0.133 . 1 . . . . . 115 GLU CA . 53572 2
15 . 2 . 2 4 4 GLU CB C 13 30.952 0.044 . 1 . . . . . 115 GLU CB . 53572 2
16 . 2 . 2 4 4 GLU CD C 13 184.012 0 . 1 . . . . . 115 GLU CD . 53572 2
17 . 2 . 2 4 4 GLU N N 15 125.221 0.169 . 1 . . . . . 115 GLU N . 53572 2
18 . 2 . 2 5 5 ILE H H 1 8.156 0.01 . 1 . . . . . 116 ILE H . 53572 2
19 . 2 . 2 5 5 ILE HA H 1 5.247 0.04 . 1 . . . . . 116 ILE HA . 53572 2
20 . 2 . 2 5 5 ILE C C 13 176.187 0.139 . 1 . . . . . 116 ILE C . 53572 2
21 . 2 . 2 5 5 ILE CA C 13 60.263 0.113 . 1 . . . . . 116 ILE CA . 53572 2
22 . 2 . 2 5 5 ILE CB C 13 40.532 0.088 . 1 . . . . . 116 ILE CB . 53572 2
23 . 2 . 2 5 5 ILE CG1 C 13 27.891 0.103 . 1 . . . . . 116 ILE CG1 . 53572 2
24 . 2 . 2 5 5 ILE CG2 C 13 16.822 0.059 . 1 . . . . . 116 ILE CG2 . 53572 2
25 . 2 . 2 5 5 ILE CD1 C 13 13.528 0.035 . 1 . . . . . 116 ILE CD1 . 53572 2
26 . 2 . 2 5 5 ILE N N 15 123.757 0.116 . 1 . . . . . 116 ILE N . 53572 2
27 . 2 . 2 6 6 TYR H H 1 9.638 0.019 . 1 . . . . . 117 TYR H . 53572 2
28 . 2 . 2 6 6 TYR HA H 1 4.758 0.014 . 1 . . . . . 117 TYR HA . 53572 2
29 . 2 . 2 6 6 TYR HE1 H 1 6.711 0 . 1 . . . . . 117 TYR HE1 . 53572 2
30 . 2 . 2 6 6 TYR HE2 H 1 6.711 0 . 1 . . . . . 117 TYR HE2 . 53572 2
31 . 2 . 2 6 6 TYR C C 13 173.228 0.044 . 1 . . . . . 117 TYR C . 53572 2
32 . 2 . 2 6 6 TYR CA C 13 57.247 0.086 . 1 . . . . . 117 TYR CA . 53572 2
33 . 2 . 2 6 6 TYR CB C 13 40.454 0.041 . 1 . . . . . 117 TYR CB . 53572 2
34 . 2 . 2 6 6 TYR CG C 13 132.584 0.16 . 1 . . . . . 117 TYR CG . 53572 2
35 . 2 . 2 6 6 TYR CE1 C 13 118.103 0.151 . 1 . . . . . 117 TYR CE1 . 53572 2
36 . 2 . 2 6 6 TYR CE2 C 13 118.103 0.151 . 1 . . . . . 117 TYR CE2 . 53572 2
37 . 2 . 2 6 6 TYR CZ C 13 157.332 0 . 1 . . . . . 117 TYR CZ . 53572 2
38 . 2 . 2 6 6 TYR N N 15 127.962 0.255 . 1 . . . . . 117 TYR N . 53572 2
39 . 2 . 2 7 7 GLU CA C 13 55.464 0.147 . 1 . . . . . 118 GLU CA . 53572 2
40 . 2 . 2 7 7 GLU N N 15 122.207 0.189 . 1 . . . . . 118 GLU N . 53572 2
41 . 2 . 2 8 8 GLY C C 13 173.887 0.087 . 1 . . . . . 119 GLY C . 53572 2
42 . 2 . 2 8 8 GLY CA C 13 46.137 0.038 . 1 . . . . . 119 GLY CA . 53572 2
43 . 2 . 2 8 8 GLY N N 15 119.7 0 . 1 . . . . . 119 GLY N . 53572 2
44 . 2 . 2 9 9 LYS H H 1 8.385 0 . 1 . . . . . 120 LYS H . 53572 2
45 . 2 . 2 9 9 LYS HA H 1 4.494 0 . 1 . . . . . 120 LYS HA . 53572 2
46 . 2 . 2 9 9 LYS C C 13 175.664 0.039 . 1 . . . . . 120 LYS C . 53572 2
47 . 2 . 2 9 9 LYS CA C 13 56.098 0.125 . 1 . . . . . 120 LYS CA . 53572 2
48 . 2 . 2 9 9 LYS CB C 13 34.381 0.122 . 1 . . . . . 120 LYS CB . 53572 2
49 . 2 . 2 9 9 LYS N N 15 124.71 0.355 . 1 . . . . . 120 LYS N . 53572 2
50 . 2 . 2 10 10 LEU H H 1 8.384 0.001 . 1 . . . . . 121 LEU H . 53572 2
51 . 2 . 2 10 10 LEU HA H 1 4.517 0.014 . 1 . . . . . 121 LEU HA . 53572 2
52 . 2 . 2 10 10 LEU C C 13 174.75 0.119 . 1 . . . . . 121 LEU C . 53572 2
53 . 2 . 2 10 10 LEU CA C 13 53.137 0.086 . 1 . . . . . 121 LEU CA . 53572 2
54 . 2 . 2 10 10 LEU CB C 13 40.389 0.057 . 1 . . . . . 121 LEU CB . 53572 2
55 . 2 . 2 10 10 LEU CG C 13 26.609 0.04 . 1 . . . . . 121 LEU CG . 53572 2
56 . 2 . 2 10 10 LEU CD1 C 13 23.178 0.019 . 2 . . . . . 121 LEU CD1 . 53572 2
57 . 2 . 2 10 10 LEU CD2 C 13 26.342 0.012 . 2 . . . . . 121 LEU CD2 . 53572 2
58 . 2 . 2 10 10 LEU N N 15 117.512 0.167 . 1 . . . . . 121 LEU N . 53572 2
59 . 2 . 2 11 11 THR H H 1 6.724 0.008 . 1 . . . . . 122 THR H . 53572 2
60 . 2 . 2 11 11 THR HA H 1 4.72 0.007 . 1 . . . . . 122 THR HA . 53572 2
61 . 2 . 2 11 11 THR C C 13 174.721 0.134 . 1 . . . . . 122 THR C . 53572 2
62 . 2 . 2 11 11 THR CA C 13 58.881 0.125 . 1 . . . . . 122 THR CA . 53572 2
63 . 2 . 2 11 11 THR CB C 13 68.709 0.04 . 1 . . . . . 122 THR CB . 53572 2
64 . 2 . 2 11 11 THR CG2 C 13 21.279 0.032 . 1 . . . . . 122 THR CG2 . 53572 2
65 . 2 . 2 11 11 THR N N 15 106.343 0.13 . 1 . . . . . 122 THR N . 53572 2
66 . 2 . 2 12 12 ALA H H 1 8.529 0.003 . 1 . . . . . 123 ALA H . 53572 2
67 . 2 . 2 12 12 ALA HA H 1 4.674 0.031 . 1 . . . . . 123 ALA HA . 53572 2
68 . 2 . 2 12 12 ALA C C 13 175.994 0.098 . 1 . . . . . 123 ALA C . 53572 2
69 . 2 . 2 12 12 ALA CA C 13 50.873 0.123 . 1 . . . . . 123 ALA CA . 53572 2
70 . 2 . 2 12 12 ALA CB C 13 19.818 0.053 . 1 . . . . . 123 ALA CB . 53572 2
71 . 2 . 2 12 12 ALA N N 15 125.568 0.198 . 1 . . . . . 123 ALA N . 53572 2
72 . 2 . 2 13 13 GLU H H 1 8.28 0.046 . 1 . . . . . 124 GLU H . 53572 2
73 . 2 . 2 13 13 GLU HA H 1 4.03 0.007 . 1 . . . . . 124 GLU HA . 53572 2
74 . 2 . 2 13 13 GLU HB2 H 1 1.924 0.017 . 1 . . . . . 124 GLU HB2 . 53572 2
75 . 2 . 2 13 13 GLU C C 13 177.893 0.063 . 1 . . . . . 124 GLU C . 53572 2
76 . 2 . 2 13 13 GLU CA C 13 58.981 0.103 . 1 . . . . . 124 GLU CA . 53572 2
77 . 2 . 2 13 13 GLU CB C 13 29.328 0.11 . 1 . . . . . 124 GLU CB . 53572 2
78 . 2 . 2 13 13 GLU CG C 13 36.148 0.029 . 1 . . . . . 124 GLU CG . 53572 2
79 . 2 . 2 13 13 GLU CD C 13 183.716 0.096 . 1 . . . . . 124 GLU CD . 53572 2
80 . 2 . 2 13 13 GLU N N 15 120.814 0.116 . 1 . . . . . 124 GLU N . 53572 2
81 . 2 . 2 14 14 GLY H H 1 9.136 0.023 . 1 . . . . . 125 GLY H . 53572 2
82 . 2 . 2 14 14 GLY HA2 H 1 4.207 0.014 . 2 . . . . . 125 GLY HA2 . 53572 2
83 . 2 . 2 14 14 GLY HA3 H 1 3.699 0.004 . 2 . . . . . 125 GLY HA3 . 53572 2
84 . 2 . 2 14 14 GLY C C 13 174.288 0.064 . 1 . . . . . 125 GLY C . 53572 2
85 . 2 . 2 14 14 GLY CA C 13 45.388 0.118 . 1 . . . . . 125 GLY CA . 53572 2
86 . 2 . 2 14 14 GLY N N 15 115.703 0.101 . 1 . . . . . 125 GLY N . 53572 2
87 . 2 . 2 15 15 LEU H H 1 7.857 0.008 . 1 . . . . . 126 LEU H . 53572 2
88 . 2 . 2 15 15 LEU HA H 1 4.486 0.014 . 1 . . . . . 126 LEU HA . 53572 2
89 . 2 . 2 15 15 LEU HD11 H 1 0.516 0 . 1 . . . . . 126 LEU HD11 . 53572 2
90 . 2 . 2 15 15 LEU HD12 H 1 0.516 0 . 1 . . . . . 126 LEU HD12 . 53572 2
91 . 2 . 2 15 15 LEU HD13 H 1 0.516 0 . 1 . . . . . 126 LEU HD13 . 53572 2
92 . 2 . 2 15 15 LEU C C 13 175.922 0.056 . 1 . . . . . 126 LEU C . 53572 2
93 . 2 . 2 15 15 LEU CA C 13 54.093 0.039 . 1 . . . . . 126 LEU CA . 53572 2
94 . 2 . 2 15 15 LEU CB C 13 44.419 0.054 . 1 . . . . . 126 LEU CB . 53572 2
95 . 2 . 2 15 15 LEU CG C 13 26.958 0.056 . 1 . . . . . 126 LEU CG . 53572 2
96 . 2 . 2 15 15 LEU CD1 C 13 22.844 0.037 . 1 . . . . . 126 LEU CD1 . 53572 2
97 . 2 . 2 15 15 LEU N N 15 120.58 0.084 . 1 . . . . . 126 LEU N . 53572 2
98 . 2 . 2 16 16 ARG H H 1 9.247 0.021 . 1 . . . . . 127 ARG H . 53572 2
99 . 2 . 2 16 16 ARG HA H 1 5.158 0.02 . 1 . . . . . 127 ARG HA . 53572 2
100 . 2 . 2 16 16 ARG C C 13 176.482 0.047 . 1 . . . . . 127 ARG C . 53572 2
101 . 2 . 2 16 16 ARG CA C 13 54.961 0.088 . 1 . . . . . 127 ARG CA . 53572 2
102 . 2 . 2 16 16 ARG CB C 13 31.344 0.071 . 1 . . . . . 127 ARG CB . 53572 2
103 . 2 . 2 16 16 ARG CG C 13 27.017 0.094 . 1 . . . . . 127 ARG CG . 53572 2
104 . 2 . 2 16 16 ARG CD C 13 42.603 0.05 . 1 . . . . . 127 ARG CD . 53572 2
105 . 2 . 2 16 16 ARG CZ C 13 159.339 0 . 1 . . . . . 127 ARG CZ . 53572 2
106 . 2 . 2 16 16 ARG N N 15 120.847 0.128 . 1 . . . . . 127 ARG N . 53572 2
107 . 2 . 2 17 17 PHE H H 1 8.517 0.022 . 1 . . . . . 128 PHE H . 53572 2
108 . 2 . 2 17 17 PHE HA H 1 5.198 0.018 . 1 . . . . . 128 PHE HA . 53572 2
109 . 2 . 2 17 17 PHE C C 13 174.762 0.071 . 1 . . . . . 128 PHE C . 53572 2
110 . 2 . 2 17 17 PHE CA C 13 56.939 0.09 . 1 . . . . . 128 PHE CA . 53572 2
111 . 2 . 2 17 17 PHE CB C 13 44.127 0.076 . 1 . . . . . 128 PHE CB . 53572 2
112 . 2 . 2 17 17 PHE CG C 13 138.947 0.031 . 1 . . . . . 128 PHE CG . 53572 2
113 . 2 . 2 17 17 PHE CD1 C 13 130.828 0 . 1 . . . . . 128 PHE CD1 . 53572 2
114 . 2 . 2 17 17 PHE CD2 C 13 130.828 0 . 1 . . . . . 128 PHE CD2 . 53572 2
115 . 2 . 2 17 17 PHE N N 15 119.423 0.253 . 1 . . . . . 128 PHE N . 53572 2
116 . 2 . 2 18 18 GLY H H 1 9.171 0.03 . 1 . . . . . 129 GLY H . 53572 2
117 . 2 . 2 18 18 GLY HA2 H 1 5.395 0.007 . 2 . . . . . 129 GLY HA2 . 53572 2
118 . 2 . 2 18 18 GLY HA3 H 1 3.222 0.009 . 2 . . . . . 129 GLY HA3 . 53572 2
119 . 2 . 2 18 18 GLY C C 13 171.029 0.063 . 1 . . . . . 129 GLY C . 53572 2
120 . 2 . 2 18 18 GLY CA C 13 44.504 0.078 . 1 . . . . . 129 GLY CA . 53572 2
121 . 2 . 2 18 18 GLY N N 15 109.159 0.146 . 1 . . . . . 129 GLY N . 53572 2
122 . 2 . 2 19 19 ILE H H 1 9.618 0.003 . 1 . . . . . 130 ILE H . 53572 2
123 . 2 . 2 19 19 ILE HA H 1 5.44 0.033 . 1 . . . . . 130 ILE HA . 53572 2
124 . 2 . 2 19 19 ILE C C 13 174.55 0.04 . 1 . . . . . 130 ILE C . 53572 2
125 . 2 . 2 19 19 ILE CA C 13 59.132 0.095 . 1 . . . . . 130 ILE CA . 53572 2
126 . 2 . 2 19 19 ILE CB C 13 40.718 0.046 . 1 . . . . . 130 ILE CB . 53572 2
127 . 2 . 2 19 19 ILE CG1 C 13 27.282 0.038 . 1 . . . . . 130 ILE CG1 . 53572 2
128 . 2 . 2 19 19 ILE CG2 C 13 17.329 0.029 . 1 . . . . . 130 ILE CG2 . 53572 2
129 . 2 . 2 19 19 ILE CD1 C 13 14.363 0.03 . 1 . . . . . 130 ILE CD1 . 53572 2
130 . 2 . 2 19 19 ILE N N 15 126.035 0.083 . 1 . . . . . 130 ILE N . 53572 2
131 . 2 . 2 20 20 VAL H H 1 8.987 0.041 . 1 . . . . . 131 VAL H . 53572 2
132 . 2 . 2 20 20 VAL HA H 1 5.137 0.014 . 1 . . . . . 131 VAL HA . 53572 2
133 . 2 . 2 20 20 VAL HB H 1 1.767 0.003 . 1 . . . . . 131 VAL HB . 53572 2
134 . 2 . 2 20 20 VAL C C 13 173.676 0.054 . 1 . . . . . 131 VAL C . 53572 2
135 . 2 . 2 20 20 VAL CA C 13 59.914 0.113 . 1 . . . . . 131 VAL CA . 53572 2
136 . 2 . 2 20 20 VAL CB C 13 33.307 0.101 . 1 . . . . . 131 VAL CB . 53572 2
137 . 2 . 2 20 20 VAL CG1 C 13 21.068 0.08 . 2 . . . . . 131 VAL CG1 . 53572 2
138 . 2 . 2 20 20 VAL CG2 C 13 22.917 0.096 . 2 . . . . . 131 VAL CG2 . 53572 2
139 . 2 . 2 20 20 VAL N N 15 126.169 0.151 . 1 . . . . . 131 VAL N . 53572 2
140 . 2 . 2 21 21 ALA H H 1 8.993 0.015 . 1 . . . . . 132 ALA H . 53572 2
141 . 2 . 2 21 21 ALA HA H 1 5.405 0.031 . 1 . . . . . 132 ALA HA . 53572 2
142 . 2 . 2 21 21 ALA C C 13 176.245 0.091 . 1 . . . . . 132 ALA C . 53572 2
143 . 2 . 2 21 21 ALA CA C 13 49.9 0.068 . 1 . . . . . 132 ALA CA . 53572 2
144 . 2 . 2 21 21 ALA CB C 13 22.847 0.048 . 1 . . . . . 132 ALA CB . 53572 2
145 . 2 . 2 21 21 ALA N N 15 127.799 0.112 . 1 . . . . . 132 ALA N . 53572 2
146 . 2 . 2 22 22 SER CA C 13 56.021 0.031 . 1 . . . . . 133 SER CA . 53572 2
147 . 2 . 2 22 22 SER CB C 13 62.944 0.003 . 1 . . . . . 133 SER CB . 53572 2
148 . 2 . 2 22 22 SER N N 15 115.514 0.205 . 1 . . . . . 133 SER N . 53572 2
149 . 2 . 2 30 30 ASP HA H 1 4.324 0.002 . 1 . . . . . 141 ASP HA . 53572 2
150 . 2 . 2 30 30 ASP C C 13 178.976 0.072 . 1 . . . . . 141 ASP C . 53572 2
151 . 2 . 2 30 30 ASP CA C 13 57.513 0.088 . 1 . . . . . 141 ASP CA . 53572 2
152 . 2 . 2 30 30 ASP CB C 13 39.568 0.112 . 1 . . . . . 141 ASP CB . 53572 2
153 . 2 . 2 30 30 ASP CG C 13 180.38 0 . 1 . . . . . 141 ASP CG . 53572 2
154 . 2 . 2 30 30 ASP N N 15 120.639 0.127 . 1 . . . . . 141 ASP N . 53572 2
155 . 2 . 2 31 31 ARG H H 1 7.382 0.002 . 1 . . . . . 142 ARG H . 53572 2
156 . 2 . 2 31 31 ARG HA H 1 4.183 0 . 1 . . . . . 142 ARG HA . 53572 2
157 . 2 . 2 31 31 ARG C C 13 180.258 0.05 . 1 . . . . . 142 ARG C . 53572 2
158 . 2 . 2 31 31 ARG CA C 13 57.986 0.123 . 1 . . . . . 142 ARG CA . 53572 2
159 . 2 . 2 31 31 ARG CB C 13 30.588 0.031 . 1 . . . . . 142 ARG CB . 53572 2
160 . 2 . 2 31 31 ARG CG C 13 26.777 0 . 1 . . . . . 142 ARG CG . 53572 2
161 . 2 . 2 31 31 ARG N N 15 116.299 0.247 . 1 . . . . . 142 ARG N . 53572 2
162 . 2 . 2 32 32 LEU H H 1 7.213 0 . 1 . . . . . 143 LEU H . 53572 2
163 . 2 . 2 32 32 LEU HA H 1 3.862 0.008 . 1 . . . . . 143 LEU HA . 53572 2
164 . 2 . 2 32 32 LEU C C 13 178.283 0.084 . 1 . . . . . 143 LEU C . 53572 2
165 . 2 . 2 32 32 LEU CA C 13 59.094 0.168 . 1 . . . . . 143 LEU CA . 53572 2
166 . 2 . 2 32 32 LEU CB C 13 38.987 0.096 . 1 . . . . . 143 LEU CB . 53572 2
167 . 2 . 2 32 32 LEU CG C 13 26.232 0 . 1 . . . . . 143 LEU CG . 53572 2
168 . 2 . 2 32 32 LEU N N 15 121.86 0.297 . 1 . . . . . 143 LEU N . 53572 2
169 . 2 . 2 33 33 VAL H H 1 7.631 0.007 . 1 . . . . . 144 VAL H . 53572 2
170 . 2 . 2 33 33 VAL HA H 1 3.322 0.004 . 1 . . . . . 144 VAL HA . 53572 2
171 . 2 . 2 33 33 VAL HB H 1 2.21 0.032 . 1 . . . . . 144 VAL HB . 53572 2
172 . 2 . 2 33 33 VAL C C 13 177.368 0.103 . 1 . . . . . 144 VAL C . 53572 2
173 . 2 . 2 33 33 VAL CA C 13 67.326 0.082 . 1 . . . . . 144 VAL CA . 53572 2
174 . 2 . 2 33 33 VAL CB C 13 31.723 0.026 . 1 . . . . . 144 VAL CB . 53572 2
175 . 2 . 2 33 33 VAL CG1 C 13 23.821 0.049 . 2 . . . . . 144 VAL CG1 . 53572 2
176 . 2 . 2 33 33 VAL CG2 C 13 22.496 0.062 . 2 . . . . . 144 VAL CG2 . 53572 2
177 . 2 . 2 33 33 VAL N N 15 118.449 0.163 . 1 . . . . . 144 VAL N . 53572 2
178 . 2 . 2 34 34 GLU H H 1 8.197 0.008 . 1 . . . . . 145 GLU H . 53572 2
179 . 2 . 2 34 34 GLU HA H 1 3.886 0.004 . 1 . . . . . 145 GLU HA . 53572 2
180 . 2 . 2 34 34 GLU HB2 H 1 2.257 0 . 1 . . . . . 145 GLU HB2 . 53572 2
181 . 2 . 2 34 34 GLU C C 13 179.304 0.12 . 1 . . . . . 145 GLU C . 53572 2
182 . 2 . 2 34 34 GLU CA C 13 59.568 0.109 . 1 . . . . . 145 GLU CA . 53572 2
183 . 2 . 2 34 34 GLU CB C 13 29.677 0.077 . 1 . . . . . 145 GLU CB . 53572 2
184 . 2 . 2 34 34 GLU CG C 13 36.734 0.055 . 1 . . . . . 145 GLU CG . 53572 2
185 . 2 . 2 34 34 GLU CD C 13 183.431 0.105 . 1 . . . . . 145 GLU CD . 53572 2
186 . 2 . 2 34 34 GLU N N 15 117.473 0.157 . 1 . . . . . 145 GLU N . 53572 2
187 . 2 . 2 35 35 GLY H H 1 7.979 0.029 . 1 . . . . . 146 GLY H . 53572 2
188 . 2 . 2 35 35 GLY HA2 H 1 4.294 0.014 . 2 . . . . . 146 GLY HA2 . 53572 2
189 . 2 . 2 35 35 GLY HA3 H 1 4.178 0.017 . 2 . . . . . 146 GLY HA3 . 53572 2
190 . 2 . 2 35 35 GLY C C 13 175.171 0.119 . 1 . . . . . 146 GLY C . 53572 2
191 . 2 . 2 35 35 GLY CA C 13 47.133 0.095 . 1 . . . . . 146 GLY CA . 53572 2
192 . 2 . 2 35 35 GLY N N 15 106.834 0.1 . 1 . . . . . 146 GLY N . 53572 2
193 . 2 . 2 36 36 ALA H H 1 8.092 0.027 . 1 . . . . . 147 ALA H . 53572 2
194 . 2 . 2 36 36 ALA HA H 1 4.007 0 . 1 . . . . . 147 ALA HA . 53572 2
195 . 2 . 2 36 36 ALA C C 13 179.051 0.059 . 1 . . . . . 147 ALA C . 53572 2
196 . 2 . 2 36 36 ALA CA C 13 54.859 0.101 . 1 . . . . . 147 ALA CA . 53572 2
197 . 2 . 2 36 36 ALA CB C 13 17.988 0.118 . 1 . . . . . 147 ALA CB . 53572 2
198 . 2 . 2 36 36 ALA N N 15 123.356 0.123 . 1 . . . . . 147 ALA N . 53572 2
199 . 2 . 2 37 37 ILE H H 1 8.459 0.025 . 1 . . . . . 148 ILE H . 53572 2
200 . 2 . 2 37 37 ILE HA H 1 3.3 0.022 . 1 . . . . . 148 ILE HA . 53572 2
201 . 2 . 2 37 37 ILE HB H 1 1.651 0.016 . 1 . . . . . 148 ILE HB . 53572 2
202 . 2 . 2 37 37 ILE C C 13 177.135 0.055 . 1 . . . . . 148 ILE C . 53572 2
203 . 2 . 2 37 37 ILE CA C 13 66.263 0.095 . 1 . . . . . 148 ILE CA . 53572 2
204 . 2 . 2 37 37 ILE CB C 13 38.403 0.062 . 1 . . . . . 148 ILE CB . 53572 2
205 . 2 . 2 37 37 ILE CG1 C 13 29.899 0.056 . 1 . . . . . 148 ILE CG1 . 53572 2
206 . 2 . 2 37 37 ILE CG2 C 13 16.462 0.035 . 1 . . . . . 148 ILE CG2 . 53572 2
207 . 2 . 2 37 37 ILE CD1 C 13 15.218 0.035 . 1 . . . . . 148 ILE CD1 . 53572 2
208 . 2 . 2 37 37 ILE N N 15 118.004 0.18 . 1 . . . . . 148 ILE N . 53572 2
209 . 2 . 2 38 38 ASP H H 1 8.291 0.024 . 1 . . . . . 149 ASP H . 53572 2
210 . 2 . 2 38 38 ASP HA H 1 4.367 0.001 . 1 . . . . . 149 ASP HA . 53572 2
211 . 2 . 2 38 38 ASP C C 13 177.269 0.062 . 1 . . . . . 149 ASP C . 53572 2
212 . 2 . 2 38 38 ASP CA C 13 57.182 0.114 . 1 . . . . . 149 ASP CA . 53572 2
213 . 2 . 2 38 38 ASP CB C 13 41.504 0.052 . 1 . . . . . 149 ASP CB . 53572 2
214 . 2 . 2 38 38 ASP CG C 13 178.666 0.033 . 1 . . . . . 149 ASP CG . 53572 2
215 . 2 . 2 38 38 ASP N N 15 118.006 0.109 . 1 . . . . . 149 ASP N . 53572 2
216 . 2 . 2 39 39 CYS H H 1 7.886 0.014 . 1 . . . . . 150 CYS H . 53572 2
217 . 2 . 2 39 39 CYS HA H 1 2.634 0.04 . 1 . . . . . 150 CYS HA . 53572 2
218 . 2 . 2 39 39 CYS C C 13 178.833 0.042 . 1 . . . . . 150 CYS C . 53572 2
219 . 2 . 2 39 39 CYS CA C 13 61.816 0.112 . 1 . . . . . 150 CYS CA . 53572 2
220 . 2 . 2 39 39 CYS CB C 13 27.023 0.051 . 1 . . . . . 150 CYS CB . 53572 2
221 . 2 . 2 39 39 CYS N N 15 117.519 0.149 . 1 . . . . . 150 CYS N . 53572 2
222 . 2 . 2 40 40 ILE H H 1 8.093 0.04 . 1 . . . . . 151 ILE H . 53572 2
223 . 2 . 2 40 40 ILE HA H 1 3.039 0.022 . 1 . . . . . 151 ILE HA . 53572 2
224 . 2 . 2 40 40 ILE HD11 H 1 -0.017 0 . 1 . . . . . 151 ILE HD11 . 53572 2
225 . 2 . 2 40 40 ILE HD12 H 1 -0.017 0 . 1 . . . . . 151 ILE HD12 . 53572 2
226 . 2 . 2 40 40 ILE HD13 H 1 -0.017 0 . 1 . . . . . 151 ILE HD13 . 53572 2
227 . 2 . 2 40 40 ILE C C 13 178.504 0.093 . 1 . . . . . 151 ILE C . 53572 2
228 . 2 . 2 40 40 ILE CA C 13 66.785 0.106 . 1 . . . . . 151 ILE CA . 53572 2
229 . 2 . 2 40 40 ILE CB C 13 38.112 0.048 . 1 . . . . . 151 ILE CB . 53572 2
230 . 2 . 2 40 40 ILE CG1 C 13 29.351 0.088 . 1 . . . . . 151 ILE CG1 . 53572 2
231 . 2 . 2 40 40 ILE CG2 C 13 19.248 0.134 . 1 . . . . . 151 ILE CG2 . 53572 2
232 . 2 . 2 40 40 ILE CD1 C 13 13.199 0.038 . 1 . . . . . 151 ILE CD1 . 53572 2
233 . 2 . 2 40 40 ILE N N 15 121.535 0.182 . 1 . . . . . 151 ILE N . 53572 2
234 . 2 . 2 41 41 VAL H H 1 8.554 0.042 . 1 . . . . . 152 VAL H . 53572 2
235 . 2 . 2 41 41 VAL HA H 1 4.049 0.013 . 1 . . . . . 152 VAL HA . 53572 2
236 . 2 . 2 41 41 VAL C C 13 181.931 0.059 . 1 . . . . . 152 VAL C . 53572 2
237 . 2 . 2 41 41 VAL CA C 13 65.472 0.082 . 1 . . . . . 152 VAL CA . 53572 2
238 . 2 . 2 41 41 VAL CB C 13 31.659 0.08 . 1 . . . . . 152 VAL CB . 53572 2
239 . 2 . 2 41 41 VAL CG1 C 13 21.016 0.021 . 2 . . . . . 152 VAL CG1 . 53572 2
240 . 2 . 2 41 41 VAL CG2 C 13 21.382 0.016 . 2 . . . . . 152 VAL CG2 . 53572 2
241 . 2 . 2 41 41 VAL N N 15 120.037 0.172 . 1 . . . . . 152 VAL N . 53572 2
242 . 2 . 2 42 42 ARG H H 1 9.11 0.027 . 1 . . . . . 153 ARG H . 53572 2
243 . 2 . 2 42 42 ARG HA H 1 4.215 0 . 1 . . . . . 153 ARG HA . 53572 2
244 . 2 . 2 42 42 ARG C C 13 176.758 0.091 . 1 . . . . . 153 ARG C . 53572 2
245 . 2 . 2 42 42 ARG CA C 13 60.108 0.099 . 1 . . . . . 153 ARG CA . 53572 2
246 . 2 . 2 42 42 ARG CB C 13 28.543 0.154 . 1 . . . . . 153 ARG CB . 53572 2
247 . 2 . 2 42 42 ARG N N 15 120.268 0.142 . 1 . . . . . 153 ARG N . 53572 2
248 . 2 . 2 43 43 HIS H H 1 7.493 0.022 . 1 . . . . . 154 HIS H . 53572 2
249 . 2 . 2 43 43 HIS HA H 1 4.617 0.017 . 1 . . . . . 154 HIS HA . 53572 2
250 . 2 . 2 43 43 HIS C C 13 174.343 0.06 . 1 . . . . . 154 HIS C . 53572 2
251 . 2 . 2 43 43 HIS CA C 13 58.126 0.086 . 1 . . . . . 154 HIS CA . 53572 2
252 . 2 . 2 43 43 HIS CB C 13 27.26 0.103 . 1 . . . . . 154 HIS CB . 53572 2
253 . 2 . 2 43 43 HIS CG C 13 131.916 0.066 . 1 . . . . . 154 HIS CG . 53572 2
254 . 2 . 2 43 43 HIS CD2 C 13 123.854 0.068 . 1 . . . . . 154 HIS CD2 . 53572 2
255 . 2 . 2 43 43 HIS N N 15 113.718 0.186 . 1 . . . . . 154 HIS N . 53572 2
256 . 2 . 2 44 44 GLY H H 1 8.027 0.022 . 1 . . . . . 155 GLY H . 53572 2
257 . 2 . 2 44 44 GLY HA2 H 1 4.524 0.006 . 2 . . . . . 155 GLY HA2 . 53572 2
258 . 2 . 2 44 44 GLY HA3 H 1 3.806 0.002 . 2 . . . . . 155 GLY HA3 . 53572 2
259 . 2 . 2 44 44 GLY C C 13 174.675 0.07 . 1 . . . . . 155 GLY C . 53572 2
260 . 2 . 2 44 44 GLY CA C 13 45.643 0.039 . 1 . . . . . 155 GLY CA . 53572 2
261 . 2 . 2 44 44 GLY N N 15 108.005 0.102 . 1 . . . . . 155 GLY N . 53572 2
262 . 2 . 2 45 45 GLY H H 1 8.614 0.015 . 1 . . . . . 156 GLY H . 53572 2
263 . 2 . 2 45 45 GLY HA2 H 1 4.28 0.019 . 2 . . . . . 156 GLY HA2 . 53572 2
264 . 2 . 2 45 45 GLY HA3 H 1 3.389 0.011 . 2 . . . . . 156 GLY HA3 . 53572 2
265 . 2 . 2 45 45 GLY C C 13 172.159 0.079 . 1 . . . . . 156 GLY C . 53572 2
266 . 2 . 2 45 45 GLY CA C 13 44.426 0.086 . 1 . . . . . 156 GLY CA . 53572 2
267 . 2 . 2 45 45 GLY N N 15 109.669 0.275 . 1 . . . . . 156 GLY N . 53572 2
268 . 2 . 2 46 46 ARG H H 1 8.491 0.008 . 1 . . . . . 157 ARG H . 53572 2
269 . 2 . 2 46 46 ARG HA H 1 4.758 0.012 . 1 . . . . . 157 ARG HA . 53572 2
270 . 2 . 2 46 46 ARG HD2 H 1 3.242 0.008 . 1 . . . . . 157 ARG HD2 . 53572 2
271 . 2 . 2 46 46 ARG C C 13 178.595 0.107 . 1 . . . . . 157 ARG C . 53572 2
272 . 2 . 2 46 46 ARG CA C 13 54.874 0.081 . 1 . . . . . 157 ARG CA . 53572 2
273 . 2 . 2 46 46 ARG CB C 13 31.67 0.179 . 1 . . . . . 157 ARG CB . 53572 2
274 . 2 . 2 46 46 ARG CG C 13 27.14 0.05 . 1 . . . . . 157 ARG CG . 53572 2
275 . 2 . 2 46 46 ARG CD C 13 43.62 0.046 . 1 . . . . . 157 ARG CD . 53572 2
276 . 2 . 2 46 46 ARG CZ C 13 159.299 0 . 1 . . . . . 157 ARG CZ . 53572 2
277 . 2 . 2 46 46 ARG N N 15 118.62 0.344 . 1 . . . . . 157 ARG N . 53572 2
278 . 2 . 2 47 47 GLY H H 1 9.209 0.022 . 1 . . . . . 158 GLY H . 53572 2
279 . 2 . 2 47 47 GLY HA2 H 1 3.868 0.009 . 2 . . . . . 158 GLY HA2 . 53572 2
280 . 2 . 2 47 47 GLY HA3 H 1 3.489 0.004 . 2 . . . . . 158 GLY HA3 . 53572 2
281 . 2 . 2 47 47 GLY C C 13 174.791 0.058 . 1 . . . . . 158 GLY C . 53572 2
282 . 2 . 2 47 47 GLY CA C 13 47.426 0.059 . 1 . . . . . 158 GLY CA . 53572 2
283 . 2 . 2 47 47 GLY N N 15 113.148 0.182 . 1 . . . . . 158 GLY N . 53572 2
284 . 2 . 2 48 48 GLU H H 1 8.783 0.015 . 1 . . . . . 159 GLU H . 53572 2
285 . 2 . 2 48 48 GLU HA H 1 4.296 0.004 . 1 . . . . . 159 GLU HA . 53572 2
286 . 2 . 2 48 48 GLU HB2 H 1 2.017 0.02 . 1 . . . . . 159 GLU HB2 . 53572 2
287 . 2 . 2 48 48 GLU C C 13 176.706 0.058 . 1 . . . . . 159 GLU C . 53572 2
288 . 2 . 2 48 48 GLU CA C 13 58.664 0.056 . 1 . . . . . 159 GLU CA . 53572 2
289 . 2 . 2 48 48 GLU CB C 13 28.654 0.08 . 1 . . . . . 159 GLU CB . 53572 2
290 . 2 . 2 48 48 GLU CG C 13 37.043 0.163 . 1 . . . . . 159 GLU CG . 53572 2
291 . 2 . 2 48 48 GLU CD C 13 184.789 0.017 . 1 . . . . . 159 GLU CD . 53572 2
292 . 2 . 2 48 48 GLU N N 15 115.399 0.145 . 1 . . . . . 159 GLU N . 53572 2
293 . 2 . 2 49 49 ASP H H 1 7.64 0.011 . 1 . . . . . 160 ASP H . 53572 2
294 . 2 . 2 49 49 ASP HA H 1 4.972 0.009 . 1 . . . . . 160 ASP HA . 53572 2
295 . 2 . 2 49 49 ASP C C 13 174.499 0.057 . 1 . . . . . 160 ASP C . 53572 2
296 . 2 . 2 49 49 ASP CA C 13 54.303 0.068 . 1 . . . . . 160 ASP CA . 53572 2
297 . 2 . 2 49 49 ASP CB C 13 41.89 0.071 . 1 . . . . . 160 ASP CB . 53572 2
298 . 2 . 2 49 49 ASP CG C 13 180.583 0.055 . 1 . . . . . 160 ASP CG . 53572 2
299 . 2 . 2 49 49 ASP N N 15 118.539 0.097 . 1 . . . . . 160 ASP N . 53572 2
300 . 2 . 2 50 50 ILE H H 1 8.011 0.011 . 1 . . . . . 161 ILE H . 53572 2
301 . 2 . 2 50 50 ILE HA H 1 4.886 0.021 . 1 . . . . . 161 ILE HA . 53572 2
302 . 2 . 2 50 50 ILE C C 13 174.25 0.068 . 1 . . . . . 161 ILE C . 53572 2
303 . 2 . 2 50 50 ILE CA C 13 61.356 0.087 . 1 . . . . . 161 ILE CA . 53572 2
304 . 2 . 2 50 50 ILE CB C 13 39.435 0.075 . 1 . . . . . 161 ILE CB . 53572 2
305 . 2 . 2 50 50 ILE CG1 C 13 27.489 0.048 . 1 . . . . . 161 ILE CG1 . 53572 2
306 . 2 . 2 50 50 ILE CG2 C 13 17.086 0.036 . 1 . . . . . 161 ILE CG2 . 53572 2
307 . 2 . 2 50 50 ILE CD1 C 13 15.466 0.054 . 1 . . . . . 161 ILE CD1 . 53572 2
308 . 2 . 2 50 50 ILE N N 15 122.886 0.159 . 1 . . . . . 161 ILE N . 53572 2
309 . 2 . 2 51 51 THR H H 1 8.905 0.01 . 1 . . . . . 162 THR H . 53572 2
310 . 2 . 2 51 51 THR HA H 1 5.024 0.013 . 1 . . . . . 162 THR HA . 53572 2
311 . 2 . 2 51 51 THR HB H 1 3.939 0.035 . 1 . . . . . 162 THR HB . 53572 2
312 . 2 . 2 51 51 THR HG21 H 1 1.188 0 . 1 . . . . . 162 THR HG21 . 53572 2
313 . 2 . 2 51 51 THR HG22 H 1 1.188 0 . 1 . . . . . 162 THR HG22 . 53572 2
314 . 2 . 2 51 51 THR HG23 H 1 1.188 0 . 1 . . . . . 162 THR HG23 . 53572 2
315 . 2 . 2 51 51 THR C C 13 172.239 0.05 . 1 . . . . . 162 THR C . 53572 2
316 . 2 . 2 51 51 THR CA C 13 61.84 0.07 . 1 . . . . . 162 THR CA . 53572 2
317 . 2 . 2 51 51 THR CB C 13 70.835 0.078 . 1 . . . . . 162 THR CB . 53572 2
318 . 2 . 2 51 51 THR CG2 C 13 22.015 0.041 . 1 . . . . . 162 THR CG2 . 53572 2
319 . 2 . 2 51 51 THR N N 15 124.126 0.122 . 1 . . . . . 162 THR N . 53572 2
320 . 2 . 2 52 52 LEU H H 1 9.477 0.012 . 1 . . . . . 163 LEU H . 53572 2
321 . 2 . 2 52 52 LEU HA H 1 5.36 0.004 . 1 . . . . . 163 LEU HA . 53572 2
322 . 2 . 2 52 52 LEU C C 13 173.649 0.064 . 1 . . . . . 163 LEU C . 53572 2
323 . 2 . 2 52 52 LEU CA C 13 53.04 0.092 . 1 . . . . . 163 LEU CA . 53572 2
324 . 2 . 2 52 52 LEU CB C 13 45.383 0.102 . 1 . . . . . 163 LEU CB . 53572 2
325 . 2 . 2 52 52 LEU CG C 13 28.162 0.04 . 1 . . . . . 163 LEU CG . 53572 2
326 . 2 . 2 52 52 LEU CD1 C 13 26.51 0.055 . 2 . . . . . 163 LEU CD1 . 53572 2
327 . 2 . 2 52 52 LEU CD2 C 13 24.432 0.024 . 2 . . . . . 163 LEU CD2 . 53572 2
328 . 2 . 2 52 52 LEU N N 15 130.279 0.141 . 1 . . . . . 163 LEU N . 53572 2
329 . 2 . 2 53 53 VAL H H 1 9.707 0.024 . 1 . . . . . 164 VAL H . 53572 2
330 . 2 . 2 53 53 VAL HA H 1 5.106 0.016 . 1 . . . . . 164 VAL HA . 53572 2
331 . 2 . 2 53 53 VAL HB H 1 1.974 0.012 . 1 . . . . . 164 VAL HB . 53572 2
332 . 2 . 2 53 53 VAL C C 13 174.799 0.104 . 1 . . . . . 164 VAL C . 53572 2
333 . 2 . 2 53 53 VAL CA C 13 60.381 0.104 . 1 . . . . . 164 VAL CA . 53572 2
334 . 2 . 2 53 53 VAL CB C 13 34.235 0.103 . 1 . . . . . 164 VAL CB . 53572 2
335 . 2 . 2 53 53 VAL CG1 C 13 23.283 0.084 . 2 . . . . . 164 VAL CG1 . 53572 2
336 . 2 . 2 53 53 VAL CG2 C 13 22.515 0.07 . 2 . . . . . 164 VAL CG2 . 53572 2
337 . 2 . 2 53 53 VAL N N 15 127.112 0.215 . 1 . . . . . 164 VAL N . 53572 2
338 . 2 . 2 54 54 ARG H H 1 8.168 0 . 1 . . . . . 165 ARG H . 53572 2
339 . 2 . 2 54 54 ARG HA H 1 5.55 0.028 . 1 . . . . . 165 ARG HA . 53572 2
340 . 2 . 2 54 54 ARG C C 13 174.952 0.126 . 1 . . . . . 165 ARG C . 53572 2
341 . 2 . 2 54 54 ARG CA C 13 54.286 0.079 . 1 . . . . . 165 ARG CA . 53572 2
342 . 2 . 2 54 54 ARG CB C 13 32.665 0.104 . 1 . . . . . 165 ARG CB . 53572 2
343 . 2 . 2 54 54 ARG N N 15 125.097 0.27 . 1 . . . . . 165 ARG N . 53572 2
344 . 2 . 2 55 55 VAL H H 1 7.917 0 . 1 . . . . . 166 VAL H . 53572 2
345 . 2 . 2 55 55 VAL C C 13 174.495 0.07 . 1 . . . . . 166 VAL C . 53572 2
346 . 2 . 2 55 55 VAL CA C 13 57.193 0.1 . 1 . . . . . 166 VAL CA . 53572 2
347 . 2 . 2 55 55 VAL CB C 13 33.081 0.115 . 1 . . . . . 166 VAL CB . 53572 2
348 . 2 . 2 55 55 VAL CG1 C 13 22.392 0.055 . 2 . . . . . 166 VAL CG1 . 53572 2
349 . 2 . 2 55 55 VAL CG2 C 13 18.077 0.032 . 2 . . . . . 166 VAL CG2 . 53572 2
350 . 2 . 2 55 55 VAL N N 15 111.315 0.33 . 1 . . . . . 166 VAL N . 53572 2
351 . 2 . 2 56 56 PRO CA C 13 65.537 0.035 . 1 . . . . . 167 PRO CA . 53572 2
352 . 2 . 2 56 56 PRO CD C 13 51.525 0.072 . 1 . . . . . 167 PRO CD . 53572 2
353 . 2 . 2 56 56 PRO N N 15 133.112 0.223 . 1 . . . . . 167 PRO N . 53572 2
354 . 2 . 2 61 61 ILE C C 13 173.076 0.161 . 1 . . . . . 172 ILE C . 53572 2
355 . 2 . 2 61 61 ILE CA C 13 66.788 0.089 . 1 . . . . . 172 ILE CA . 53572 2
356 . 2 . 2 61 61 ILE CB C 13 35.065 0.098 . 1 . . . . . 172 ILE CB . 53572 2
357 . 2 . 2 61 61 ILE CG2 C 13 17.751 0.019 . 1 . . . . . 172 ILE CG2 . 53572 2
358 . 2 . 2 61 61 ILE CD1 C 13 14.917 0.026 . 1 . . . . . 172 ILE CD1 . 53572 2
359 . 2 . 2 61 61 ILE N N 15 119.336 0.216 . 1 . . . . . 172 ILE N . 53572 2
360 . 2 . 2 62 62 PRO C C 13 175.931 0.088 . 1 . . . . . 173 PRO C . 53572 2
361 . 2 . 2 62 62 PRO CA C 13 63.631 0.058 . 1 . . . . . 173 PRO CA . 53572 2
362 . 2 . 2 62 62 PRO CB C 13 31.26 0.086 . 1 . . . . . 173 PRO CB . 53572 2
363 . 2 . 2 62 62 PRO CG C 13 28.326 0.094 . 1 . . . . . 173 PRO CG . 53572 2
364 . 2 . 2 62 62 PRO CD C 13 50.731 0.095 . 1 . . . . . 173 PRO CD . 53572 2
365 . 2 . 2 62 62 PRO N N 15 138.786 0.163 . 1 . . . . . 173 PRO N . 53572 2
366 . 2 . 2 63 63 VAL H H 1 7.885 0.04 . 1 . . . . . 174 VAL H . 53572 2
367 . 2 . 2 63 63 VAL HA H 1 5.158 0 . 1 . . . . . 174 VAL HA . 53572 2
368 . 2 . 2 63 63 VAL C C 13 174.781 0 . 1 . . . . . 174 VAL C . 53572 2
369 . 2 . 2 63 63 VAL CA C 13 60.935 0.082 . 1 . . . . . 174 VAL CA . 53572 2
370 . 2 . 2 63 63 VAL CG1 C 13 22.43 0 . 2 . . . . . 174 VAL CG1 . 53572 2
371 . 2 . 2 63 63 VAL CG2 C 13 19.892 0.017 . 2 . . . . . 174 VAL CG2 . 53572 2
372 . 2 . 2 63 63 VAL N N 15 126.081 0.381 . 1 . . . . . 174 VAL N . 53572 2
373 . 2 . 2 64 64 ALA H H 1 8.021 0.011 . 1 . . . . . 175 ALA H . 53572 2
374 . 2 . 2 64 64 ALA N N 15 120.624 0.047 . 1 . . . . . 175 ALA N . 53572 2
375 . 2 . 2 65 65 ALA H H 1 8.881 0.02 . 1 . . . . . 176 ALA H . 53572 2
376 . 2 . 2 65 65 ALA HA H 1 3.737 0.001 . 1 . . . . . 176 ALA HA . 53572 2
377 . 2 . 2 65 65 ALA C C 13 177.813 0.066 . 1 . . . . . 176 ALA C . 53572 2
378 . 2 . 2 65 65 ALA CA C 13 55.15 0.102 . 1 . . . . . 176 ALA CA . 53572 2
379 . 2 . 2 65 65 ALA CB C 13 18.047 0.068 . 1 . . . . . 176 ALA CB . 53572 2
380 . 2 . 2 65 65 ALA N N 15 116.9 0.345 . 1 . . . . . 176 ALA N . 53572 2
381 . 2 . 2 66 66 ASP H H 1 7.504 0.031 . 1 . . . . . 177 ASP H . 53572 2
382 . 2 . 2 66 66 ASP HA H 1 4.113 0.008 . 1 . . . . . 177 ASP HA . 53572 2
383 . 2 . 2 66 66 ASP C C 13 179.497 0 . 1 . . . . . 177 ASP C . 53572 2
384 . 2 . 2 66 66 ASP CA C 13 57.951 0.153 . 1 . . . . . 177 ASP CA . 53572 2
385 . 2 . 2 66 66 ASP CB C 13 42.703 0.05 . 1 . . . . . 177 ASP CB . 53572 2
386 . 2 . 2 66 66 ASP N N 15 118.057 0.224 . 1 . . . . . 177 ASP N . 53572 2
387 . 2 . 2 67 67 GLU C C 13 179.353 0.057 . 1 . . . . . 178 GLU C . 53572 2
388 . 2 . 2 67 67 GLU CA C 13 59.05 0.197 . 1 . . . . . 178 GLU CA . 53572 2
389 . 2 . 2 67 67 GLU CB C 13 29.628 0.061 . 1 . . . . . 178 GLU CB . 53572 2
390 . 2 . 2 67 67 GLU CG C 13 35.513 0.02 . 1 . . . . . 178 GLU CG . 53572 2
391 . 2 . 2 67 67 GLU CD C 13 182.58 0 . 1 . . . . . 178 GLU CD . 53572 2
392 . 2 . 2 67 67 GLU N N 15 119.066 0.261 . 1 . . . . . 178 GLU N . 53572 2
393 . 2 . 2 68 68 LEU H H 1 7.954 0.001 . 1 . . . . . 179 LEU H . 53572 2
394 . 2 . 2 68 68 LEU HA H 1 3.863 0.053 . 1 . . . . . 179 LEU HA . 53572 2
395 . 2 . 2 68 68 LEU C C 13 177.661 0.139 . 1 . . . . . 179 LEU C . 53572 2
396 . 2 . 2 68 68 LEU CA C 13 57.227 0.083 . 1 . . . . . 179 LEU CA . 53572 2
397 . 2 . 2 68 68 LEU CB C 13 43.295 0.08 . 1 . . . . . 179 LEU CB . 53572 2
398 . 2 . 2 68 68 LEU CG C 13 26.476 0.052 . 1 . . . . . 179 LEU CG . 53572 2
399 . 2 . 2 68 68 LEU N N 15 115.845 0.42 . 1 . . . . . 179 LEU N . 53572 2
400 . 2 . 2 69 69 ALA H H 1 8.716 0.013 . 1 . . . . . 180 ALA H . 53572 2
401 . 2 . 2 69 69 ALA HA H 1 3.574 0.005 . 1 . . . . . 180 ALA HA . 53572 2
402 . 2 . 2 69 69 ALA C C 13 178.155 0.105 . 1 . . . . . 180 ALA C . 53572 2
403 . 2 . 2 69 69 ALA CA C 13 54.562 0.084 . 1 . . . . . 180 ALA CA . 53572 2
404 . 2 . 2 69 69 ALA CB C 13 18.902 0.126 . 1 . . . . . 180 ALA CB . 53572 2
405 . 2 . 2 69 69 ALA N N 15 117.142 0.215 . 1 . . . . . 180 ALA N . 53572 2
406 . 2 . 2 70 70 ARG H H 1 7.359 0.045 . 1 . . . . . 181 ARG H . 53572 2
407 . 2 . 2 70 70 ARG HA H 1 3.965 0.005 . 1 . . . . . 181 ARG HA . 53572 2
408 . 2 . 2 70 70 ARG C C 13 177.164 0.064 . 1 . . . . . 181 ARG C . 53572 2
409 . 2 . 2 70 70 ARG CA C 13 57.172 0.092 . 1 . . . . . 181 ARG CA . 53572 2
410 . 2 . 2 70 70 ARG CB C 13 30.094 0.107 . 1 . . . . . 181 ARG CB . 53572 2
411 . 2 . 2 70 70 ARG CD C 13 42.593 0.11 . 1 . . . . . 181 ARG CD . 53572 2
412 . 2 . 2 70 70 ARG CZ C 13 159.357 0 . 1 . . . . . 181 ARG CZ . 53572 2
413 . 2 . 2 70 70 ARG N N 15 113.116 0.218 . 1 . . . . . 181 ARG N . 53572 2
414 . 2 . 2 71 71 LYS H H 1 7.359 0.042 . 1 . . . . . 182 LYS H . 53572 2
415 . 2 . 2 71 71 LYS HA H 1 4.131 0.008 . 1 . . . . . 182 LYS HA . 53572 2
416 . 2 . 2 71 71 LYS C C 13 177.665 0.097 . 1 . . . . . 182 LYS C . 53572 2
417 . 2 . 2 71 71 LYS CA C 13 57.007 0.082 . 1 . . . . . 182 LYS CA . 53572 2
418 . 2 . 2 71 71 LYS CB C 13 31.661 0.095 . 1 . . . . . 182 LYS CB . 53572 2
419 . 2 . 2 71 71 LYS CG C 13 24.988 0.083 . 1 . . . . . 182 LYS CG . 53572 2
420 . 2 . 2 71 71 LYS CD C 13 28.957 0.04 . 1 . . . . . 182 LYS CD . 53572 2
421 . 2 . 2 71 71 LYS N N 15 121.711 0.139 . 1 . . . . . 182 LYS N . 53572 2
422 . 2 . 2 72 72 GLU H H 1 8.788 0.004 . 1 . . . . . 183 GLU H . 53572 2
423 . 2 . 2 72 72 GLU HA H 1 4.036 0.017 . 1 . . . . . 183 GLU HA . 53572 2
424 . 2 . 2 72 72 GLU C C 13 177.049 0.073 . 1 . . . . . 183 GLU C . 53572 2
425 . 2 . 2 72 72 GLU CA C 13 57.994 0.074 . 1 . . . . . 183 GLU CA . 53572 2
426 . 2 . 2 72 72 GLU CB C 13 29.487 0.049 . 1 . . . . . 183 GLU CB . 53572 2
427 . 2 . 2 72 72 GLU N N 15 122.368 0.196 . 1 . . . . . 183 GLU N . 53572 2
428 . 2 . 2 73 73 ASP H H 1 8.34 0.015 . 1 . . . . . 184 ASP H . 53572 2
429 . 2 . 2 73 73 ASP HA H 1 4.495 0.008 . 1 . . . . . 184 ASP HA . 53572 2
430 . 2 . 2 73 73 ASP C C 13 173.835 0.061 . 1 . . . . . 184 ASP C . 53572 2
431 . 2 . 2 73 73 ASP CA C 13 52.354 0.094 . 1 . . . . . 184 ASP CA . 53572 2
432 . 2 . 2 73 73 ASP CB C 13 39.229 0.093 . 1 . . . . . 184 ASP CB . 53572 2
433 . 2 . 2 73 73 ASP CG C 13 180.81 0.057 . 1 . . . . . 184 ASP CG . 53572 2
434 . 2 . 2 73 73 ASP N N 15 114.135 0.163 . 1 . . . . . 184 ASP N . 53572 2
435 . 2 . 2 74 74 ILE H H 1 6.792 0.01 . 1 . . . . . 185 ILE H . 53572 2
436 . 2 . 2 74 74 ILE HA H 1 3.877 0 . 1 . . . . . 185 ILE HA . 53572 2
437 . 2 . 2 74 74 ILE HD11 H 1 0.532 0 . 1 . . . . . 185 ILE HD11 . 53572 2
438 . 2 . 2 74 74 ILE HD12 H 1 0.532 0 . 1 . . . . . 185 ILE HD12 . 53572 2
439 . 2 . 2 74 74 ILE HD13 H 1 0.532 0 . 1 . . . . . 185 ILE HD13 . 53572 2
440 . 2 . 2 74 74 ILE C C 13 175.081 0.037 . 1 . . . . . 185 ILE C . 53572 2
441 . 2 . 2 74 74 ILE CA C 13 58.295 0.14 . 1 . . . . . 185 ILE CA . 53572 2
442 . 2 . 2 74 74 ILE CB C 13 37.252 0.062 . 1 . . . . . 185 ILE CB . 53572 2
443 . 2 . 2 74 74 ILE CG1 C 13 26.067 0.078 . 1 . . . . . 185 ILE CG1 . 53572 2
444 . 2 . 2 74 74 ILE CG2 C 13 18.077 0.035 . 1 . . . . . 185 ILE CG2 . 53572 2
445 . 2 . 2 74 74 ILE CD1 C 13 9.487 0.055 . 1 . . . . . 185 ILE CD1 . 53572 2
446 . 2 . 2 74 74 ILE N N 15 118.369 0.12 . 1 . . . . . 185 ILE N . 53572 2
447 . 2 . 2 75 75 ASP H H 1 8.685 0.005 . 1 . . . . . 186 ASP H . 53572 2
448 . 2 . 2 75 75 ASP HA H 1 4.739 0.011 . 1 . . . . . 186 ASP HA . 53572 2
449 . 2 . 2 75 75 ASP C C 13 175.263 0.062 . 1 . . . . . 186 ASP C . 53572 2
450 . 2 . 2 75 75 ASP CA C 13 55.917 0.089 . 1 . . . . . 186 ASP CA . 53572 2
451 . 2 . 2 75 75 ASP CB C 13 43.065 0.078 . 1 . . . . . 186 ASP CB . 53572 2
452 . 2 . 2 75 75 ASP CG C 13 179.537 0.059 . 1 . . . . . 186 ASP CG . 53572 2
453 . 2 . 2 75 75 ASP N N 15 124.206 0.174 . 1 . . . . . 186 ASP N . 53572 2
454 . 2 . 2 76 76 ALA H H 1 7.259 0.007 . 1 . . . . . 187 ALA H . 53572 2
455 . 2 . 2 76 76 ALA HA H 1 4.711 0.014 . 1 . . . . . 187 ALA HA . 53572 2
456 . 2 . 2 76 76 ALA C C 13 174.674 0.082 . 1 . . . . . 187 ALA C . 53572 2
457 . 2 . 2 76 76 ALA CA C 13 51.732 0.083 . 1 . . . . . 187 ALA CA . 53572 2
458 . 2 . 2 76 76 ALA CB C 13 22.228 0.084 . 1 . . . . . 187 ALA CB . 53572 2
459 . 2 . 2 76 76 ALA N N 15 116.632 0.114 . 1 . . . . . 187 ALA N . 53572 2
460 . 2 . 2 77 77 VAL H H 1 8.735 0.032 . 1 . . . . . 188 VAL H . 53572 2
461 . 2 . 2 77 77 VAL C C 13 173.575 0.042 . 1 . . . . . 188 VAL C . 53572 2
462 . 2 . 2 77 77 VAL CA C 13 60.295 0.131 . 1 . . . . . 188 VAL CA . 53572 2
463 . 2 . 2 77 77 VAL CB C 13 34.909 0.108 . 1 . . . . . 188 VAL CB . 53572 2
464 . 2 . 2 77 77 VAL CG1 C 13 22.36 0.039 . 2 . . . . . 188 VAL CG1 . 53572 2
465 . 2 . 2 77 77 VAL CG2 C 13 20.731 0.046 . 2 . . . . . 188 VAL CG2 . 53572 2
466 . 2 . 2 77 77 VAL N N 15 120.398 0.102 . 1 . . . . . 188 VAL N . 53572 2
467 . 2 . 2 78 78 ILE H H 1 8.956 0.018 . 1 . . . . . 189 ILE H . 53572 2
468 . 2 . 2 78 78 ILE HA H 1 4.307 0.033 . 1 . . . . . 189 ILE HA . 53572 2
469 . 2 . 2 78 78 ILE C C 13 173.461 0.05 . 1 . . . . . 189 ILE C . 53572 2
470 . 2 . 2 78 78 ILE CA C 13 59.438 0.118 . 1 . . . . . 189 ILE CA . 53572 2
471 . 2 . 2 78 78 ILE CB C 13 41.386 0.066 . 1 . . . . . 189 ILE CB . 53572 2
472 . 2 . 2 78 78 ILE CG1 C 13 26.97 0.091 . 1 . . . . . 189 ILE CG1 . 53572 2
473 . 2 . 2 78 78 ILE CG2 C 13 18.552 0.087 . 1 . . . . . 189 ILE CG2 . 53572 2
474 . 2 . 2 78 78 ILE CD1 C 13 14.391 0.056 . 1 . . . . . 189 ILE CD1 . 53572 2
475 . 2 . 2 78 78 ILE N N 15 127.895 0.548 . 1 . . . . . 189 ILE N . 53572 2
476 . 2 . 2 79 79 ALA H H 1 8.275 0.008 . 1 . . . . . 190 ALA H . 53572 2
477 . 2 . 2 79 79 ALA HA H 1 5.686 0.006 . 1 . . . . . 190 ALA HA . 53572 2
478 . 2 . 2 79 79 ALA C C 13 176.491 0.021 . 1 . . . . . 190 ALA C . 53572 2
479 . 2 . 2 79 79 ALA CA C 13 49.232 0.075 . 1 . . . . . 190 ALA CA . 53572 2
480 . 2 . 2 79 79 ALA CB C 13 22.225 0.061 . 1 . . . . . 190 ALA CB . 53572 2
481 . 2 . 2 79 79 ALA N N 15 126.776 0.288 . 1 . . . . . 190 ALA N . 53572 2
482 . 2 . 2 80 80 PHE H H 1 8.73 0.005 . 1 . . . . . 191 PHE H . 53572 2
483 . 2 . 2 80 80 PHE HA H 1 5.559 0.016 . 1 . . . . . 191 PHE HA . 53572 2
484 . 2 . 2 80 80 PHE C C 13 174.753 0.101 . 1 . . . . . 191 PHE C . 53572 2
485 . 2 . 2 80 80 PHE CA C 13 55.143 0.089 . 1 . . . . . 191 PHE CA . 53572 2
486 . 2 . 2 80 80 PHE CB C 13 42.61 0 . 1 . . . . . 191 PHE CB . 53572 2
487 . 2 . 2 80 80 PHE CG C 13 138.585 0 . 1 . . . . . 191 PHE CG . 53572 2
488 . 2 . 2 80 80 PHE N N 15 120.302 0.316 . 1 . . . . . 191 PHE N . 53572 2
489 . 2 . 2 81 81 GLY CA C 13 44.444 0 . 1 . . . . . 192 GLY CA . 53572 2
490 . 2 . 2 81 81 GLY N N 15 109.049 0.353 . 1 . . . . . 192 GLY N . 53572 2
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