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 53616
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'sn3 list'
_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
3 '3D CBCA(CO)NH' . . . 53616 1
4 '3D HNCACB' . . . 53616 1
5 '3D HNCO' . . . 53616 1
6 '3D HN(CA)CO' . . . 53616 1
7 '3D 1H-15N NOESY' . . . 53616 1
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 . . 53616 1
2 $software_2 . . 53616 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 1 1 PRO C C 13 176.951 0.005 . 1 . . . . . 2 P C . 53616 1
2 . 1 . 1 1 1 PRO CA C 13 63.193 0.010 . 1 . . . . . 2 P CA . 53616 1
3 . 1 . 1 1 1 PRO CB C 13 32.405 0.060 . 1 . . . . . 2 P CB . 53616 1
4 . 1 . 1 2 2 LEU H H 1 8.567 0.001 . 1 . . . . . 3 L H . 53616 1
5 . 1 . 1 2 2 LEU C C 13 177.934 0.017 . 1 . . . . . 3 L C . 53616 1
6 . 1 . 1 2 2 LEU CA C 13 55.403 0.039 . 1 . . . . . 3 L CA . 53616 1
7 . 1 . 1 2 2 LEU CB C 13 42.670 0.070 . 1 . . . . . 3 L CB . 53616 1
8 . 1 . 1 2 2 LEU N N 15 122.502 0.021 . 1 . . . . . 3 L N . 53616 1
9 . 1 . 1 3 3 GLY H H 1 8.507 0.001 . 1 . . . . . 4 G H . 53616 1
10 . 1 . 1 3 3 GLY C C 13 174.627 0.028 . 1 . . . . . 4 G C . 53616 1
11 . 1 . 1 3 3 GLY CA C 13 45.468 0.014 . 1 . . . . . 4 G CA . 53616 1
12 . 1 . 1 3 3 GLY N N 15 109.963 0.018 . 1 . . . . . 4 G N . 53616 1
13 . 1 . 1 4 4 SER H H 1 8.414 0.001 . 1 . . . . . 5 S H . 53616 1
14 . 1 . 1 4 4 SER C C 13 174.469 0.041 . 1 . . . . . 5 S C . 53616 1
15 . 1 . 1 4 4 SER CA C 13 58.933 0.050 . 1 . . . . . 5 S CA . 53616 1
16 . 1 . 1 4 4 SER CB C 13 64.021 0.008 . 1 . . . . . 5 S CB . 53616 1
17 . 1 . 1 4 4 SER N N 15 116.049 0.023 . 1 . . . . . 5 S N . 53616 1
18 . 1 . 1 5 5 ASP H H 1 8.556 0.001 . 1 . . . . . 6 D H . 53616 1
19 . 1 . 1 5 5 ASP C C 13 176.286 0.064 . 1 . . . . . 6 D C . 53616 1
20 . 1 . 1 5 5 ASP CA C 13 54.897 0.062 . 1 . . . . . 6 D CA . 53616 1
21 . 1 . 1 5 5 ASP CB C 13 40.562 0.065 . 1 . . . . . 6 D CB . 53616 1
22 . 1 . 1 5 5 ASP N N 15 120.603 0.013 . 1 . . . . . 6 D N . 53616 1
23 . 1 . 1 6 6 LYS H H 1 8.143 0.001 . 1 . . . . . 7 K H . 53616 1
24 . 1 . 1 6 6 LYS C C 13 174.976 0.039 . 1 . . . . . 7 K C . 53616 1
25 . 1 . 1 6 6 LYS CA C 13 56.708 0.053 . 1 . . . . . 7 K CA . 53616 1
26 . 1 . 1 6 6 LYS CB C 13 33.856 0.090 . 1 . . . . . 7 K CB . 53616 1
27 . 1 . 1 6 6 LYS N N 15 119.165 0.026 . 1 . . . . . 7 K N . 53616 1
28 . 1 . 1 7 7 GLN H H 1 7.749 0.002 . 1 . . . . . 8 Q H . 53616 1
29 . 1 . 1 7 7 GLN C C 13 174.567 0.066 . 1 . . . . . 8 Q C . 53616 1
30 . 1 . 1 7 7 GLN CA C 13 54.582 0.069 . 1 . . . . . 8 Q CA . 53616 1
31 . 1 . 1 7 7 GLN CB C 13 31.589 0.040 . 1 . . . . . 8 Q CB . 53616 1
32 . 1 . 1 7 7 GLN N N 15 118.492 0.020 . 1 . . . . . 8 Q N . 53616 1
33 . 1 . 1 8 8 PHE H H 1 8.524 0.002 . 1 . . . . . 9 F H . 53616 1
34 . 1 . 1 8 8 PHE C C 13 172.531 0.049 . 1 . . . . . 9 F C . 53616 1
35 . 1 . 1 8 8 PHE CA C 13 55.979 0.075 . 1 . . . . . 9 F CA . 53616 1
36 . 1 . 1 8 8 PHE CB C 13 40.078 0.062 . 1 . . . . . 9 F CB . 53616 1
37 . 1 . 1 8 8 PHE N N 15 119.910 0.036 . 1 . . . . . 9 F N . 53616 1
38 . 1 . 1 9 9 VAL H H 1 8.554 0.009 . 1 . . . . . 10 V H . 53616 1
39 . 1 . 1 9 9 VAL C C 13 175.538 0.016 . 1 . . . . . 10 V C . 53616 1
40 . 1 . 1 9 9 VAL CA C 13 60.560 0.013 . 1 . . . . . 10 V CA . 53616 1
41 . 1 . 1 9 9 VAL CB C 13 33.574 0.049 . 1 . . . . . 10 V CB . 53616 1
42 . 1 . 1 9 9 VAL N N 15 119.728 0.054 . 1 . . . . . 10 V N . 53616 1
43 . 1 . 1 10 10 ALA H H 1 8.759 0.003 . 1 . . . . . 11 A H . 53616 1
44 . 1 . 1 10 10 ALA C C 13 173.824 0.054 . 1 . . . . . 11 A C . 53616 1
45 . 1 . 1 10 10 ALA CA C 13 51.029 0.020 . 1 . . . . . 11 A CA . 53616 1
46 . 1 . 1 10 10 ALA CB C 13 24.218 0.046 . 1 . . . . . 11 A CB . 53616 1
47 . 1 . 1 10 10 ALA N N 15 125.999 0.029 . 1 . . . . . 11 A N . 53616 1
48 . 1 . 1 11 11 LYS H H 1 8.061 0.001 . 1 . . . . . 12 K H . 53616 1
49 . 1 . 1 11 11 LYS C C 13 176.841 0.039 . 1 . . . . . 12 K C . 53616 1
50 . 1 . 1 11 11 LYS CA C 13 54.799 0.040 . 1 . . . . . 12 K CA . 53616 1
51 . 1 . 1 11 11 LYS CB C 13 35.478 0.051 . 1 . . . . . 12 K CB . 53616 1
52 . 1 . 1 11 11 LYS N N 15 119.879 0.034 . 1 . . . . . 12 K N . 53616 1
53 . 1 . 1 12 12 VAL H H 1 8.638 0.002 . 1 . . . . . 13 V H . 53616 1
54 . 1 . 1 12 12 VAL C C 13 175.277 0.036 . 1 . . . . . 13 V C . 53616 1
55 . 1 . 1 12 12 VAL CA C 13 65.207 0.042 . 1 . . . . . 13 V CA . 53616 1
56 . 1 . 1 12 12 VAL CB C 13 29.916 0.051 . 1 . . . . . 13 V CB . 53616 1
57 . 1 . 1 12 12 VAL N N 15 126.051 0.026 . 1 . . . . . 13 V N . 53616 1
58 . 1 . 1 13 13 MET H H 1 9.137 0.005 . 1 . . . . . 14 M H . 53616 1
59 . 1 . 1 13 13 MET C C 13 176.809 0.101 . 1 . . . . . 14 M C . 53616 1
60 . 1 . 1 13 13 MET CA C 13 54.193 0.025 . 1 . . . . . 14 M CA . 53616 1
61 . 1 . 1 13 13 MET CB C 13 32.936 0.049 . 1 . . . . . 14 M CB . 53616 1
62 . 1 . 1 13 13 MET N N 15 125.451 0.068 . 1 . . . . . 14 M N . 53616 1
63 . 1 . 1 14 14 GLN H H 1 7.722 0.002 . 1 . . . . . 15 Q H . 53616 1
64 . 1 . 1 14 14 GLN C C 13 173.917 0.076 . 1 . . . . . 15 Q C . 53616 1
65 . 1 . 1 14 14 GLN CA C 13 55.145 0.020 . 1 . . . . . 15 Q CA . 53616 1
66 . 1 . 1 14 14 GLN CB C 13 33.756 0.049 . 1 . . . . . 15 Q CB . 53616 1
67 . 1 . 1 14 14 GLN N N 15 115.358 0.044 . 1 . . . . . 15 Q N . 53616 1
68 . 1 . 1 15 15 VAL H H 1 9.232 0.002 . 1 . . . . . 16 V H . 53616 1
69 . 1 . 1 15 15 VAL C C 13 174.899 0.064 . 1 . . . . . 16 V C . 53616 1
70 . 1 . 1 15 15 VAL CA C 13 62.507 0.031 . 1 . . . . . 16 V CA . 53616 1
71 . 1 . 1 15 15 VAL CB C 13 33.446 0.050 . 1 . . . . . 16 V CB . 53616 1
72 . 1 . 1 15 15 VAL N N 15 125.047 0.036 . 1 . . . . . 16 V N . 53616 1
73 . 1 . 1 16 16 LEU H H 1 8.477 0.003 . 1 . . . . . 17 L H . 53616 1
74 . 1 . 1 16 16 LEU C C 13 176.372 0.051 . 1 . . . . . 17 L C . 53616 1
75 . 1 . 1 16 16 LEU CA C 13 55.578 0.026 . 1 . . . . . 17 L CA . 53616 1
76 . 1 . 1 16 16 LEU CB C 13 41.045 0.073 . 1 . . . . . 17 L CB . 53616 1
77 . 1 . 1 16 16 LEU N N 15 127.307 0.042 . 1 . . . . . 17 L N . 53616 1
78 . 1 . 1 17 17 ASN H H 1 8.550 0.003 . 1 . . . . . 18 N H . 53616 1
79 . 1 . 1 17 17 ASN C C 13 173.837 0.026 . 1 . . . . . 18 N C . 53616 1
80 . 1 . 1 17 17 ASN CA C 13 51.505 0.014 . 1 . . . . . 18 N CA . 53616 1
81 . 1 . 1 17 17 ASN CB C 13 40.570 0.083 . 1 . . . . . 18 N CB . 53616 1
82 . 1 . 1 17 17 ASN N N 15 115.195 0.087 . 1 . . . . . 18 N N . 53616 1
83 . 1 . 1 18 18 ALA H H 1 8.671 0.004 . 1 . . . . . 19 A H . 53616 1
84 . 1 . 1 18 18 ALA C C 13 171.981 0.036 . 1 . . . . . 19 A C . 53616 1
85 . 1 . 1 18 18 ALA CA C 13 53.628 0.013 . 1 . . . . . 19 A CA . 53616 1
86 . 1 . 1 18 18 ALA CB C 13 19.496 0.022 . 1 . . . . . 19 A CB . 53616 1
87 . 1 . 1 18 18 ALA N N 15 119.371 0.095 . 1 . . . . . 19 A N . 53616 1
88 . 1 . 1 19 19 ASP H H 1 7.605 0.005 . 1 . . . . . 20 D H . 53616 1
89 . 1 . 1 19 19 ASP C C 13 176.114 0.000 . 1 . . . . . 20 D C . 53616 1
90 . 1 . 1 19 19 ASP CA C 13 51.757 0.052 . 1 . . . . . 20 D CA . 53616 1
91 . 1 . 1 19 19 ASP CB C 13 42.869 0.028 . 1 . . . . . 20 D CB . 53616 1
92 . 1 . 1 19 19 ASP N N 15 105.104 0.069 . 1 . . . . . 20 D N . 53616 1
93 . 1 . 1 20 20 ALA H H 1 7.334 0.002 . 1 . . . . . 21 A H . 53616 1
94 . 1 . 1 20 20 ALA C C 13 175.384 0.013 . 1 . . . . . 21 A C . 53616 1
95 . 1 . 1 20 20 ALA CA C 13 52.580 0.070 . 1 . . . . . 21 A CA . 53616 1
96 . 1 . 1 20 20 ALA CB C 13 21.627 0.048 . 1 . . . . . 21 A CB . 53616 1
97 . 1 . 1 20 20 ALA N N 15 120.017 0.022 . 1 . . . . . 21 A N . 53616 1
98 . 1 . 1 21 21 ILE H H 1 8.947 0.003 . 1 . . . . . 22 I H . 53616 1
99 . 1 . 1 21 21 ILE C C 13 172.601 0.039 . 1 . . . . . 22 I C . 53616 1
100 . 1 . 1 21 21 ILE CA C 13 58.984 0.044 . 1 . . . . . 22 I CA . 53616 1
101 . 1 . 1 21 21 ILE CB C 13 41.999 0.016 . 1 . . . . . 22 I CB . 53616 1
102 . 1 . 1 21 21 ILE N N 15 115.291 0.030 . 1 . . . . . 22 I N . 53616 1
103 . 1 . 1 22 22 VAL H H 1 8.832 0.003 . 1 . . . . . 23 V H . 53616 1
104 . 1 . 1 22 22 VAL C C 13 176.662 0.090 . 1 . . . . . 23 V C . 53616 1
105 . 1 . 1 22 22 VAL CA C 13 61.801 0.033 . 1 . . . . . 23 V CA . 53616 1
106 . 1 . 1 22 22 VAL CB C 13 33.926 0.059 . 1 . . . . . 23 V CB . 53616 1
107 . 1 . 1 22 22 VAL N N 15 121.405 0.030 . 1 . . . . . 23 V N . 53616 1
108 . 1 . 1 23 23 VAL H H 1 9.296 0.003 . 1 . . . . . 24 V H . 53616 1
109 . 1 . 1 23 23 VAL C C 13 172.516 0.030 . 1 . . . . . 24 V C . 53616 1
110 . 1 . 1 23 23 VAL CA C 13 57.494 0.028 . 1 . . . . . 24 V CA . 53616 1
111 . 1 . 1 23 23 VAL CB C 13 34.185 0.042 . 1 . . . . . 24 V CB . 53616 1
112 . 1 . 1 23 23 VAL N N 15 119.595 0.046 . 1 . . . . . 24 V N . 53616 1
113 . 1 . 1 24 24 LYS H H 1 9.360 0.002 . 1 . . . . . 25 K H . 53616 1
114 . 1 . 1 24 24 LYS C C 13 176.780 0.009 . 1 . . . . . 25 K C . 53616 1
115 . 1 . 1 24 24 LYS CA C 13 54.910 0.059 . 1 . . . . . 25 K CA . 53616 1
116 . 1 . 1 24 24 LYS CB C 13 35.676 0.014 . 1 . . . . . 25 K CB . 53616 1
117 . 1 . 1 24 24 LYS N N 15 122.306 0.042 . 1 . . . . . 25 K N . 53616 1
118 . 1 . 1 25 25 LEU H H 1 9.045 0.004 . 1 . . . . . 26 L H . 53616 1
119 . 1 . 1 25 25 LEU C C 13 178.994 0.009 . 1 . . . . . 26 L C . 53616 1
120 . 1 . 1 25 25 LEU CA C 13 55.058 0.037 . 1 . . . . . 26 L CA . 53616 1
121 . 1 . 1 25 25 LEU CB C 13 42.821 0.079 . 1 . . . . . 26 L CB . 53616 1
122 . 1 . 1 25 25 LEU N N 15 128.672 0.065 . 1 . . . . . 26 L N . 53616 1
123 . 1 . 1 26 26 ASN H H 1 9.932 0.003 . 1 . . . . . 27 N H . 53616 1
124 . 1 . 1 26 26 ASN C C 13 176.433 0.066 . 1 . . . . . 27 N C . 53616 1
125 . 1 . 1 26 26 ASN CA C 13 56.188 0.060 . 1 . . . . . 27 N CA . 53616 1
126 . 1 . 1 26 26 ASN CB C 13 37.628 0.048 . 1 . . . . . 27 N CB . 53616 1
127 . 1 . 1 26 26 ASN N N 15 122.339 0.023 . 1 . . . . . 27 N N . 53616 1
128 . 1 . 1 27 27 SER H H 1 7.705 0.004 . 1 . . . . . 28 S H . 53616 1
129 . 1 . 1 27 27 SER C C 13 175.385 0.099 . 1 . . . . . 28 S C . 53616 1
130 . 1 . 1 27 27 SER CA C 13 58.663 0.072 . 1 . . . . . 28 S CA . 53616 1
131 . 1 . 1 27 27 SER CB C 13 63.797 0.037 . 1 . . . . . 28 S CB . 53616 1
132 . 1 . 1 27 27 SER N N 15 110.939 0.067 . 1 . . . . . 28 S N . 53616 1
133 . 1 . 1 28 28 GLY H H 1 8.112 0.003 . 1 . . . . . 29 G H . 53616 1
134 . 1 . 1 28 28 GLY C C 13 172.993 0.026 . 1 . . . . . 29 G C . 53616 1
135 . 1 . 1 28 28 GLY CA C 13 44.944 0.044 . 1 . . . . . 29 G CA . 53616 1
136 . 1 . 1 28 28 GLY N N 15 110.762 0.034 . 1 . . . . . 29 G N . 53616 1
137 . 1 . 1 29 29 ASP H H 1 7.399 0.002 . 1 . . . . . 30 D H . 53616 1
138 . 1 . 1 29 29 ASP C C 13 174.182 0.001 . 1 . . . . . 30 D C . 53616 1
139 . 1 . 1 29 29 ASP CA C 13 54.203 0.019 . 1 . . . . . 30 D CA . 53616 1
140 . 1 . 1 29 29 ASP CB C 13 41.958 0.040 . 1 . . . . . 30 D CB . 53616 1
141 . 1 . 1 29 29 ASP N N 15 118.828 0.029 . 1 . . . . . 30 D N . 53616 1
142 . 1 . 1 30 30 TYR H H 1 8.674 0.003 . 1 . . . . . 31 Y H . 53616 1
143 . 1 . 1 30 30 TYR C C 13 176.686 0.043 . 1 . . . . . 31 Y C . 53616 1
144 . 1 . 1 30 30 TYR CA C 13 56.371 0.022 . 1 . . . . . 31 Y CA . 53616 1
145 . 1 . 1 30 30 TYR CB C 13 39.739 0.021 . 1 . . . . . 31 Y CB . 53616 1
146 . 1 . 1 30 30 TYR N N 15 119.890 0.060 . 1 . . . . . 31 Y N . 53616 1
147 . 1 . 1 31 31 LYS H H 1 9.126 0.002 . 1 . . . . . 32 K H . 53616 1
148 . 1 . 1 31 31 LYS C C 13 174.836 0.027 . 1 . . . . . 32 K C . 53616 1
149 . 1 . 1 31 31 LYS CA C 13 55.372 0.042 . 1 . . . . . 32 K CA . 53616 1
150 . 1 . 1 31 31 LYS CB C 13 37.429 0.016 . 1 . . . . . 32 K CB . 53616 1
151 . 1 . 1 31 31 LYS N N 15 121.743 0.014 . 1 . . . . . 32 K N . 53616 1
152 . 1 . 1 32 32 THR H H 1 9.068 0.002 . 1 . . . . . 33 T H . 53616 1
153 . 1 . 1 32 32 THR C C 13 174.321 0.056 . 1 . . . . . 33 T C . 53616 1
154 . 1 . 1 32 32 THR CA C 13 63.230 0.012 . 1 . . . . . 33 T CA . 53616 1
155 . 1 . 1 32 32 THR CB C 13 68.568 0.040 . 1 . . . . . 33 T CB . 53616 1
156 . 1 . 1 32 32 THR N N 15 123.906 0.019 . 1 . . . . . 33 T N . 53616 1
157 . 1 . 1 33 33 ILE H H 1 9.598 0.004 . 1 . . . . . 34 I H . 53616 1
158 . 1 . 1 33 33 ILE C C 13 173.570 0.087 . 1 . . . . . 34 I C . 53616 1
159 . 1 . 1 33 33 ILE CA C 13 57.798 0.015 . 1 . . . . . 34 I CA . 53616 1
160 . 1 . 1 33 33 ILE CB C 13 39.338 0.022 . 1 . . . . . 34 I CB . 53616 1
161 . 1 . 1 33 33 ILE N N 15 130.704 0.044 . 1 . . . . . 34 I N . 53616 1
162 . 1 . 1 34 34 HIS H H 1 9.024 0.002 . 1 . . . . . 35 H H . 53616 1
163 . 1 . 1 34 34 HIS C C 13 175.740 0.047 . 1 . . . . . 35 H C . 53616 1
164 . 1 . 1 34 34 HIS CA C 13 55.559 0.016 . 1 . . . . . 35 H CA . 53616 1
165 . 1 . 1 34 34 HIS CB C 13 32.165 0.085 . 1 . . . . . 35 H CB . 53616 1
166 . 1 . 1 34 34 HIS N N 15 125.302 0.037 . 1 . . . . . 35 H N . 53616 1
167 . 1 . 1 35 35 LEU H H 1 8.650 0.004 . 1 . . . . . 36 L H . 53616 1
168 . 1 . 1 35 35 LEU C C 13 177.003 0.000 . 1 . . . . . 36 L C . 53616 1
169 . 1 . 1 35 35 LEU CA C 13 53.905 0.034 . 1 . . . . . 36 L CA . 53616 1
170 . 1 . 1 35 35 LEU CB C 13 41.064 0.047 . 1 . . . . . 36 L CB . 53616 1
171 . 1 . 1 35 35 LEU N N 15 122.405 0.041 . 1 . . . . . 36 L N . 53616 1
172 . 1 . 1 36 36 SER H H 1 9.053 0.003 . 1 . . . . . 37 S H . 53616 1
173 . 1 . 1 36 36 SER C C 13 174.755 0.041 . 1 . . . . . 37 S C . 53616 1
174 . 1 . 1 36 36 SER CA C 13 58.600 0.040 . 1 . . . . . 37 S CA . 53616 1
175 . 1 . 1 36 36 SER CB C 13 63.564 0.071 . 1 . . . . . 37 S CB . 53616 1
176 . 1 . 1 36 36 SER N N 15 121.184 0.041 . 1 . . . . . 37 S N . 53616 1
177 . 1 . 1 37 37 SER H H 1 8.674 0.004 . 1 . . . . . 38 S H . 53616 1
178 . 1 . 1 37 37 SER C C 13 178.189 0.000 . 1 . . . . . 38 S C . 53616 1
179 . 1 . 1 37 37 SER CA C 13 58.867 0.000 . 1 . . . . . 38 S CA . 53616 1
180 . 1 . 1 37 37 SER N N 15 107.478 0.039 . 1 . . . . . 38 S N . 53616 1
181 . 1 . 1 38 38 ILE H H 1 8.210 0.002 . 1 . . . . . 39 I H . 53616 1
182 . 1 . 1 38 38 ILE CA C 13 61.428 0.000 . 1 . . . . . 39 I CA . 53616 1
183 . 1 . 1 38 38 ILE CB C 13 39.003 0.000 . 1 . . . . . 39 I CB . 53616 1
184 . 1 . 1 38 38 ILE N N 15 120.895 0.044 . 1 . . . . . 39 I N . 53616 1
185 . 1 . 1 41 41 PRO C C 13 176.195 0.000 . 1 . . . . . 42 P C . 53616 1
186 . 1 . 1 41 41 PRO CB C 13 32.825 0.067 . 1 . . . . . 42 P CB . 53616 1
187 . 1 . 1 42 42 ARG H H 1 8.225 0.002 . 1 . . . . . 43 R H . 53616 1
188 . 1 . 1 42 42 ARG C C 13 176.417 0.045 . 1 . . . . . 43 R C . 53616 1
189 . 1 . 1 42 42 ARG CA C 13 56.395 0.006 . 1 . . . . . 43 R CA . 53616 1
190 . 1 . 1 42 42 ARG CB C 13 32.756 0.038 . 1 . . . . . 43 R CB . 53616 1
191 . 1 . 1 42 42 ARG N N 15 121.332 0.065 . 1 . . . . . 43 R N . 53616 1
192 . 1 . 1 43 43 LEU H H 1 8.125 0.001 . 1 . . . . . 44 L H . 53616 1
193 . 1 . 1 43 43 LEU C C 13 176.770 0.017 . 1 . . . . . 44 L C . 53616 1
194 . 1 . 1 43 43 LEU CA C 13 55.132 0.048 . 1 . . . . . 44 L CA . 53616 1
195 . 1 . 1 43 43 LEU CB C 13 42.554 0.092 . 1 . . . . . 44 L CB . 53616 1
196 . 1 . 1 43 43 LEU N N 15 122.799 0.018 . 1 . . . . . 44 L N . 53616 1
197 . 1 . 1 44 44 GLU H H 1 8.648 0.007 . 1 . . . . . 45 E H . 53616 1
198 . 1 . 1 44 44 GLU C C 13 176.852 0.081 . 1 . . . . . 45 E C . 53616 1
199 . 1 . 1 44 44 GLU CA C 13 56.596 0.031 . 1 . . . . . 45 E CA . 53616 1
200 . 1 . 1 44 44 GLU CB C 13 30.581 0.014 . 1 . . . . . 45 E CB . 53616 1
201 . 1 . 1 44 44 GLU N N 15 123.417 0.023 . 1 . . . . . 45 E N . 53616 1
202 . 1 . 1 45 45 GLY H H 1 8.470 0.002 . 1 . . . . . 46 G H . 53616 1
203 . 1 . 1 45 45 GLY C C 13 174.140 0.032 . 1 . . . . . 46 G C . 53616 1
204 . 1 . 1 45 45 GLY CA C 13 45.372 0.009 . 1 . . . . . 46 G CA . 53616 1
205 . 1 . 1 45 45 GLY N N 15 109.950 0.025 . 1 . . . . . 46 G N . 53616 1
206 . 1 . 1 46 46 GLU H H 1 8.353 0.002 . 1 . . . . . 47 E H . 53616 1
207 . 1 . 1 46 46 GLU C C 13 176.363 0.032 . 1 . . . . . 47 E C . 53616 1
208 . 1 . 1 46 46 GLU CA C 13 56.817 0.030 . 1 . . . . . 47 E CA . 53616 1
209 . 1 . 1 46 46 GLU CB C 13 30.421 0.002 . 1 . . . . . 47 E CB . 53616 1
210 . 1 . 1 46 46 GLU N N 15 120.572 0.018 . 1 . . . . . 47 E N . 53616 1
211 . 1 . 1 47 47 ASN H H 1 8.638 0.002 . 1 . . . . . 48 N H . 53616 1
212 . 1 . 1 47 47 ASN C C 13 175.577 0.027 . 1 . . . . . 48 N C . 53616 1
213 . 1 . 1 47 47 ASN CA C 13 53.419 0.027 . 1 . . . . . 48 N CA . 53616 1
214 . 1 . 1 47 47 ASN CB C 13 38.856 0.007 . 1 . . . . . 48 N CB . 53616 1
215 . 1 . 1 47 47 ASN N N 15 119.817 0.014 . 1 . . . . . 48 N N . 53616 1
216 . 1 . 1 48 48 THR H H 1 8.137 0.001 . 1 . . . . . 49 T H . 53616 1
217 . 1 . 1 48 48 THR C C 13 174.856 0.040 . 1 . . . . . 49 T C . 53616 1
218 . 1 . 1 48 48 THR CA C 13 62.376 0.051 . 1 . . . . . 49 T CA . 53616 1
219 . 1 . 1 48 48 THR CB C 13 69.537 0.017 . 1 . . . . . 49 T CB . 53616 1
220 . 1 . 1 48 48 THR N N 15 114.014 0.025 . 1 . . . . . 49 T N . 53616 1
221 . 1 . 1 49 49 GLN H H 1 8.402 0.001 . 1 . . . . . 50 Q H . 53616 1
222 . 1 . 1 49 49 GLN C C 13 175.905 0.030 . 1 . . . . . 50 Q C . 53616 1
223 . 1 . 1 49 49 GLN CA C 13 56.447 0.029 . 1 . . . . . 50 Q CA . 53616 1
224 . 1 . 1 49 49 GLN CB C 13 29.261 0.003 . 1 . . . . . 50 Q CB . 53616 1
225 . 1 . 1 49 49 GLN N N 15 121.558 0.016 . 1 . . . . . 50 Q N . 53616 1
226 . 1 . 1 50 50 ASP H H 1 8.225 0.001 . 1 . . . . . 51 D H . 53616 1
227 . 1 . 1 50 50 ASP C C 13 176.759 0.061 . 1 . . . . . 51 D C . 53616 1
228 . 1 . 1 50 50 ASP CA C 13 54.558 0.054 . 1 . . . . . 51 D CA . 53616 1
229 . 1 . 1 50 50 ASP CB C 13 41.368 0.004 . 1 . . . . . 51 D CB . 53616 1
230 . 1 . 1 50 50 ASP N N 15 120.982 0.092 . 1 . . . . . 51 D N . 53616 1
231 . 1 . 1 51 51 LYS H H 1 8.345 0.001 . 1 . . . . . 52 K H . 53616 1
232 . 1 . 1 51 51 LYS C C 13 176.931 0.078 . 1 . . . . . 52 K C . 53616 1
233 . 1 . 1 51 51 LYS CA C 13 57.469 0.033 . 1 . . . . . 52 K CA . 53616 1
234 . 1 . 1 51 51 LYS CB C 13 32.417 0.050 . 1 . . . . . 52 K CB . 53616 1
235 . 1 . 1 51 51 LYS N N 15 122.019 0.010 . 1 . . . . . 52 K N . 53616 1
236 . 1 . 1 52 52 ASN H H 1 8.432 0.001 . 1 . . . . . 53 N H . 53616 1
237 . 1 . 1 52 52 ASN C C 13 175.333 0.036 . 1 . . . . . 53 N C . 53616 1
238 . 1 . 1 52 52 ASN CA C 13 53.662 0.024 . 1 . . . . . 53 N CA . 53616 1
239 . 1 . 1 52 52 ASN CB C 13 38.811 0.014 . 1 . . . . . 53 N CB . 53616 1
240 . 1 . 1 52 52 ASN N N 15 117.646 0.018 . 1 . . . . . 53 N N . 53616 1
241 . 1 . 1 53 53 LYS H H 1 7.968 0.001 . 1 . . . . . 54 K H . 53616 1
242 . 1 . 1 53 53 LYS C C 13 176.265 0.000 . 1 . . . . . 54 K C . 53616 1
243 . 1 . 1 53 53 LYS CA C 13 56.842 0.000 . 1 . . . . . 54 K CA . 53616 1
244 . 1 . 1 53 53 LYS CB C 13 32.846 0.000 . 1 . . . . . 54 K CB . 53616 1
245 . 1 . 1 53 53 LYS N N 15 120.756 0.022 . 1 . . . . . 54 K N . 53616 1
246 . 1 . 1 55 55 LEU CA C 13 54.125 0.000 . 1 . . . . . 56 L CA . 53616 1
247 . 1 . 1 55 55 LEU CB C 13 40.695 0.024 . 1 . . . . . 56 L CB . 53616 1
248 . 1 . 1 56 56 ARG H H 1 8.009 0.002 . 1 . . . . . 57 R H . 53616 1
249 . 1 . 1 56 56 ARG CA C 13 54.857 0.000 . 1 . . . . . 57 R CA . 53616 1
250 . 1 . 1 56 56 ARG CB C 13 27.269 0.000 . 1 . . . . . 57 R CB . 53616 1
251 . 1 . 1 56 56 ARG N N 15 123.131 0.018 . 1 . . . . . 57 R N . 53616 1
252 . 1 . 1 57 57 PRO C C 13 176.280 0.047 . 1 . . . . . 58 P C . 53616 1
253 . 1 . 1 57 57 PRO CA C 13 62.402 0.029 . 1 . . . . . 58 P CA . 53616 1
254 . 1 . 1 57 57 PRO CB C 13 34.775 0.037 . 1 . . . . . 58 P CB . 53616 1
255 . 1 . 1 58 58 LEU H H 1 8.649 0.003 . 1 . . . . . 59 L H . 53616 1
256 . 1 . 1 58 58 LEU C C 13 177.702 0.000 . 1 . . . . . 59 L C . 53616 1
257 . 1 . 1 58 58 LEU CA C 13 55.541 0.000 . 1 . . . . . 59 L CA . 53616 1
258 . 1 . 1 58 58 LEU CB C 13 42.665 0.000 . 1 . . . . . 59 L CB . 53616 1
259 . 1 . 1 58 58 LEU N N 15 122.991 0.037 . 1 . . . . . 59 L N . 53616 1
260 . 1 . 1 59 59 TYR C C 13 177.481 0.000 . 1 . . . . . 60 Y C . 53616 1
261 . 1 . 1 59 59 TYR CA C 13 57.776 0.020 . 1 . . . . . 60 Y CA . 53616 1
262 . 1 . 1 59 59 TYR CB C 13 38.978 0.009 . 1 . . . . . 60 Y CB . 53616 1
263 . 1 . 1 60 60 ASP H H 1 8.213 0.008 . 1 . . . . . 61 D H . 53616 1
264 . 1 . 1 60 60 ASP C C 13 175.637 0.000 . 1 . . . . . 61 D C . 53616 1
265 . 1 . 1 60 60 ASP CA C 13 54.614 0.062 . 1 . . . . . 61 D CA . 53616 1
266 . 1 . 1 60 60 ASP CB C 13 41.657 0.035 . 1 . . . . . 61 D CB . 53616 1
267 . 1 . 1 60 60 ASP N N 15 119.898 0.036 . 1 . . . . . 61 D N . 53616 1
268 . 1 . 1 61 61 ILE H H 1 7.802 0.003 . 1 . . . . . 62 I H . 53616 1
269 . 1 . 1 61 61 ILE N N 15 121.406 0.080 . 1 . . . . . 62 I N . 53616 1
270 . 1 . 1 70 70 PHE CA C 13 56.401 0.000 . 1 . . . . . 71 F CA . 53616 1
271 . 1 . 1 71 71 LEU H H 1 7.658 0.002 . 1 . . . . . 72 L H . 53616 1
272 . 1 . 1 71 71 LEU C C 13 174.027 0.000 . 1 . . . . . 72 L C . 53616 1
273 . 1 . 1 71 71 LEU CA C 13 57.821 0.095 . 1 . . . . . 72 L CA . 53616 1
274 . 1 . 1 71 71 LEU CB C 13 43.454 0.036 . 1 . . . . . 72 L CB . 53616 1
275 . 1 . 1 71 71 LEU N N 15 116.401 0.060 . 1 . . . . . 72 L N . 53616 1
276 . 1 . 1 72 72 ARG H H 1 8.679 0.005 . 1 . . . . . 73 R H . 53616 1
277 . 1 . 1 72 72 ARG C C 13 178.915 0.048 . 1 . . . . . 73 R C . 53616 1
278 . 1 . 1 72 72 ARG CA C 13 60.319 0.038 . 1 . . . . . 73 R CA . 53616 1
279 . 1 . 1 72 72 ARG CB C 13 30.438 0.000 . 1 . . . . . 73 R CB . 53616 1
280 . 1 . 1 72 72 ARG N N 15 119.453 0.093 . 1 . . . . . 73 R N . 53616 1
281 . 1 . 1 73 73 LYS H H 1 8.265 0.003 . 1 . . . . . 74 K H . 53616 1
282 . 1 . 1 73 73 LYS C C 13 179.184 0.038 . 1 . . . . . 74 K C . 53616 1
283 . 1 . 1 73 73 LYS CA C 13 59.241 0.053 . 1 . . . . . 74 K CA . 53616 1
284 . 1 . 1 73 73 LYS CB C 13 32.315 0.049 . 1 . . . . . 74 K CB . 53616 1
285 . 1 . 1 73 73 LYS N N 15 117.832 0.023 . 1 . . . . . 74 K N . 53616 1
286 . 1 . 1 74 74 LYS H H 1 7.599 0.001 . 1 . . . . . 75 K H . 53616 1
287 . 1 . 1 74 74 LYS C C 13 177.477 0.022 . 1 . . . . . 75 K C . 53616 1
288 . 1 . 1 74 74 LYS CA C 13 56.455 0.020 . 1 . . . . . 75 K CA . 53616 1
289 . 1 . 1 74 74 LYS CB C 13 33.149 0.014 . 1 . . . . . 75 K CB . 53616 1
290 . 1 . 1 74 74 LYS N N 15 114.578 0.029 . 1 . . . . . 75 K N . 53616 1
291 . 1 . 1 75 75 LEU H H 1 7.907 0.003 . 1 . . . . . 76 L H . 53616 1
292 . 1 . 1 75 75 LEU C C 13 177.727 0.046 . 1 . . . . . 76 L C . 53616 1
293 . 1 . 1 75 75 LEU CA C 13 55.845 0.041 . 1 . . . . . 76 L CA . 53616 1
294 . 1 . 1 75 75 LEU CB C 13 45.547 0.047 . 1 . . . . . 76 L CB . 53616 1
295 . 1 . 1 75 75 LEU N N 15 110.294 0.033 . 1 . . . . . 76 L N . 53616 1
296 . 1 . 1 76 76 ILE H H 1 7.609 0.002 . 1 . . . . . 77 I H . 53616 1
297 . 1 . 1 76 76 ILE C C 13 178.151 0.046 . 1 . . . . . 77 I C . 53616 1
298 . 1 . 1 76 76 ILE CA C 13 63.977 0.031 . 1 . . . . . 77 I CA . 53616 1
299 . 1 . 1 76 76 ILE CB C 13 35.010 0.053 . 1 . . . . . 77 I CB . 53616 1
300 . 1 . 1 76 76 ILE N N 15 116.585 0.037 . 1 . . . . . 77 I N . 53616 1
301 . 1 . 1 77 77 GLY H H 1 8.863 0.008 . 1 . . . . . 78 G H . 53616 1
302 . 1 . 1 77 77 GLY C C 13 173.950 0.000 . 1 . . . . . 78 G C . 53616 1
303 . 1 . 1 77 77 GLY CA C 13 45.353 0.010 . 1 . . . . . 78 G CA . 53616 1
304 . 1 . 1 77 77 GLY N N 15 113.920 0.038 . 1 . . . . . 78 G N . 53616 1
305 . 1 . 1 78 78 LYS H H 1 8.307 0.008 . 1 . . . . . 79 K H . 53616 1
306 . 1 . 1 78 78 LYS C C 13 175.950 0.000 . 1 . . . . . 79 K C . 53616 1
307 . 1 . 1 78 78 LYS CA C 13 54.401 0.010 . 1 . . . . . 79 K CA . 53616 1
308 . 1 . 1 78 78 LYS CB C 13 34.016 0.026 . 1 . . . . . 79 K CB . 53616 1
309 . 1 . 1 78 78 LYS N N 15 119.992 0.057 . 1 . . . . . 79 K N . 53616 1
310 . 1 . 1 79 79 LYS H H 1 8.240 0.005 . 1 . . . . . 80 K H . 53616 1
311 . 1 . 1 79 79 LYS C C 13 176.422 0.084 . 1 . . . . . 80 K C . 53616 1
312 . 1 . 1 79 79 LYS CA C 13 55.905 0.041 . 1 . . . . . 80 K CA . 53616 1
313 . 1 . 1 79 79 LYS CB C 13 32.864 0.064 . 1 . . . . . 80 K CB . 53616 1
314 . 1 . 1 79 79 LYS N N 15 119.874 0.030 . 1 . . . . . 80 K N . 53616 1
315 . 1 . 1 80 80 VAL H H 1 9.037 0.003 . 1 . . . . . 81 V H . 53616 1
316 . 1 . 1 80 80 VAL C C 13 173.787 0.054 . 1 . . . . . 81 V C . 53616 1
317 . 1 . 1 80 80 VAL CA C 13 58.314 0.024 . 1 . . . . . 81 V CA . 53616 1
318 . 1 . 1 80 80 VAL CB C 13 34.707 0.009 . 1 . . . . . 81 V CB . 53616 1
319 . 1 . 1 80 80 VAL N N 15 115.449 0.036 . 1 . . . . . 81 V N . 53616 1
320 . 1 . 1 81 81 ASN H H 1 8.540 0.007 . 1 . . . . . 82 N H . 53616 1
321 . 1 . 1 81 81 ASN C C 13 174.113 0.031 . 1 . . . . . 82 N C . 53616 1
322 . 1 . 1 81 81 ASN CA C 13 53.005 0.048 . 1 . . . . . 82 N CA . 53616 1
323 . 1 . 1 81 81 ASN CB C 13 39.815 0.012 . 1 . . . . . 82 N CB . 53616 1
324 . 1 . 1 81 81 ASN N N 15 118.652 0.074 . 1 . . . . . 82 N N . 53616 1
325 . 1 . 1 82 82 VAL H H 1 9.061 0.002 . 1 . . . . . 83 V H . 53616 1
326 . 1 . 1 82 82 VAL C C 13 174.218 0.014 . 1 . . . . . 83 V C . 53616 1
327 . 1 . 1 82 82 VAL CA C 13 61.679 0.052 . 1 . . . . . 83 V CA . 53616 1
328 . 1 . 1 82 82 VAL CB C 13 32.106 0.023 . 1 . . . . . 83 V CB . 53616 1
329 . 1 . 1 82 82 VAL N N 15 126.175 0.037 . 1 . . . . . 83 V N . 53616 1
330 . 1 . 1 83 83 THR H H 1 8.667 0.005 . 1 . . . . . 84 T H . 53616 1
331 . 1 . 1 83 83 THR C C 13 174.024 0.016 . 1 . . . . . 84 T C . 53616 1
332 . 1 . 1 83 83 THR CA C 13 61.057 0.059 . 1 . . . . . 84 T CA . 53616 1
333 . 1 . 1 83 83 THR CB C 13 70.651 0.068 . 1 . . . . . 84 T CB . 53616 1
334 . 1 . 1 83 83 THR N N 15 122.468 0.052 . 1 . . . . . 84 T N . 53616 1
335 . 1 . 1 84 84 VAL H H 1 9.287 0.002 . 1 . . . . . 85 V H . 53616 1
336 . 1 . 1 84 84 VAL C C 13 174.531 0.006 . 1 . . . . . 85 V C . 53616 1
337 . 1 . 1 84 84 VAL CA C 13 65.555 0.049 . 1 . . . . . 85 V CA . 53616 1
338 . 1 . 1 84 84 VAL CB C 13 31.954 0.000 . 1 . . . . . 85 V CB . 53616 1
339 . 1 . 1 84 84 VAL N N 15 127.736 0.042 . 1 . . . . . 85 V N . 53616 1
340 . 1 . 1 85 85 ASP H H 1 9.214 0.004 . 1 . . . . . 86 D H . 53616 1
341 . 1 . 1 85 85 ASP C C 13 175.773 0.027 . 1 . . . . . 86 D C . 53616 1
342 . 1 . 1 85 85 ASP CA C 13 56.412 0.032 . 1 . . . . . 86 D CA . 53616 1
343 . 1 . 1 85 85 ASP CB C 13 43.555 0.102 . 1 . . . . . 86 D CB . 53616 1
344 . 1 . 1 85 85 ASP N N 15 130.013 0.082 . 1 . . . . . 86 D N . 53616 1
345 . 1 . 1 86 86 TYR H H 1 7.811 0.003 . 1 . . . . . 87 Y H . 53616 1
346 . 1 . 1 86 86 TYR C C 13 171.870 0.004 . 1 . . . . . 87 Y C . 53616 1
347 . 1 . 1 86 86 TYR CA C 13 57.446 0.055 . 1 . . . . . 87 Y CA . 53616 1
348 . 1 . 1 86 86 TYR CB C 13 38.532 0.053 . 1 . . . . . 87 Y CB . 53616 1
349 . 1 . 1 86 86 TYR N N 15 113.208 0.026 . 1 . . . . . 87 Y N . 53616 1
350 . 1 . 1 87 87 ILE H H 1 8.671 0.006 . 1 . . . . . 88 I H . 53616 1
351 . 1 . 1 87 87 ILE C C 13 176.765 0.040 . 1 . . . . . 88 I C . 53616 1
352 . 1 . 1 87 87 ILE CA C 13 58.964 0.055 . 1 . . . . . 88 I CA . 53616 1
353 . 1 . 1 87 87 ILE CB C 13 39.691 0.061 . 1 . . . . . 88 I CB . 53616 1
354 . 1 . 1 87 87 ILE N N 15 119.990 0.072 . 1 . . . . . 88 I N . 53616 1
355 . 1 . 1 88 88 ARG H H 1 9.339 0.006 . 1 . . . . . 89 R H . 53616 1
356 . 1 . 1 88 88 ARG C C 13 173.515 0.000 . 1 . . . . . 89 R C . 53616 1
357 . 1 . 1 88 88 ARG CA C 13 52.837 0.000 . 1 . . . . . 89 R CA . 53616 1
358 . 1 . 1 88 88 ARG CB C 13 31.841 0.000 . 1 . . . . . 89 R CB . 53616 1
359 . 1 . 1 88 88 ARG N N 15 131.132 0.042 . 1 . . . . . 89 R N . 53616 1
360 . 1 . 1 89 89 PRO C C 13 176.428 0.002 . 1 . . . . . 90 P C . 53616 1
361 . 1 . 1 89 89 PRO CA C 13 62.618 0.010 . 1 . . . . . 90 P CA . 53616 1
362 . 1 . 1 89 89 PRO CB C 13 32.650 0.032 . 1 . . . . . 90 P CB . 53616 1
363 . 1 . 1 90 90 ALA H H 1 8.730 0.003 . 1 . . . . . 91 A H . 53616 1
364 . 1 . 1 90 90 ALA C C 13 177.510 0.053 . 1 . . . . . 91 A C . 53616 1
365 . 1 . 1 90 90 ALA CA C 13 52.628 0.056 . 1 . . . . . 91 A CA . 53616 1
366 . 1 . 1 90 90 ALA CB C 13 19.573 0.055 . 1 . . . . . 91 A CB . 53616 1
367 . 1 . 1 90 90 ALA N N 15 123.248 0.016 . 1 . . . . . 91 A N . 53616 1
368 . 1 . 1 91 91 SER H H 1 8.914 0.002 . 1 . . . . . 92 S H . 53616 1
369 . 1 . 1 91 91 SER C C 13 172.322 0.000 . 1 . . . . . 92 S C . 53616 1
370 . 1 . 1 91 91 SER CA C 13 55.084 0.000 . 1 . . . . . 92 S CA . 53616 1
371 . 1 . 1 91 91 SER CB C 13 64.880 0.000 . 1 . . . . . 92 S CB . 53616 1
372 . 1 . 1 91 91 SER N N 15 115.510 0.021 . 1 . . . . . 92 S N . 53616 1
373 . 1 . 1 92 92 PRO C C 13 176.968 0.000 . 1 . . . . . 93 P C . 53616 1
374 . 1 . 1 92 92 PRO CA C 13 61.943 0.001 . 1 . . . . . 93 P CA . 53616 1
375 . 1 . 1 92 92 PRO CB C 13 32.566 0.035 . 1 . . . . . 93 P CB . 53616 1
376 . 1 . 1 93 93 ALA H H 1 8.743 0.003 . 1 . . . . . 94 A H . 53616 1
377 . 1 . 1 93 93 ALA C C 13 178.586 0.032 . 1 . . . . . 94 A C . 53616 1
378 . 1 . 1 93 93 ALA CA C 13 52.754 0.011 . 1 . . . . . 94 A CA . 53616 1
379 . 1 . 1 93 93 ALA CB C 13 19.745 0.012 . 1 . . . . . 94 A CB . 53616 1
380 . 1 . 1 93 93 ALA N N 15 123.629 0.034 . 1 . . . . . 94 A N . 53616 1
381 . 1 . 1 94 94 THR H H 1 8.996 0.003 . 1 . . . . . 95 T H . 53616 1
382 . 1 . 1 94 94 THR C C 13 174.570 0.020 . 1 . . . . . 95 T C . 53616 1
383 . 1 . 1 94 94 THR CA C 13 59.620 0.079 . 1 . . . . . 95 T CA . 53616 1
384 . 1 . 1 94 94 THR CB C 13 71.076 0.020 . 1 . . . . . 95 T CB . 53616 1
385 . 1 . 1 94 94 THR N N 15 113.716 0.020 . 1 . . . . . 95 T N . 53616 1
386 . 1 . 1 95 95 GLU H H 1 8.843 0.001 . 1 . . . . . 96 E H . 53616 1
387 . 1 . 1 95 95 GLU C C 13 177.723 0.023 . 1 . . . . . 96 E C . 53616 1
388 . 1 . 1 95 95 GLU CA C 13 59.426 0.061 . 1 . . . . . 96 E CA . 53616 1
389 . 1 . 1 95 95 GLU CB C 13 29.596 0.016 . 1 . . . . . 96 E CB . 53616 1
390 . 1 . 1 95 95 GLU N N 15 118.268 0.022 . 1 . . . . . 96 E N . 53616 1
391 . 1 . 1 96 96 THR H H 1 7.990 0.003 . 1 . . . . . 97 T H . 53616 1
392 . 1 . 1 96 96 THR C C 13 174.288 0.044 . 1 . . . . . 97 T C . 53616 1
393 . 1 . 1 96 96 THR CA C 13 61.717 0.026 . 1 . . . . . 97 T CA . 53616 1
394 . 1 . 1 96 96 THR CB C 13 70.481 0.032 . 1 . . . . . 97 T CB . 53616 1
395 . 1 . 1 96 96 THR N N 15 105.711 0.022 . 1 . . . . . 97 T N . 53616 1
396 . 1 . 1 97 97 VAL H H 1 7.569 0.002 . 1 . . . . . 98 V H . 53616 1
397 . 1 . 1 97 97 VAL C C 13 172.986 0.000 . 1 . . . . . 98 V C . 53616 1
398 . 1 . 1 97 97 VAL CA C 13 59.239 0.000 . 1 . . . . . 98 V CA . 53616 1
399 . 1 . 1 97 97 VAL CB C 13 34.465 0.000 . 1 . . . . . 98 V CB . 53616 1
400 . 1 . 1 97 97 VAL N N 15 123.433 0.029 . 1 . . . . . 98 V N . 53616 1
401 . 1 . 1 98 98 PRO C C 13 175.147 0.046 . 1 . . . . . 99 P C . 53616 1
402 . 1 . 1 98 98 PRO CA C 13 61.958 0.005 . 1 . . . . . 99 P CA . 53616 1
403 . 1 . 1 98 98 PRO CB C 13 32.410 0.022 . 1 . . . . . 99 P CB . 53616 1
404 . 1 . 1 99 99 ALA H H 1 8.219 0.003 . 1 . . . . . 100 A H . 53616 1
405 . 1 . 1 99 99 ALA C C 13 177.519 0.014 . 1 . . . . . 100 A C . 53616 1
406 . 1 . 1 99 99 ALA CA C 13 52.586 0.056 . 1 . . . . . 100 A CA . 53616 1
407 . 1 . 1 99 99 ALA CB C 13 19.428 0.017 . 1 . . . . . 100 A CB . 53616 1
408 . 1 . 1 99 99 ALA N N 15 119.851 0.020 . 1 . . . . . 100 A N . 53616 1
409 . 1 . 1 100 100 PHE H H 1 8.412 0.002 . 1 . . . . . 101 F H . 53616 1
410 . 1 . 1 100 100 PHE C C 13 176.398 0.037 . 1 . . . . . 101 F C . 53616 1
411 . 1 . 1 100 100 PHE CA C 13 56.601 0.049 . 1 . . . . . 101 F CA . 53616 1
412 . 1 . 1 100 100 PHE CB C 13 41.817 0.009 . 1 . . . . . 101 F CB . 53616 1
413 . 1 . 1 100 100 PHE N N 15 119.223 0.014 . 1 . . . . . 101 F N . 53616 1
414 . 1 . 1 101 101 SER H H 1 8.473 0.001 . 1 . . . . . 102 S H . 53616 1
415 . 1 . 1 101 101 SER C C 13 173.751 0.056 . 1 . . . . . 102 S C . 53616 1
416 . 1 . 1 101 101 SER CA C 13 57.865 0.027 . 1 . . . . . 102 S CA . 53616 1
417 . 1 . 1 101 101 SER CB C 13 64.326 0.008 . 1 . . . . . 102 S CB . 53616 1
418 . 1 . 1 101 101 SER N N 15 118.033 0.036 . 1 . . . . . 102 S N . 53616 1
419 . 1 . 1 102 102 GLU H H 1 8.829 0.002 . 1 . . . . . 103 E H . 53616 1
420 . 1 . 1 102 102 GLU C C 13 176.399 0.056 . 1 . . . . . 103 E C . 53616 1
421 . 1 . 1 102 102 GLU CA C 13 57.487 0.042 . 1 . . . . . 103 E CA . 53616 1
422 . 1 . 1 102 102 GLU CB C 13 30.742 0.025 . 1 . . . . . 103 E CB . 53616 1
423 . 1 . 1 102 102 GLU N N 15 122.821 0.021 . 1 . . . . . 103 E N . 53616 1
424 . 1 . 1 103 103 ARG H H 1 8.794 0.002 . 1 . . . . . 104 R H . 53616 1
425 . 1 . 1 103 103 ARG C C 13 174.755 0.014 . 1 . . . . . 104 R C . 53616 1
426 . 1 . 1 103 103 ARG CA C 13 55.125 0.019 . 1 . . . . . 104 R CA . 53616 1
427 . 1 . 1 103 103 ARG CB C 13 34.209 0.028 . 1 . . . . . 104 R CB . 53616 1
428 . 1 . 1 103 103 ARG N N 15 125.226 0.033 . 1 . . . . . 104 R N . 53616 1
429 . 1 . 1 104 104 THR H H 1 9.708 0.006 . 1 . . . . . 105 T H . 53616 1
430 . 1 . 1 104 104 THR C C 13 173.115 0.054 . 1 . . . . . 105 T C . 53616 1
431 . 1 . 1 104 104 THR CA C 13 63.729 0.055 . 1 . . . . . 105 T CA . 53616 1
432 . 1 . 1 104 104 THR CB C 13 68.952 0.019 . 1 . . . . . 105 T CB . 53616 1
433 . 1 . 1 104 104 THR N N 15 124.336 0.052 . 1 . . . . . 105 T N . 53616 1
434 . 1 . 1 105 105 CYS H H 1 8.554 0.002 . 1 . . . . . 106 C H . 53616 1
435 . 1 . 1 105 105 CYS C C 13 174.731 0.033 . 1 . . . . . 106 C C . 53616 1
436 . 1 . 1 105 105 CYS CA C 13 57.586 0.064 . 1 . . . . . 106 C CA . 53616 1
437 . 1 . 1 105 105 CYS CB C 13 27.886 0.027 . 1 . . . . . 106 C CB . 53616 1
438 . 1 . 1 105 105 CYS N N 15 125.962 0.027 . 1 . . . . . 106 C N . 53616 1
439 . 1 . 1 106 106 ALA H H 1 9.683 0.004 . 1 . . . . . 107 A H . 53616 1
440 . 1 . 1 106 106 ALA C C 13 176.864 0.083 . 1 . . . . . 107 A C . 53616 1
441 . 1 . 1 106 106 ALA CA C 13 51.363 0.040 . 1 . . . . . 107 A CA . 53616 1
442 . 1 . 1 106 106 ALA CB C 13 26.737 0.046 . 1 . . . . . 107 A CB . 53616 1
443 . 1 . 1 106 106 ALA N N 15 127.580 0.045 . 1 . . . . . 107 A N . 53616 1
444 . 1 . 1 107 107 THR H H 1 9.077 0.002 . 1 . . . . . 108 T H . 53616 1
445 . 1 . 1 107 107 THR C C 13 173.100 0.000 . 1 . . . . . 108 T C . 53616 1
446 . 1 . 1 107 107 THR CA C 13 63.801 0.069 . 1 . . . . . 108 T CA . 53616 1
447 . 1 . 1 107 107 THR CB C 13 70.343 0.038 . 1 . . . . . 108 T CB . 53616 1
448 . 1 . 1 107 107 THR N N 15 119.387 0.056 . 1 . . . . . 108 T N . 53616 1
449 . 1 . 1 108 108 VAL H H 1 9.609 0.005 . 1 . . . . . 109 V H . 53616 1
450 . 1 . 1 108 108 VAL C C 13 174.440 0.088 . 1 . . . . . 109 V C . 53616 1
451 . 1 . 1 108 108 VAL CA C 13 61.112 0.032 . 1 . . . . . 109 V CA . 53616 1
452 . 1 . 1 108 108 VAL CB C 13 33.510 0.009 . 1 . . . . . 109 V CB . 53616 1
453 . 1 . 1 108 108 VAL N N 15 132.259 0.067 . 1 . . . . . 109 V N . 53616 1
454 . 1 . 1 109 109 THR H H 1 8.996 0.002 . 1 . . . . . 110 T H . 53616 1
455 . 1 . 1 109 109 THR C C 13 173.434 0.027 . 1 . . . . . 110 T C . 53616 1
456 . 1 . 1 109 109 THR CA C 13 58.500 0.071 . 1 . . . . . 110 T CA . 53616 1
457 . 1 . 1 109 109 THR CB C 13 71.522 0.013 . 1 . . . . . 110 T CB . 53616 1
458 . 1 . 1 109 109 THR N N 15 118.314 0.026 . 1 . . . . . 110 T N . 53616 1
459 . 1 . 1 110 110 ILE H H 1 8.798 0.003 . 1 . . . . . 111 I H . 53616 1
460 . 1 . 1 110 110 ILE C C 13 176.437 0.038 . 1 . . . . . 111 I C . 53616 1
461 . 1 . 1 110 110 ILE CA C 13 57.910 0.042 . 1 . . . . . 111 I CA . 53616 1
462 . 1 . 1 110 110 ILE CB C 13 40.477 0.000 . 1 . . . . . 111 I CB . 53616 1
463 . 1 . 1 110 110 ILE N N 15 119.516 0.036 . 1 . . . . . 111 I N . 53616 1
464 . 1 . 1 111 111 GLY H H 1 9.322 0.005 . 1 . . . . . 112 G H . 53616 1
465 . 1 . 1 111 111 GLY C C 13 175.140 0.050 . 1 . . . . . 112 G C . 53616 1
466 . 1 . 1 111 111 GLY CA C 13 47.343 0.010 . 1 . . . . . 112 G CA . 53616 1
467 . 1 . 1 111 111 GLY N N 15 120.858 0.061 . 1 . . . . . 112 G N . 53616 1
468 . 1 . 1 112 112 GLY H H 1 8.582 0.002 . 1 . . . . . 113 G H . 53616 1
469 . 1 . 1 112 112 GLY C C 13 173.714 0.010 . 1 . . . . . 113 G C . 53616 1
470 . 1 . 1 112 112 GLY CA C 13 44.847 0.038 . 1 . . . . . 113 G CA . 53616 1
471 . 1 . 1 112 112 GLY N N 15 105.194 0.027 . 1 . . . . . 113 G N . 53616 1
472 . 1 . 1 113 113 ILE H H 1 7.851 0.002 . 1 . . . . . 114 I H . 53616 1
473 . 1 . 1 113 113 ILE C C 13 175.159 0.024 . 1 . . . . . 114 I C . 53616 1
474 . 1 . 1 113 113 ILE CA C 13 59.442 0.074 . 1 . . . . . 114 I CA . 53616 1
475 . 1 . 1 113 113 ILE CB C 13 38.992 0.045 . 1 . . . . . 114 I CB . 53616 1
476 . 1 . 1 113 113 ILE N N 15 121.176 0.032 . 1 . . . . . 114 I N . 53616 1
477 . 1 . 1 114 114 ASN H H 1 8.924 0.003 . 1 . . . . . 115 N H . 53616 1
478 . 1 . 1 114 114 ASN C C 13 177.113 0.050 . 1 . . . . . 115 N C . 53616 1
479 . 1 . 1 114 114 ASN CA C 13 52.088 0.052 . 1 . . . . . 115 N CA . 53616 1
480 . 1 . 1 114 114 ASN CB C 13 37.351 0.017 . 1 . . . . . 115 N CB . 53616 1
481 . 1 . 1 114 114 ASN N N 15 124.876 0.019 . 1 . . . . . 115 N N . 53616 1
482 . 1 . 1 115 115 ILE H H 1 8.857 0.006 . 1 . . . . . 116 I H . 53616 1
483 . 1 . 1 115 115 ILE C C 13 175.669 0.000 . 1 . . . . . 116 I C . 53616 1
484 . 1 . 1 115 115 ILE CA C 13 61.093 0.070 . 1 . . . . . 116 I CA . 53616 1
485 . 1 . 1 115 115 ILE CB C 13 38.807 0.107 . 1 . . . . . 116 I CB . 53616 1
486 . 1 . 1 115 115 ILE N N 15 129.162 0.052 . 1 . . . . . 116 I N . 53616 1
487 . 1 . 1 116 116 ALA H H 1 7.744 0.001 . 1 . . . . . 117 A H . 53616 1
488 . 1 . 1 116 116 ALA C C 13 178.259 0.059 . 1 . . . . . 117 A C . 53616 1
489 . 1 . 1 116 116 ALA CA C 13 55.021 0.020 . 1 . . . . . 117 A CA . 53616 1
490 . 1 . 1 116 116 ALA CB C 13 19.913 0.021 . 1 . . . . . 117 A CB . 53616 1
491 . 1 . 1 116 116 ALA N N 15 121.824 0.063 . 1 . . . . . 117 A N . 53616 1
492 . 1 . 1 117 117 GLU H H 1 6.819 0.002 . 1 . . . . . 118 E H . 53616 1
493 . 1 . 1 117 117 GLU C C 13 178.007 0.095 . 1 . . . . . 118 E C . 53616 1
494 . 1 . 1 117 117 GLU CA C 13 59.490 0.025 . 1 . . . . . 118 E CA . 53616 1
495 . 1 . 1 117 117 GLU CB C 13 29.636 0.000 . 1 . . . . . 118 E CB . 53616 1
496 . 1 . 1 117 117 GLU N N 15 119.160 0.032 . 1 . . . . . 118 E N . 53616 1
497 . 1 . 1 118 118 ALA H H 1 7.949 0.001 . 1 . . . . . 119 A H . 53616 1
498 . 1 . 1 118 118 ALA C C 13 179.885 0.070 . 1 . . . . . 119 A C . 53616 1
499 . 1 . 1 118 118 ALA CA C 13 55.249 0.052 . 1 . . . . . 119 A CA . 53616 1
500 . 1 . 1 118 118 ALA CB C 13 18.038 0.021 . 1 . . . . . 119 A CB . 53616 1
501 . 1 . 1 118 118 ALA N N 15 122.527 0.026 . 1 . . . . . 119 A N . 53616 1
502 . 1 . 1 119 119 LEU H H 1 8.044 0.004 . 1 . . . . . 120 L H . 53616 1
503 . 1 . 1 119 119 LEU C C 13 179.189 0.000 . 1 . . . . . 120 L C . 53616 1
504 . 1 . 1 119 119 LEU CA C 13 58.356 0.022 . 1 . . . . . 120 L CA . 53616 1
505 . 1 . 1 119 119 LEU CB C 13 44.302 0.016 . 1 . . . . . 120 L CB . 53616 1
506 . 1 . 1 119 119 LEU N N 15 118.006 0.038 . 1 . . . . . 120 L N . 53616 1
507 . 1 . 1 120 120 VAL H H 1 8.098 0.003 . 1 . . . . . 121 V H . 53616 1
508 . 1 . 1 120 120 VAL C C 13 180.885 0.047 . 1 . . . . . 121 V C . 53616 1
509 . 1 . 1 120 120 VAL CA C 13 65.963 0.026 . 1 . . . . . 121 V CA . 53616 1
510 . 1 . 1 120 120 VAL CB C 13 31.894 0.046 . 1 . . . . . 121 V CB . 53616 1
511 . 1 . 1 120 120 VAL N N 15 118.281 0.052 . 1 . . . . . 121 V N . 53616 1
512 . 1 . 1 121 121 SER H H 1 8.866 0.009 . 1 . . . . . 122 S H . 53616 1
513 . 1 . 1 121 121 SER C C 13 174.626 0.066 . 1 . . . . . 122 S C . 53616 1
514 . 1 . 1 121 121 SER CA C 13 62.023 0.056 . 1 . . . . . 122 S CA . 53616 1
515 . 1 . 1 121 121 SER CB C 13 63.026 0.050 . 1 . . . . . 122 S CB . 53616 1
516 . 1 . 1 121 121 SER N N 15 118.421 0.092 . 1 . . . . . 122 S N . 53616 1
517 . 1 . 1 122 122 LYS H H 1 6.999 0.002 . 1 . . . . . 123 K H . 53616 1
518 . 1 . 1 122 122 LYS C C 13 176.301 0.028 . 1 . . . . . 123 K C . 53616 1
519 . 1 . 1 122 122 LYS CA C 13 55.987 0.087 . 1 . . . . . 123 K CA . 53616 1
520 . 1 . 1 122 122 LYS CB C 13 33.155 0.034 . 1 . . . . . 123 K CB . 53616 1
521 . 1 . 1 122 122 LYS N N 15 117.993 0.041 . 1 . . . . . 123 K N . 53616 1
522 . 1 . 1 123 123 GLY H H 1 8.256 0.006 . 1 . . . . . 124 G H . 53616 1
523 . 1 . 1 123 123 GLY C C 13 173.497 0.000 . 1 . . . . . 124 G C . 53616 1
524 . 1 . 1 123 123 GLY CA C 13 46.060 0.010 . 1 . . . . . 124 G CA . 53616 1
525 . 1 . 1 123 123 GLY N N 15 107.569 0.062 . 1 . . . . . 124 G N . 53616 1
526 . 1 . 1 124 124 LEU H H 1 7.632 0.004 . 1 . . . . . 125 L H . 53616 1
527 . 1 . 1 124 124 LEU C C 13 172.530 0.000 . 1 . . . . . 125 L C . 53616 1
528 . 1 . 1 124 124 LEU CA C 13 53.517 0.015 . 1 . . . . . 125 L CA . 53616 1
529 . 1 . 1 124 124 LEU N N 15 115.385 0.024 . 1 . . . . . 125 L N . 53616 1
530 . 1 . 1 125 125 ALA H H 1 7.288 0.001 . 1 . . . . . 126 A H . 53616 1
531 . 1 . 1 125 125 ALA C C 13 175.604 0.040 . 1 . . . . . 126 A C . 53616 1
532 . 1 . 1 125 125 ALA CA C 13 51.208 0.053 . 1 . . . . . 126 A CA . 53616 1
533 . 1 . 1 125 125 ALA CB C 13 23.301 0.015 . 1 . . . . . 126 A CB . 53616 1
534 . 1 . 1 125 125 ALA N N 15 112.343 0.053 . 1 . . . . . 126 A N . 53616 1
535 . 1 . 1 126 126 THR H H 1 8.480 0.007 . 1 . . . . . 127 T H . 53616 1
536 . 1 . 1 126 126 THR C C 13 172.762 0.086 . 1 . . . . . 127 T C . 53616 1
537 . 1 . 1 126 126 THR CA C 13 60.240 0.024 . 1 . . . . . 127 T CA . 53616 1
538 . 1 . 1 126 126 THR CB C 13 71.574 0.047 . 1 . . . . . 127 T CB . 53616 1
539 . 1 . 1 126 126 THR N N 15 110.433 0.048 . 1 . . . . . 127 T N . 53616 1
540 . 1 . 1 127 127 VAL H H 1 8.800 0.006 . 1 . . . . . 128 V H . 53616 1
541 . 1 . 1 127 127 VAL C C 13 177.488 0.041 . 1 . . . . . 128 V C . 53616 1
542 . 1 . 1 127 127 VAL CA C 13 62.250 0.070 . 1 . . . . . 128 V CA . 53616 1
543 . 1 . 1 127 127 VAL CB C 13 32.939 0.000 . 1 . . . . . 128 V CB . 53616 1
544 . 1 . 1 127 127 VAL N N 15 121.054 0.027 . 1 . . . . . 128 V N . 53616 1
545 . 1 . 1 128 128 ILE H H 1 8.379 0.003 . 1 . . . . . 129 I H . 53616 1
546 . 1 . 1 128 128 ILE C C 13 174.983 0.069 . 1 . . . . . 129 I C . 53616 1
547 . 1 . 1 128 128 ILE CA C 13 62.923 0.020 . 1 . . . . . 129 I CA . 53616 1
548 . 1 . 1 128 128 ILE CB C 13 39.204 0.064 . 1 . . . . . 129 I CB . 53616 1
549 . 1 . 1 128 128 ILE N N 15 130.809 0.035 . 1 . . . . . 129 I N . 53616 1
550 . 1 . 1 129 129 ARG H H 1 8.432 0.003 . 1 . . . . . 130 R H . 53616 1
551 . 1 . 1 129 129 ARG C C 13 175.555 0.000 . 1 . . . . . 130 R C . 53616 1
552 . 1 . 1 129 129 ARG CA C 13 54.799 0.092 . 1 . . . . . 130 R CA . 53616 1
553 . 1 . 1 129 129 ARG CB C 13 30.755 0.086 . 1 . . . . . 130 R CB . 53616 1
554 . 1 . 1 129 129 ARG N N 15 127.098 0.034 . 1 . . . . . 130 R N . 53616 1
555 . 1 . 1 130 130 TYR H H 1 8.293 0.007 . 1 . . . . . 131 Y H . 53616 1
556 . 1 . 1 130 130 TYR C C 13 176.351 0.027 . 1 . . . . . 131 Y C . 53616 1
557 . 1 . 1 130 130 TYR CA C 13 57.680 0.013 . 1 . . . . . 131 Y CA . 53616 1
558 . 1 . 1 130 130 TYR CB C 13 41.583 0.025 . 1 . . . . . 131 Y CB . 53616 1
559 . 1 . 1 130 130 TYR N N 15 121.252 0.022 . 1 . . . . . 131 Y N . 53616 1
560 . 1 . 1 131 131 ARG H H 1 9.027 0.002 . 1 . . . . . 132 R H . 53616 1
561 . 1 . 1 131 131 ARG CA C 13 56.712 0.000 . 1 . . . . . 132 R CA . 53616 1
562 . 1 . 1 131 131 ARG CB C 13 31.477 0.000 . 1 . . . . . 132 R CB . 53616 1
563 . 1 . 1 131 131 ARG N N 15 122.702 0.043 . 1 . . . . . 132 R N . 53616 1
564 . 1 . 1 137 137 ARG C C 13 174.522 0.000 . 1 . . . . . 138 R C . 53616 1
565 . 1 . 1 138 138 SER H H 1 8.298 0.003 . 1 . . . . . 139 S H . 53616 1
566 . 1 . 1 138 138 SER C C 13 176.241 0.026 . 1 . . . . . 139 S C . 53616 1
567 . 1 . 1 138 138 SER CA C 13 57.562 0.060 . 1 . . . . . 139 S CA . 53616 1
568 . 1 . 1 138 138 SER CB C 13 64.492 0.074 . 1 . . . . . 139 S CB . 53616 1
569 . 1 . 1 138 138 SER N N 15 111.215 0.087 . 1 . . . . . 139 S N . 53616 1
570 . 1 . 1 139 139 SER H H 1 7.931 0.009 . 1 . . . . . 140 S H . 53616 1
571 . 1 . 1 139 139 SER C C 13 174.513 0.000 . 1 . . . . . 140 S C . 53616 1
572 . 1 . 1 139 139 SER CA C 13 60.437 0.015 . 1 . . . . . 140 S CA . 53616 1
573 . 1 . 1 139 139 SER CB C 13 62.593 0.035 . 1 . . . . . 140 S CB . 53616 1
574 . 1 . 1 139 139 SER N N 15 123.470 0.066 . 1 . . . . . 140 S N . 53616 1
575 . 1 . 1 140 140 HIS H H 1 8.963 0.004 . 1 . . . . . 141 H H . 53616 1
576 . 1 . 1 140 140 HIS C C 13 174.640 0.040 . 1 . . . . . 141 H C . 53616 1
577 . 1 . 1 140 140 HIS CA C 13 54.607 0.097 . 1 . . . . . 141 H CA . 53616 1
578 . 1 . 1 140 140 HIS CB C 13 28.279 0.066 . 1 . . . . . 141 H CB . 53616 1
579 . 1 . 1 140 140 HIS N N 15 121.428 0.044 . 1 . . . . . 141 H N . 53616 1
580 . 1 . 1 141 141 TYR H H 1 7.226 0.002 . 1 . . . . . 142 Y H . 53616 1
581 . 1 . 1 141 141 TYR C C 13 176.028 0.021 . 1 . . . . . 142 Y C . 53616 1
582 . 1 . 1 141 141 TYR CA C 13 63.842 0.046 . 1 . . . . . 142 Y CA . 53616 1
583 . 1 . 1 141 141 TYR CB C 13 39.055 0.026 . 1 . . . . . 142 Y CB . 53616 1
584 . 1 . 1 141 141 TYR N N 15 121.205 0.042 . 1 . . . . . 142 Y N . 53616 1
585 . 1 . 1 142 142 ASP H H 1 8.769 0.002 . 1 . . . . . 143 D H . 53616 1
586 . 1 . 1 142 142 ASP C C 13 179.806 0.013 . 1 . . . . . 143 D C . 53616 1
587 . 1 . 1 142 142 ASP CA C 13 58.250 0.041 . 1 . . . . . 143 D CA . 53616 1
588 . 1 . 1 142 142 ASP CB C 13 39.740 0.033 . 1 . . . . . 143 D CB . 53616 1
589 . 1 . 1 142 142 ASP N N 15 116.927 0.036 . 1 . . . . . 143 D N . 53616 1
590 . 1 . 1 143 143 GLU H H 1 8.136 0.003 . 1 . . . . . 144 E H . 53616 1
591 . 1 . 1 143 143 GLU C C 13 180.329 0.009 . 1 . . . . . 144 E C . 53616 1
592 . 1 . 1 143 143 GLU CA C 13 59.476 0.028 . 1 . . . . . 144 E CA . 53616 1
593 . 1 . 1 143 143 GLU CB C 13 29.419 0.051 . 1 . . . . . 144 E CB . 53616 1
594 . 1 . 1 143 143 GLU N N 15 121.154 0.022 . 1 . . . . . 144 E N . 53616 1
595 . 1 . 1 144 144 LEU H H 1 8.055 0.003 . 1 . . . . . 145 L H . 53616 1
596 . 1 . 1 144 144 LEU C C 13 178.581 0.000 . 1 . . . . . 145 L C . 53616 1
597 . 1 . 1 144 144 LEU CA C 13 58.300 0.000 . 1 . . . . . 145 L CA . 53616 1
598 . 1 . 1 144 144 LEU CB C 13 40.864 0.000 . 1 . . . . . 145 L CB . 53616 1
599 . 1 . 1 144 144 LEU N N 15 121.121 0.057 . 1 . . . . . 145 L N . 53616 1
600 . 1 . 1 145 145 LEU CA C 13 57.958 0.007 . 1 . . . . . 146 L CA . 53616 1
601 . 1 . 1 145 145 LEU CB C 13 41.900 0.000 . 1 . . . . . 146 L CB . 53616 1
602 . 1 . 1 146 146 ALA H H 1 7.896 0.001 . 1 . . . . . 147 A H . 53616 1
603 . 1 . 1 146 146 ALA C C 13 180.353 0.036 . 1 . . . . . 147 A C . 53616 1
604 . 1 . 1 146 146 ALA CA C 13 54.858 0.087 . 1 . . . . . 147 A CA . 53616 1
605 . 1 . 1 146 146 ALA CB C 13 17.831 0.025 . 1 . . . . . 147 A CB . 53616 1
606 . 1 . 1 146 146 ALA N N 15 122.049 0.019 . 1 . . . . . 147 A N . 53616 1
607 . 1 . 1 147 147 ALA H H 1 7.872 0.003 . 1 . . . . . 148 A H . 53616 1
608 . 1 . 1 147 147 ALA C C 13 179.048 0.025 . 1 . . . . . 148 A C . 53616 1
609 . 1 . 1 147 147 ALA CA C 13 54.820 0.073 . 1 . . . . . 148 A CA . 53616 1
610 . 1 . 1 147 147 ALA CB C 13 18.508 0.048 . 1 . . . . . 148 A CB . 53616 1
611 . 1 . 1 147 147 ALA N N 15 122.197 0.065 . 1 . . . . . 148 A N . 53616 1
612 . 1 . 1 148 148 GLU H H 1 8.202 0.001 . 1 . . . . . 149 E H . 53616 1
613 . 1 . 1 148 148 GLU C C 13 177.374 0.077 . 1 . . . . . 149 E C . 53616 1
614 . 1 . 1 148 148 GLU CA C 13 59.618 0.023 . 1 . . . . . 149 E CA . 53616 1
615 . 1 . 1 148 148 GLU CB C 13 30.462 0.044 . 1 . . . . . 149 E CB . 53616 1
616 . 1 . 1 148 148 GLU N N 15 122.327 0.025 . 1 . . . . . 149 E N . 53616 1
617 . 1 . 1 149 149 ALA H H 1 7.918 0.003 . 1 . . . . . 150 A H . 53616 1
618 . 1 . 1 149 149 ALA C C 13 181.204 0.020 . 1 . . . . . 150 A C . 53616 1
619 . 1 . 1 149 149 ALA CA C 13 55.313 0.061 . 1 . . . . . 150 A CA . 53616 1
620 . 1 . 1 149 149 ALA CB C 13 17.573 0.045 . 1 . . . . . 150 A CB . 53616 1
621 . 1 . 1 149 149 ALA N N 15 120.127 0.050 . 1 . . . . . 150 A N . 53616 1
622 . 1 . 1 150 150 ARG H H 1 7.671 0.003 . 1 . . . . . 151 R H . 53616 1
623 . 1 . 1 150 150 ARG C C 13 177.892 0.047 . 1 . . . . . 151 R C . 53616 1
624 . 1 . 1 150 150 ARG CA C 13 59.827 0.008 . 1 . . . . . 151 R CA . 53616 1
625 . 1 . 1 150 150 ARG CB C 13 30.370 0.023 . 1 . . . . . 151 R CB . 53616 1
626 . 1 . 1 150 150 ARG N N 15 118.753 0.037 . 1 . . . . . 151 R N . 53616 1
627 . 1 . 1 151 151 ALA H H 1 8.110 0.003 . 1 . . . . . 152 A H . 53616 1
628 . 1 . 1 151 151 ALA C C 13 179.831 0.028 . 1 . . . . . 152 A C . 53616 1
629 . 1 . 1 151 151 ALA CA C 13 55.756 0.026 . 1 . . . . . 152 A CA . 53616 1
630 . 1 . 1 151 151 ALA CB C 13 19.064 0.061 . 1 . . . . . 152 A CB . 53616 1
631 . 1 . 1 151 151 ALA N N 15 124.256 0.020 . 1 . . . . . 152 A N . 53616 1
632 . 1 . 1 152 152 ILE H H 1 8.199 0.003 . 1 . . . . . 153 I H . 53616 1
633 . 1 . 1 152 152 ILE C C 13 179.767 0.022 . 1 . . . . . 153 I C . 53616 1
634 . 1 . 1 152 152 ILE CA C 13 65.516 0.040 . 1 . . . . . 153 I CA . 53616 1
635 . 1 . 1 152 152 ILE CB C 13 38.450 0.000 . 1 . . . . . 153 I CB . 53616 1
636 . 1 . 1 152 152 ILE N N 15 118.200 0.051 . 1 . . . . . 153 I N . 53616 1
637 . 1 . 1 153 153 LYS H H 1 7.968 0.002 . 1 . . . . . 154 K H . 53616 1
638 . 1 . 1 153 153 LYS C C 13 178.284 0.069 . 1 . . . . . 154 K C . 53616 1
639 . 1 . 1 153 153 LYS CA C 13 59.213 0.021 . 1 . . . . . 154 K CA . 53616 1
640 . 1 . 1 153 153 LYS CB C 13 32.328 0.009 . 1 . . . . . 154 K CB . 53616 1
641 . 1 . 1 153 153 LYS N N 15 121.883 0.042 . 1 . . . . . 154 K N . 53616 1
642 . 1 . 1 154 154 ASN H H 1 8.091 0.003 . 1 . . . . . 155 N H . 53616 1
643 . 1 . 1 154 154 ASN C C 13 175.087 0.081 . 1 . . . . . 155 N C . 53616 1
644 . 1 . 1 154 154 ASN CA C 13 53.267 0.046 . 1 . . . . . 155 N CA . 53616 1
645 . 1 . 1 154 154 ASN CB C 13 39.497 0.088 . 1 . . . . . 155 N CB . 53616 1
646 . 1 . 1 154 154 ASN N N 15 113.437 0.048 . 1 . . . . . 155 N N . 53616 1
647 . 1 . 1 155 155 GLY H H 1 7.870 0.002 . 1 . . . . . 156 G H . 53616 1
648 . 1 . 1 155 155 GLY C C 13 174.302 0.046 . 1 . . . . . 156 G C . 53616 1
649 . 1 . 1 155 155 GLY CA C 13 47.391 0.016 . 1 . . . . . 156 G CA . 53616 1
650 . 1 . 1 155 155 GLY N N 15 111.354 0.032 . 1 . . . . . 156 G N . 53616 1
651 . 1 . 1 156 156 LYS H H 1 8.125 0.002 . 1 . . . . . 157 K H . 53616 1
652 . 1 . 1 156 156 LYS C C 13 178.154 0.051 . 1 . . . . . 157 K C . 53616 1
653 . 1 . 1 156 156 LYS CA C 13 54.506 0.068 . 1 . . . . . 157 K CA . 53616 1
654 . 1 . 1 156 156 LYS CB C 13 33.276 0.061 . 1 . . . . . 157 K CB . 53616 1
655 . 1 . 1 156 156 LYS N N 15 116.819 0.033 . 1 . . . . . 157 K N . 53616 1
656 . 1 . 1 157 157 GLY H H 1 8.680 0.003 . 1 . . . . . 158 G H . 53616 1
657 . 1 . 1 157 157 GLY C C 13 175.383 0.068 . 1 . . . . . 158 G C . 53616 1
658 . 1 . 1 157 157 GLY CA C 13 46.348 0.000 . 1 . . . . . 158 G CA . 53616 1
659 . 1 . 1 157 157 GLY N N 15 109.913 0.030 . 1 . . . . . 158 G N . 53616 1
660 . 1 . 1 158 158 LEU H H 1 9.152 0.002 . 1 . . . . . 159 L H . 53616 1
661 . 1 . 1 158 158 LEU C C 13 176.917 0.000 . 1 . . . . . 159 L C . 53616 1
662 . 1 . 1 158 158 LEU CA C 13 56.985 0.126 . 1 . . . . . 159 L CA . 53616 1
663 . 1 . 1 158 158 LEU CB C 13 41.955 0.000 . 1 . . . . . 159 L CB . 53616 1
664 . 1 . 1 158 158 LEU N N 15 127.673 0.065 . 1 . . . . . 159 L N . 53616 1
665 . 1 . 1 159 159 HIS H H 1 7.856 0.005 . 1 . . . . . 160 H H . 53616 1
666 . 1 . 1 159 159 HIS C C 13 175.194 0.042 . 1 . . . . . 160 H C . 53616 1
667 . 1 . 1 159 159 HIS CA C 13 55.052 0.029 . 1 . . . . . 160 H CA . 53616 1
668 . 1 . 1 159 159 HIS CB C 13 30.133 0.031 . 1 . . . . . 160 H CB . 53616 1
669 . 1 . 1 159 159 HIS N N 15 117.799 0.034 . 1 . . . . . 160 H N . 53616 1
670 . 1 . 1 160 160 SER H H 1 7.813 0.001 . 1 . . . . . 161 S H . 53616 1
671 . 1 . 1 160 160 SER C C 13 173.772 0.038 . 1 . . . . . 161 S C . 53616 1
672 . 1 . 1 160 160 SER CA C 13 59.411 0.074 . 1 . . . . . 161 S CA . 53616 1
673 . 1 . 1 160 160 SER CB C 13 64.414 0.022 . 1 . . . . . 161 S CB . 53616 1
674 . 1 . 1 160 160 SER N N 15 116.432 0.037 . 1 . . . . . 161 S N . 53616 1
675 . 1 . 1 161 161 LYS H H 1 8.008 0.001 . 1 . . . . . 162 K H . 53616 1
676 . 1 . 1 161 161 LYS C C 13 181.318 0.000 . 1 . . . . . 162 K C . 53616 1
677 . 1 . 1 161 161 LYS CA C 13 57.737 0.000 . 1 . . . . . 162 K CA . 53616 1
678 . 1 . 1 161 161 LYS CB C 13 33.890 0.000 . 1 . . . . . 162 K CB . 53616 1
679 . 1 . 1 161 161 LYS N N 15 128.468 0.017 . 1 . . . . . 162 K N . 53616 1
stop_
save_