Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 16514
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
2 '3D HNCO' . . . 16514 1
3 '3D HNCA' . . . 16514 1
4 '3D HNCACB' . . . 16514 1
5 '3D HN(CA)CO' . . . 16514 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 MET H H 1 8.447 0.001 . 1 . . . . 1 M H . 16514 1
2 . 1 1 1 1 MET C C 13 176.098 0.000 . 1 . . . . 1 M C . 16514 1
3 . 1 1 1 1 MET CA C 13 55.556 0.034 . 1 . . . . 1 M CA . 16514 1
4 . 1 1 1 1 MET CB C 13 32.989 0.004 . 1 . . . . 1 M CB . 16514 1
5 . 1 1 1 1 MET N N 15 122.195 0.012 . 1 . . . . 1 M N . 16514 1
6 . 1 1 2 2 SER H H 1 8.411 0.001 . 1 . . . . 2 S H . 16514 1
7 . 1 1 2 2 SER C C 13 174.322 0.000 . 1 . . . . 2 S C . 16514 1
8 . 1 1 2 2 SER CA C 13 58.291 0.001 . 1 . . . . 2 S CA . 16514 1
9 . 1 1 2 2 SER CB C 13 63.881 0.005 . 1 . . . . 2 S CB . 16514 1
10 . 1 1 2 2 SER N N 15 117.702 0.009 . 1 . . . . 2 S N . 16514 1
11 . 1 1 3 3 ALA H H 1 8.475 0.001 . 1 . . . . 3 A H . 16514 1
12 . 1 1 3 3 ALA C C 13 177.956 0.000 . 1 . . . . 3 A C . 16514 1
13 . 1 1 3 3 ALA CA C 13 52.764 0.007 . 1 . . . . 3 A CA . 16514 1
14 . 1 1 3 3 ALA CB C 13 19.145 0.001 . 1 . . . . 3 A CB . 16514 1
15 . 1 1 3 3 ALA N N 15 126.483 0.007 . 1 . . . . 3 A N . 16514 1
16 . 1 1 4 4 THR H H 1 8.102 0.002 . 1 . . . . 4 T H . 16514 1
17 . 1 1 4 4 THR C C 13 174.323 0.000 . 1 . . . . 4 T C . 16514 1
18 . 1 1 4 4 THR CA C 13 61.748 0.013 . 1 . . . . 4 T CA . 16514 1
19 . 1 1 4 4 THR CB C 13 70.018 0.018 . 1 . . . . 4 T CB . 16514 1
20 . 1 1 4 4 THR N N 15 113.208 0.007 . 1 . . . . 4 T N . 16514 1
21 . 1 1 5 5 ALA H H 1 8.230 0.001 . 1 . . . . 5 A H . 16514 1
22 . 1 1 5 5 ALA C C 13 177.287 0.000 . 1 . . . . 5 A C . 16514 1
23 . 1 1 5 5 ALA CA C 13 52.464 0.000 . 1 . . . . 5 A CA . 16514 1
24 . 1 1 5 5 ALA CB C 13 19.184 0.000 . 1 . . . . 5 A CB . 16514 1
25 . 1 1 5 5 ALA N N 15 126.719 0.008 . 1 . . . . 5 A N . 16514 1
26 . 1 1 6 6 ALA H H 1 8.265 0.001 . 1 . . . . 6 A H . 16514 1
27 . 1 1 6 6 ALA C C 13 177.809 0.000 . 1 . . . . 6 A C . 16514 1
28 . 1 1 6 6 ALA CA C 13 52.419 0.002 . 1 . . . . 6 A CA . 16514 1
29 . 1 1 6 6 ALA CB C 13 19.175 0.001 . 1 . . . . 6 A CB . 16514 1
30 . 1 1 6 6 ALA N N 15 123.441 0.015 . 1 . . . . 6 A N . 16514 1
31 . 1 1 7 7 THR H H 1 8.135 0.001 . 1 . . . . 7 T H . 16514 1
32 . 1 1 7 7 THR C C 13 174.249 0.000 . 1 . . . . 7 T C . 16514 1
33 . 1 1 7 7 THR CA C 13 61.974 0.009 . 1 . . . . 7 T CA . 16514 1
34 . 1 1 7 7 THR CB C 13 70.040 0.034 . 1 . . . . 7 T CB . 16514 1
35 . 1 1 7 7 THR N N 15 114.272 0.054 . 1 . . . . 7 T N . 16514 1
36 . 1 1 8 8 VAL H H 1 8.188 0.010 . 1 . . . . 8 V H . 16514 1
37 . 1 1 8 8 VAL C C 13 173.920 0.000 . 1 . . . . 8 V C . 16514 1
38 . 1 1 8 8 VAL CA C 13 59.739 0.000 . 1 . . . . 8 V CA . 16514 1
39 . 1 1 8 8 VAL CB C 13 32.716 0.000 . 1 . . . . 8 V CB . 16514 1
40 . 1 1 8 8 VAL N N 15 124.681 0.094 . 1 . . . . 8 V N . 16514 1
41 . 1 1 10 10 PRO C C 13 176.488 0.000 . 1 . . . . 10 P C . 16514 1
42 . 1 1 10 10 PRO CA C 13 62.706 0.000 . 1 . . . . 10 P CA . 16514 1
43 . 1 1 10 10 PRO CB C 13 32.127 0.000 . 1 . . . . 10 P CB . 16514 1
44 . 1 1 11 11 ALA H H 1 8.311 0.000 . 1 . . . . 11 A H . 16514 1
45 . 1 1 11 11 ALA C C 13 177.091 0.009 . 1 . . . . 11 A C . 16514 1
46 . 1 1 11 11 ALA CA C 13 52.067 0.014 . 1 . . . . 11 A CA . 16514 1
47 . 1 1 11 11 ALA CB C 13 19.174 0.000 . 1 . . . . 11 A CB . 16514 1
48 . 1 1 11 11 ALA N N 15 124.536 0.043 . 1 . . . . 11 A N . 16514 1
49 . 1 1 12 12 ALA H H 1 8.285 0.008 . 1 . . . . 12 A H . 16514 1
50 . 1 1 12 12 ALA C C 13 175.455 0.000 . 1 . . . . 12 A C . 16514 1
51 . 1 1 12 12 ALA CA C 13 50.294 0.000 . 1 . . . . 12 A CA . 16514 1
52 . 1 1 12 12 ALA CB C 13 18.145 0.000 . 1 . . . . 12 A CB . 16514 1
53 . 1 1 12 12 ALA N N 15 124.901 0.025 . 1 . . . . 12 A N . 16514 1
54 . 1 1 13 13 PRO C C 13 176.741 0.000 . 1 . . . . 13 P C . 16514 1
55 . 1 1 13 13 PRO CA C 13 62.972 0.000 . 1 . . . . 13 P CA . 16514 1
56 . 1 1 13 13 PRO CB C 13 32.160 0.000 . 1 . . . . 13 P CB . 16514 1
57 . 1 1 14 14 ALA H H 1 8.473 0.001 . 1 . . . . 14 A H . 16514 1
58 . 1 1 14 14 ALA C C 13 178.395 0.000 . 1 . . . . 14 A C . 16514 1
59 . 1 1 14 14 ALA CA C 13 52.642 0.008 . 1 . . . . 14 A CA . 16514 1
60 . 1 1 14 14 ALA CB C 13 19.078 0.004 . 1 . . . . 14 A CB . 16514 1
61 . 1 1 14 14 ALA N N 15 124.754 0.006 . 1 . . . . 14 A N . 16514 1
62 . 1 1 15 15 GLY H H 1 8.371 0.001 . 1 . . . . 15 G H . 16514 1
63 . 1 1 15 15 GLY C C 13 174.274 0.000 . 1 . . . . 15 G C . 16514 1
64 . 1 1 15 15 GLY CA C 13 45.255 0.049 . 1 . . . . 15 G CA . 16514 1
65 . 1 1 15 15 GLY N N 15 108.357 0.010 . 1 . . . . 15 G N . 16514 1
66 . 1 1 16 16 GLU H H 1 8.313 0.002 . 1 . . . . 16 E H . 16514 1
67 . 1 1 16 16 GLU C C 13 177.050 0.000 . 1 . . . . 16 E C . 16514 1
68 . 1 1 16 16 GLU CA C 13 56.558 0.004 . 1 . . . . 16 E CA . 16514 1
69 . 1 1 16 16 GLU CB C 13 30.298 0.008 . 1 . . . . 16 E CB . 16514 1
70 . 1 1 16 16 GLU N N 15 120.615 0.009 . 1 . . . . 16 E N . 16514 1
71 . 1 1 17 17 GLY H H 1 8.521 0.001 . 1 . . . . 17 G H . 16514 1
72 . 1 1 17 17 GLY C C 13 174.312 0.011 . 1 . . . . 17 G C . 16514 1
73 . 1 1 17 17 GLY CA C 13 45.256 0.047 . 1 . . . . 17 G CA . 16514 1
74 . 1 1 17 17 GLY N N 15 110.132 0.007 . 1 . . . . 17 G N . 16514 1
75 . 1 1 18 18 GLY H H 1 8.097 0.002 . 1 . . . . 18 G H . 16514 1
76 . 1 1 18 18 GLY C C 13 171.147 0.000 . 1 . . . . 18 G C . 16514 1
77 . 1 1 18 18 GLY CA C 13 44.416 0.110 . 1 . . . . 18 G CA . 16514 1
78 . 1 1 18 18 GLY N N 15 108.988 0.040 . 1 . . . . 18 G N . 16514 1
79 . 1 1 20 20 PRO C C 13 176.285 0.013 . 1 . . . . 20 P C . 16514 1
80 . 1 1 20 20 PRO CA C 13 62.722 0.000 . 1 . . . . 20 P CA . 16514 1
81 . 1 1 20 20 PRO CB C 13 32.018 0.000 . 1 . . . . 20 P CB . 16514 1
82 . 1 1 21 21 ALA H H 1 8.358 0.008 . 1 . . . . 21 A H . 16514 1
83 . 1 1 21 21 ALA C C 13 175.007 0.000 . 1 . . . . 21 A C . 16514 1
84 . 1 1 21 21 ALA CA C 13 50.249 0.000 . 1 . . . . 21 A CA . 16514 1
85 . 1 1 21 21 ALA CB C 13 18.040 0.000 . 1 . . . . 21 A CB . 16514 1
86 . 1 1 21 21 ALA N N 15 125.649 0.032 . 1 . . . . 21 A N . 16514 1
87 . 1 1 24 24 PRO C C 13 176.551 0.000 . 1 . . . . 24 P C . 16514 1
88 . 1 1 24 24 PRO CA C 13 63.109 0.000 . 1 . . . . 24 P CA . 16514 1
89 . 1 1 24 24 PRO CB C 13 32.072 0.000 . 1 . . . . 24 P CB . 16514 1
90 . 1 1 25 25 ASN H H 1 8.467 0.001 . 1 . . . . 25 N H . 16514 1
91 . 1 1 25 25 ASN C C 13 175.287 0.000 . 1 . . . . 25 N C . 16514 1
92 . 1 1 25 25 ASN CA C 13 53.109 0.011 . 1 . . . . 25 N CA . 16514 1
93 . 1 1 25 25 ASN CB C 13 38.572 0.009 . 1 . . . . 25 N CB . 16514 1
94 . 1 1 25 25 ASN N N 15 118.178 0.004 . 1 . . . . 25 N N . 16514 1
95 . 1 1 26 26 LEU H H 1 8.274 0.001 . 1 . . . . 26 L H . 16514 1
96 . 1 1 26 26 LEU C C 13 177.742 0.000 . 1 . . . . 26 L C . 16514 1
97 . 1 1 26 26 LEU CA C 13 55.410 0.003 . 1 . . . . 26 L CA . 16514 1
98 . 1 1 26 26 LEU CB C 13 42.295 0.002 . 1 . . . . 26 L CB . 16514 1
99 . 1 1 26 26 LEU N N 15 122.942 0.019 . 1 . . . . 26 L N . 16514 1
100 . 1 1 27 27 THR H H 1 8.130 0.002 . 1 . . . . 27 T H . 16514 1
101 . 1 1 27 27 THR C C 13 174.807 0.000 . 1 . . . . 27 T C . 16514 1
102 . 1 1 27 27 THR CA C 13 62.157 0.033 . 1 . . . . 27 T CA . 16514 1
103 . 1 1 27 27 THR CB C 13 69.868 0.025 . 1 . . . . 27 T CB . 16514 1
104 . 1 1 27 27 THR N N 15 113.988 0.022 . 1 . . . . 27 T N . 16514 1
105 . 1 1 28 28 SER H H 1 8.246 0.001 . 1 . . . . 28 S H . 16514 1
106 . 1 1 28 28 SER C C 13 174.472 0.000 . 1 . . . . 28 S C . 16514 1
107 . 1 1 28 28 SER CA C 13 58.621 0.007 . 1 . . . . 28 S CA . 16514 1
108 . 1 1 28 28 SER CB C 13 63.692 0.004 . 1 . . . . 28 S CB . 16514 1
109 . 1 1 28 28 SER N N 15 117.579 0.027 . 1 . . . . 28 S N . 16514 1
110 . 1 1 29 29 ASN H H 1 8.418 0.001 . 1 . . . . 29 N H . 16514 1
111 . 1 1 29 29 ASN C C 13 175.407 0.000 . 1 . . . . 29 N C . 16514 1
112 . 1 1 29 29 ASN CA C 13 53.492 0.012 . 1 . . . . 29 N CA . 16514 1
113 . 1 1 29 29 ASN CB C 13 38.557 0.107 . 1 . . . . 29 N CB . 16514 1
114 . 1 1 29 29 ASN N N 15 120.846 0.005 . 1 . . . . 29 N N . 16514 1
115 . 1 1 30 30 ARG H H 1 8.230 0.002 . 1 . . . . 30 R H . 16514 1
116 . 1 1 30 30 ARG C C 13 176.487 0.000 . 1 . . . . 30 R C . 16514 1
117 . 1 1 30 30 ARG CA C 13 56.600 0.000 . 1 . . . . 30 R CA . 16514 1
118 . 1 1 30 30 ARG CB C 13 30.442 0.000 . 1 . . . . 30 R CB . 16514 1
119 . 1 1 30 30 ARG N N 15 121.346 0.017 . 1 . . . . 30 R N . 16514 1
120 . 1 1 31 31 ARG H H 1 8.280 0.001 . 1 . . . . 31 R H . 16514 1
121 . 1 1 31 31 ARG C C 13 176.590 0.000 . 1 . . . . 31 R C . 16514 1
122 . 1 1 31 31 ARG CA C 13 56.587 0.004 . 1 . . . . 31 R CA . 16514 1
123 . 1 1 31 31 ARG CB C 13 30.378 0.040 . 1 . . . . 31 R CB . 16514 1
124 . 1 1 31 31 ARG N N 15 121.598 0.023 . 1 . . . . 31 R N . 16514 1
125 . 1 1 32 32 LEU H H 1 8.182 0.001 . 1 . . . . 32 L H . 16514 1
126 . 1 1 32 32 LEU C C 13 177.478 0.000 . 1 . . . . 32 L C . 16514 1
127 . 1 1 32 32 LEU CA C 13 55.401 0.037 . 1 . . . . 32 L CA . 16514 1
128 . 1 1 32 32 LEU CB C 13 42.183 0.033 . 1 . . . . 32 L CB . 16514 1
129 . 1 1 32 32 LEU N N 15 122.758 0.029 . 1 . . . . 32 L N . 16514 1
130 . 1 1 33 33 GLN H H 1 8.288 0.001 . 1 . . . . 33 Q H . 16514 1
131 . 1 1 33 33 GLN C C 13 176.066 0.000 . 1 . . . . 33 Q C . 16514 1
132 . 1 1 33 33 GLN CA C 13 56.085 0.000 . 1 . . . . 33 Q CA . 16514 1
133 . 1 1 33 33 GLN CB C 13 29.368 0.000 . 1 . . . . 33 Q CB . 16514 1
134 . 1 1 33 33 GLN N N 15 120.674 0.017 . 1 . . . . 33 Q N . 16514 1
135 . 1 1 34 34 GLN H H 1 8.387 0.001 . 1 . . . . 34 Q H . 16514 1
136 . 1 1 34 34 GLN C C 13 176.277 0.000 . 1 . . . . 34 Q C . 16514 1
137 . 1 1 34 34 GLN CA C 13 56.100 0.002 . 1 . . . . 34 Q CA . 16514 1
138 . 1 1 34 34 GLN CB C 13 29.459 0.019 . 1 . . . . 34 Q CB . 16514 1
139 . 1 1 34 34 GLN N N 15 121.423 0.010 . 1 . . . . 34 Q N . 16514 1
140 . 1 1 35 35 THR H H 1 8.222 0.001 . 1 . . . . 35 T H . 16514 1
141 . 1 1 35 35 THR C C 13 174.571 0.000 . 1 . . . . 35 T C . 16514 1
142 . 1 1 35 35 THR CA C 13 62.128 0.009 . 1 . . . . 35 T CA . 16514 1
143 . 1 1 35 35 THR CB C 13 70.028 0.016 . 1 . . . . 35 T CB . 16514 1
144 . 1 1 35 35 THR N N 15 115.414 0.008 . 1 . . . . 35 T N . 16514 1
145 . 1 1 36 36 GLN H H 1 8.419 0.001 . 1 . . . . 36 Q H . 16514 1
146 . 1 1 36 36 GLN C C 13 175.594 0.000 . 1 . . . . 36 Q C . 16514 1
147 . 1 1 36 36 GLN CA C 13 55.895 0.006 . 1 . . . . 36 Q CA . 16514 1
148 . 1 1 36 36 GLN CB C 13 29.410 0.008 . 1 . . . . 36 Q CB . 16514 1
149 . 1 1 36 36 GLN N N 15 122.666 0.006 . 1 . . . . 36 Q N . 16514 1
150 . 1 1 37 37 ALA H H 1 8.316 0.002 . 1 . . . . 37 A H . 16514 1
151 . 1 1 37 37 ALA C C 13 177.665 0.000 . 1 . . . . 37 A C . 16514 1
152 . 1 1 37 37 ALA CA C 13 52.672 0.003 . 1 . . . . 37 A CA . 16514 1
153 . 1 1 37 37 ALA CB C 13 18.940 0.056 . 1 . . . . 37 A CB . 16514 1
154 . 1 1 37 37 ALA N N 15 125.113 0.033 . 1 . . . . 37 A N . 16514 1
155 . 1 1 38 38 GLN H H 1 8.319 0.001 . 1 . . . . 38 Q H . 16514 1
156 . 1 1 38 38 GLN C C 13 176.084 0.000 . 1 . . . . 38 Q C . 16514 1
157 . 1 1 38 38 GLN CA C 13 55.827 0.021 . 1 . . . . 38 Q CA . 16514 1
158 . 1 1 38 38 GLN CB C 13 29.362 0.018 . 1 . . . . 38 Q CB . 16514 1
159 . 1 1 38 38 GLN N N 15 119.966 0.013 . 1 . . . . 38 Q N . 16514 1
160 . 1 1 39 39 VAL H H 1 8.172 0.001 . 1 . . . . 39 V H . 16514 1
161 . 1 1 39 39 VAL C C 13 175.838 0.000 . 1 . . . . 39 V C . 16514 1
162 . 1 1 39 39 VAL CA C 13 62.398 0.003 . 1 . . . . 39 V CA . 16514 1
163 . 1 1 39 39 VAL CB C 13 32.916 0.022 . 1 . . . . 39 V CB . 16514 1
164 . 1 1 39 39 VAL N N 15 121.414 0.020 . 1 . . . . 39 V N . 16514 1
165 . 1 1 40 40 ASP H H 1 8.383 0.001 . 1 . . . . 40 D H . 16514 1
166 . 1 1 40 40 ASP C C 13 175.962 0.000 . 1 . . . . 40 D C . 16514 1
167 . 1 1 40 40 ASP CA C 13 54.494 0.000 . 1 . . . . 40 D CA . 16514 1
168 . 1 1 40 40 ASP CB C 13 41.200 0.000 . 1 . . . . 40 D CB . 16514 1
169 . 1 1 40 40 ASP N N 15 123.603 0.011 . 1 . . . . 40 D N . 16514 1
170 . 1 1 41 41 GLU H H 1 8.236 0.002 . 1 . . . . 41 E H . 16514 1
171 . 1 1 41 41 GLU C C 13 176.238 0.000 . 1 . . . . 41 E C . 16514 1
172 . 1 1 41 41 GLU CA C 13 56.610 0.000 . 1 . . . . 41 E CA . 16514 1
173 . 1 1 41 41 GLU CB C 13 30.468 0.004 . 1 . . . . 41 E CB . 16514 1
174 . 1 1 41 41 GLU N N 15 121.309 0.021 . 1 . . . . 41 E N . 16514 1
175 . 1 1 42 42 VAL H H 1 8.228 0.002 . 1 . . . . 42 V H . 16514 1
176 . 1 1 42 42 VAL C C 13 176.172 0.000 . 1 . . . . 42 V C . 16514 1
177 . 1 1 42 42 VAL CA C 13 62.633 0.000 . 1 . . . . 42 V CA . 16514 1
178 . 1 1 42 42 VAL CB C 13 32.511 0.000 . 1 . . . . 42 V CB . 16514 1
179 . 1 1 42 42 VAL N N 15 122.318 0.020 . 1 . . . . 42 V N . 16514 1
180 . 1 1 43 43 VAL H H 1 8.198 0.002 . 1 . . . . 43 V H . 16514 1
181 . 1 1 43 43 VAL C C 13 175.730 0.000 . 1 . . . . 43 V C . 16514 1
182 . 1 1 43 43 VAL CA C 13 62.378 0.041 . 1 . . . . 43 V CA . 16514 1
183 . 1 1 43 43 VAL CB C 13 32.814 0.052 . 1 . . . . 43 V CB . 16514 1
184 . 1 1 43 43 VAL N N 15 124.362 0.044 . 1 . . . . 43 V N . 16514 1
185 . 1 1 44 44 ASP H H 1 8.370 0.001 . 1 . . . . 44 D H . 16514 1
186 . 1 1 44 44 ASP C C 13 176.459 0.000 . 1 . . . . 44 D C . 16514 1
187 . 1 1 44 44 ASP CA C 13 54.189 0.006 . 1 . . . . 44 D CA . 16514 1
188 . 1 1 44 44 ASP CB C 13 41.253 0.084 . 1 . . . . 44 D CB . 16514 1
189 . 1 1 44 44 ASP N N 15 124.447 0.028 . 1 . . . . 44 D N . 16514 1
190 . 1 1 45 45 ILE H H 1 8.087 0.001 . 1 . . . . 45 I H . 16514 1
191 . 1 1 45 45 ILE C C 13 176.376 0.000 . 1 . . . . 45 I C . 16514 1
192 . 1 1 45 45 ILE CA C 13 61.780 0.005 . 1 . . . . 45 I CA . 16514 1
193 . 1 1 45 45 ILE CB C 13 38.853 0.111 . 1 . . . . 45 I CB . 16514 1
194 . 1 1 45 45 ILE N N 15 121.344 0.010 . 1 . . . . 45 I N . 16514 1
195 . 1 1 46 46 MET H H 1 8.342 0.000 . 1 . . . . 46 M H . 16514 1
196 . 1 1 46 46 MET C C 13 176.332 0.000 . 1 . . . . 46 M C . 16514 1
197 . 1 1 46 46 MET CA C 13 55.531 0.021 . 1 . . . . 46 M CA . 16514 1
198 . 1 1 46 46 MET CB C 13 32.024 0.012 . 1 . . . . 46 M CB . 16514 1
199 . 1 1 46 46 MET N N 15 122.341 0.042 . 1 . . . . 46 M N . 16514 1
200 . 1 1 47 47 ARG H H 1 8.106 0.003 . 1 . . . . 47 R H . 16514 1
201 . 1 1 47 47 ARG C C 13 176.131 0.000 . 1 . . . . 47 R C . 16514 1
202 . 1 1 47 47 ARG CA C 13 56.195 0.015 . 1 . . . . 47 R CA . 16514 1
203 . 1 1 47 47 ARG CB C 13 30.610 0.002 . 1 . . . . 47 R CB . 16514 1
204 . 1 1 47 47 ARG N N 15 122.040 0.050 . 1 . . . . 47 R N . 16514 1
205 . 1 1 48 48 VAL H H 1 8.059 0.002 . 1 . . . . 48 V H . 16514 1
206 . 1 1 48 48 VAL C C 13 175.777 0.000 . 1 . . . . 48 V C . 16514 1
207 . 1 1 48 48 VAL CA C 13 62.409 0.007 . 1 . . . . 48 V CA . 16514 1
208 . 1 1 48 48 VAL CB C 13 32.825 0.006 . 1 . . . . 48 V CB . 16514 1
209 . 1 1 48 48 VAL N N 15 120.740 0.017 . 1 . . . . 48 V N . 16514 1
210 . 1 1 49 49 ASN H H 1 8.518 0.001 . 1 . . . . 49 N H . 16514 1
211 . 1 1 49 49 ASN C C 13 175.320 0.000 . 1 . . . . 49 N C . 16514 1
212 . 1 1 49 49 ASN CA C 13 53.248 0.004 . 1 . . . . 49 N CA . 16514 1
213 . 1 1 49 49 ASN CB C 13 38.951 0.055 . 1 . . . . 49 N CB . 16514 1
214 . 1 1 49 49 ASN N N 15 122.485 0.002 . 1 . . . . 49 N N . 16514 1
215 . 1 1 50 50 VAL H H 1 8.103 0.001 . 1 . . . . 50 V H . 16514 1
216 . 1 1 50 50 VAL C C 13 175.845 0.000 . 1 . . . . 50 V C . 16514 1
217 . 1 1 50 50 VAL CA C 13 62.605 0.003 . 1 . . . . 50 V CA . 16514 1
218 . 1 1 50 50 VAL CB C 13 32.610 0.010 . 1 . . . . 50 V CB . 16514 1
219 . 1 1 50 50 VAL N N 15 120.390 0.030 . 1 . . . . 50 V N . 16514 1
220 . 1 1 51 51 ASP H H 1 8.332 0.001 . 1 . . . . 51 D H . 16514 1
221 . 1 1 51 51 ASP C C 13 176.262 0.000 . 1 . . . . 51 D C . 16514 1
222 . 1 1 51 51 ASP CA C 13 54.736 0.010 . 1 . . . . 51 D CA . 16514 1
223 . 1 1 51 51 ASP CB C 13 41.043 0.029 . 1 . . . . 51 D CB . 16514 1
224 . 1 1 51 51 ASP N N 15 123.120 0.012 . 1 . . . . 51 D N . 16514 1
225 . 1 1 52 52 LYS H H 1 8.106 0.002 . 1 . . . . 52 K H . 16514 1
226 . 1 1 52 52 LYS C C 13 176.688 0.000 . 1 . . . . 52 K C . 16514 1
227 . 1 1 52 52 LYS CA C 13 56.519 0.028 . 1 . . . . 52 K CA . 16514 1
228 . 1 1 52 52 LYS CB C 13 32.857 0.000 . 1 . . . . 52 K CB . 16514 1
229 . 1 1 52 52 LYS N N 15 121.544 0.061 . 1 . . . . 52 K N . 16514 1
230 . 1 1 53 53 VAL H H 1 8.098 0.002 . 1 . . . . 53 V H . 16514 1
231 . 1 1 53 53 VAL C C 13 176.325 0.000 . 1 . . . . 53 V C . 16514 1
232 . 1 1 53 53 VAL CA C 13 63.091 0.003 . 1 . . . . 53 V CA . 16514 1
233 . 1 1 53 53 VAL CB C 13 32.430 0.121 . 1 . . . . 53 V CB . 16514 1
234 . 1 1 53 53 VAL N N 15 121.956 0.040 . 1 . . . . 53 V N . 16514 1
235 . 1 1 54 54 LEU H H 1 8.271 0.001 . 1 . . . . 54 L H . 16514 1
236 . 1 1 54 54 LEU C C 13 177.581 0.000 . 1 . . . . 54 L C . 16514 1
237 . 1 1 54 54 LEU CA C 13 55.365 0.010 . 1 . . . . 54 L CA . 16514 1
238 . 1 1 54 54 LEU CB C 13 42.244 0.011 . 1 . . . . 54 L CB . 16514 1
239 . 1 1 54 54 LEU N N 15 125.350 0.009 . 1 . . . . 54 L N . 16514 1
240 . 1 1 55 55 GLU H H 1 8.315 0.003 . 1 . . . . 55 E H . 16514 1
241 . 1 1 55 55 GLU C C 13 176.732 0.000 . 1 . . . . 55 E C . 16514 1
242 . 1 1 55 55 GLU CA C 13 56.914 0.000 . 1 . . . . 55 E CA . 16514 1
243 . 1 1 55 55 GLU CB C 13 30.145 0.000 . 1 . . . . 55 E CB . 16514 1
244 . 1 1 55 55 GLU N N 15 121.696 0.024 . 1 . . . . 55 E N . 16514 1
245 . 1 1 56 56 ARG H H 1 8.238 0.002 . 1 . . . . 56 R H . 16514 1
246 . 1 1 56 56 ARG C C 13 176.299 0.000 . 1 . . . . 56 R C . 16514 1
247 . 1 1 56 56 ARG CA C 13 56.686 0.016 . 1 . . . . 56 R CA . 16514 1
248 . 1 1 56 56 ARG CB C 13 30.699 0.000 . 1 . . . . 56 R CB . 16514 1
249 . 1 1 56 56 ARG N N 15 121.346 0.032 . 1 . . . . 56 R N . 16514 1
250 . 1 1 57 57 ASP H H 1 8.338 0.001 . 1 . . . . 57 D H . 16514 1
251 . 1 1 57 57 ASP C C 13 176.613 0.000 . 1 . . . . 57 D C . 16514 1
252 . 1 1 57 57 ASP CA C 13 54.745 0.042 . 1 . . . . 57 D CA . 16514 1
253 . 1 1 57 57 ASP CB C 13 40.971 0.017 . 1 . . . . 57 D CB . 16514 1
254 . 1 1 57 57 ASP N N 15 120.918 0.051 . 1 . . . . 57 D N . 16514 1
255 . 1 1 58 58 GLN H H 1 8.252 0.002 . 1 . . . . 58 Q H . 16514 1
256 . 1 1 58 58 GLN C C 13 176.279 0.000 . 1 . . . . 58 Q C . 16514 1
257 . 1 1 58 58 GLN CA C 13 56.468 0.000 . 1 . . . . 58 Q CA . 16514 1
258 . 1 1 58 58 GLN CB C 13 29.604 0.009 . 1 . . . . 58 Q CB . 16514 1
259 . 1 1 58 58 GLN N N 15 121.336 0.063 . 1 . . . . 58 Q N . 16514 1
260 . 1 1 59 59 LYS H H 1 8.334 0.002 . 1 . . . . 59 K H . 16514 1
261 . 1 1 59 59 LYS C C 13 177.060 0.000 . 1 . . . . 59 K C . 16514 1
262 . 1 1 59 59 LYS CA C 13 56.676 0.001 . 1 . . . . 59 K CA . 16514 1
263 . 1 1 59 59 LYS CB C 13 32.553 0.022 . 1 . . . . 59 K CB . 16514 1
264 . 1 1 59 59 LYS N N 15 121.836 0.054 . 1 . . . . 59 K N . 16514 1
265 . 1 1 60 60 LEU H H 1 8.212 0.003 . 1 . . . . 60 L H . 16514 1
266 . 1 1 60 60 LEU C C 13 177.816 0.000 . 1 . . . . 60 L C . 16514 1
267 . 1 1 60 60 LEU CA C 13 55.648 0.001 . 1 . . . . 60 L CA . 16514 1
268 . 1 1 60 60 LEU CB C 13 42.078 0.005 . 1 . . . . 60 L CB . 16514 1
269 . 1 1 60 60 LEU N N 15 122.582 0.040 . 1 . . . . 60 L N . 16514 1
270 . 1 1 61 61 SER H H 1 8.247 0.001 . 1 . . . . 61 S H . 16514 1
271 . 1 1 61 61 SER C C 13 174.817 0.000 . 1 . . . . 61 S C . 16514 1
272 . 1 1 61 61 SER CA C 13 58.752 0.012 . 1 . . . . 61 S CA . 16514 1
273 . 1 1 61 61 SER CB C 13 63.811 0.009 . 1 . . . . 61 S CB . 16514 1
274 . 1 1 61 61 SER N N 15 115.972 0.004 . 1 . . . . 61 S N . 16514 1
275 . 1 1 62 62 GLU H H 1 8.345 0.002 . 1 . . . . 62 E H . 16514 1
276 . 1 1 62 62 GLU C C 13 176.612 0.000 . 1 . . . . 62 E C . 16514 1
277 . 1 1 62 62 GLU CA C 13 56.886 0.020 . 1 . . . . 62 E CA . 16514 1
278 . 1 1 62 62 GLU CB C 13 29.999 0.012 . 1 . . . . 62 E CB . 16514 1
279 . 1 1 62 62 GLU N N 15 122.376 0.022 . 1 . . . . 62 E N . 16514 1
280 . 1 1 63 63 LEU H H 1 8.040 0.001 . 1 . . . . 63 L H . 16514 1
281 . 1 1 63 63 LEU C C 13 177.203 0.000 . 1 . . . . 63 L C . 16514 1
282 . 1 1 63 63 LEU CA C 13 55.433 0.009 . 1 . . . . 63 L CA . 16514 1
283 . 1 1 63 63 LEU CB C 13 42.214 0.062 . 1 . . . . 63 L CB . 16514 1
284 . 1 1 63 63 LEU N N 15 121.543 0.010 . 1 . . . . 63 L N . 16514 1
285 . 1 1 64 64 ASP H H 1 8.157 0.003 . 1 . . . . 64 D H . 16514 1
286 . 1 1 64 64 ASP C C 13 176.025 0.000 . 1 . . . . 64 D C . 16514 1
287 . 1 1 64 64 ASP CA C 13 54.461 0.000 . 1 . . . . 64 D CA . 16514 1
288 . 1 1 64 64 ASP CB C 13 41.532 0.008 . 1 . . . . 64 D CB . 16514 1
289 . 1 1 64 64 ASP N N 15 120.989 0.031 . 1 . . . . 64 D N . 16514 1
290 . 1 1 65 65 ASP H H 1 8.249 0.003 . 1 . . . . 65 D H . 16514 1
291 . 1 1 65 65 ASP C C 13 176.637 0.000 . 1 . . . . 65 D C . 16514 1
292 . 1 1 65 65 ASP CA C 13 54.529 0.009 . 1 . . . . 65 D CA . 16514 1
293 . 1 1 65 65 ASP CB C 13 41.109 0.045 . 1 . . . . 65 D CB . 16514 1
294 . 1 1 65 65 ASP N N 15 121.358 0.016 . 1 . . . . 65 D N . 16514 1
295 . 1 1 66 66 ARG H H 1 8.177 0.002 . 1 . . . . 66 R H . 16514 1
296 . 1 1 66 66 ARG C C 13 176.696 0.000 . 1 . . . . 66 R C . 16514 1
297 . 1 1 66 66 ARG CA C 13 56.468 0.017 . 1 . . . . 66 R CA . 16514 1
298 . 1 1 66 66 ARG CB C 13 30.434 0.010 . 1 . . . . 66 R CB . 16514 1
299 . 1 1 66 66 ARG N N 15 120.725 0.014 . 1 . . . . 66 R N . 16514 1
300 . 1 1 67 67 ALA H H 1 8.230 0.001 . 1 . . . . 67 A H . 16514 1
301 . 1 1 67 67 ALA C C 13 178.091 0.000 . 1 . . . . 67 A C . 16514 1
302 . 1 1 67 67 ALA CA C 13 53.302 0.001 . 1 . . . . 67 A CA . 16514 1
303 . 1 1 67 67 ALA CB C 13 18.922 0.007 . 1 . . . . 67 A CB . 16514 1
304 . 1 1 67 67 ALA N N 15 124.155 0.010 . 1 . . . . 67 A N . 16514 1
305 . 1 1 68 68 ASP H H 1 8.244 0.001 . 1 . . . . 68 D H . 16514 1
306 . 1 1 68 68 ASP C C 13 176.545 0.000 . 1 . . . . 68 D C . 16514 1
307 . 1 1 68 68 ASP CA C 13 54.641 0.006 . 1 . . . . 68 D CA . 16514 1
308 . 1 1 68 68 ASP CB C 13 40.910 0.006 . 1 . . . . 68 D CB . 16514 1
309 . 1 1 68 68 ASP N N 15 118.791 0.016 . 1 . . . . 68 D N . 16514 1
310 . 1 1 69 69 ALA H H 1 8.057 0.002 . 1 . . . . 69 A H . 16514 1
311 . 1 1 69 69 ALA C C 13 178.281 0.000 . 1 . . . . 69 A C . 16514 1
312 . 1 1 69 69 ALA CA C 13 53.120 0.062 . 1 . . . . 69 A CA . 16514 1
313 . 1 1 69 69 ALA CB C 13 18.959 0.029 . 1 . . . . 69 A CB . 16514 1
314 . 1 1 69 69 ALA N N 15 123.608 0.008 . 1 . . . . 69 A N . 16514 1
315 . 1 1 70 70 LEU H H 1 8.099 0.001 . 1 . . . . 70 L H . 16514 1
316 . 1 1 70 70 LEU C C 13 177.844 0.000 . 1 . . . . 70 L C . 16514 1
317 . 1 1 70 70 LEU CA C 13 55.511 0.052 . 1 . . . . 70 L CA . 16514 1
318 . 1 1 70 70 LEU CB C 13 41.933 0.046 . 1 . . . . 70 L CB . 16514 1
319 . 1 1 70 70 LEU N N 15 120.026 0.044 . 1 . . . . 70 L N . 16514 1
320 . 1 1 71 71 GLN H H 1 8.129 0.002 . 1 . . . . 71 Q H . 16514 1
321 . 1 1 71 71 GLN C C 13 175.981 0.000 . 1 . . . . 71 Q C . 16514 1
322 . 1 1 71 71 GLN CA C 13 55.886 0.029 . 1 . . . . 71 Q CA . 16514 1
323 . 1 1 71 71 GLN CB C 13 29.180 0.005 . 1 . . . . 71 Q CB . 16514 1
324 . 1 1 71 71 GLN N N 15 120.286 0.013 . 1 . . . . 71 Q N . 16514 1
325 . 1 1 72 72 ALA H H 1 8.252 0.001 . 1 . . . . 72 A H . 16514 1
326 . 1 1 72 72 ALA C C 13 178.403 0.000 . 1 . . . . 72 A C . 16514 1
327 . 1 1 72 72 ALA CA C 13 53.007 0.010 . 1 . . . . 72 A CA . 16514 1
328 . 1 1 72 72 ALA CB C 13 18.998 0.016 . 1 . . . . 72 A CB . 16514 1
329 . 1 1 72 72 ALA N N 15 124.757 0.018 . 1 . . . . 72 A N . 16514 1
330 . 1 1 73 73 GLY H H 1 8.335 0.001 . 1 . . . . 73 G H . 16514 1
331 . 1 1 73 73 GLY C C 13 174.136 0.000 . 1 . . . . 73 G C . 16514 1
332 . 1 1 73 73 GLY CA C 13 45.387 0.047 . 1 . . . . 73 G CA . 16514 1
333 . 1 1 73 73 GLY N N 15 108.215 0.009 . 1 . . . . 73 G N . 16514 1
334 . 1 1 74 74 ALA H H 1 8.067 0.001 . 1 . . . . 74 A H . 16514 1
335 . 1 1 74 74 ALA C C 13 178.116 0.000 . 1 . . . . 74 A C . 16514 1
336 . 1 1 74 74 ALA CA C 13 52.764 0.038 . 1 . . . . 74 A CA . 16514 1
337 . 1 1 74 74 ALA CB C 13 19.230 0.057 . 1 . . . . 74 A CB . 16514 1
338 . 1 1 74 74 ALA N N 15 123.574 0.011 . 1 . . . . 74 A N . 16514 1
339 . 1 1 75 75 SER H H 1 8.347 0.001 . 1 . . . . 75 S H . 16514 1
340 . 1 1 75 75 SER C C 13 174.903 0.000 . 1 . . . . 75 S C . 16514 1
341 . 1 1 75 75 SER CA C 13 58.611 0.002 . 1 . . . . 75 S CA . 16514 1
342 . 1 1 75 75 SER CB C 13 63.819 0.035 . 1 . . . . 75 S CB . 16514 1
343 . 1 1 75 75 SER N N 15 115.004 0.004 . 1 . . . . 75 S N . 16514 1
344 . 1 1 76 76 GLN H H 1 8.365 0.001 . 1 . . . . 76 Q H . 16514 1
345 . 1 1 76 76 GLN C C 13 175.841 0.000 . 1 . . . . 76 Q C . 16514 1
346 . 1 1 76 76 GLN CA C 13 56.395 0.035 . 1 . . . . 76 Q CA . 16514 1
347 . 1 1 76 76 GLN CB C 13 29.055 0.026 . 1 . . . . 76 Q CB . 16514 1
348 . 1 1 76 76 GLN N N 15 121.834 0.023 . 1 . . . . 76 Q N . 16514 1
349 . 1 1 77 77 PHE H H 1 8.098 0.001 . 1 . . . . 77 F H . 16514 1
350 . 1 1 77 77 PHE C C 13 175.812 0.000 . 1 . . . . 77 F C . 16514 1
351 . 1 1 77 77 PHE CA C 13 57.971 0.015 . 1 . . . . 77 F CA . 16514 1
352 . 1 1 77 77 PHE CB C 13 39.546 0.006 . 1 . . . . 77 F CB . 16514 1
353 . 1 1 77 77 PHE N N 15 119.988 0.036 . 1 . . . . 77 F N . 16514 1
354 . 1 1 78 78 GLU H H 1 8.193 0.001 . 1 . . . . 78 E H . 16514 1
355 . 1 1 78 78 GLU C C 13 176.715 0.000 . 1 . . . . 78 E C . 16514 1
356 . 1 1 78 78 GLU CA C 13 56.709 0.005 . 1 . . . . 78 E CA . 16514 1
357 . 1 1 78 78 GLU CB C 13 30.433 0.034 . 1 . . . . 78 E CB . 16514 1
358 . 1 1 78 78 GLU N N 15 121.837 0.025 . 1 . . . . 78 E N . 16514 1
359 . 1 1 79 79 THR H H 1 8.148 0.001 . 1 . . . . 79 T H . 16514 1
360 . 1 1 79 79 THR C C 13 175.087 0.000 . 1 . . . . 79 T C . 16514 1
361 . 1 1 79 79 THR CA C 13 62.125 0.002 . 1 . . . . 79 T CA . 16514 1
362 . 1 1 79 79 THR CB C 13 70.132 0.019 . 1 . . . . 79 T CB . 16514 1
363 . 1 1 79 79 THR N N 15 114.683 0.018 . 1 . . . . 79 T N . 16514 1
364 . 1 1 80 80 SER H H 1 8.452 0.001 . 1 . . . . 80 S H . 16514 1
365 . 1 1 80 80 SER C C 13 175.419 0.000 . 1 . . . . 80 S C . 16514 1
366 . 1 1 80 80 SER CA C 13 59.605 0.014 . 1 . . . . 80 S CA . 16514 1
367 . 1 1 80 80 SER CB C 13 63.494 0.010 . 1 . . . . 80 S CB . 16514 1
368 . 1 1 80 80 SER N N 15 117.835 0.007 . 1 . . . . 80 S N . 16514 1
369 . 1 1 81 81 ALA H H 1 8.308 0.003 . 1 . . . . 81 A H . 16514 1
370 . 1 1 81 81 ALA C C 13 178.741 0.000 . 1 . . . . 81 A C . 16514 1
371 . 1 1 81 81 ALA CA C 13 53.855 0.000 . 1 . . . . 81 A CA . 16514 1
372 . 1 1 81 81 ALA CB C 13 18.494 0.000 . 1 . . . . 81 A CB . 16514 1
373 . 1 1 81 81 ALA N N 15 125.216 0.033 . 1 . . . . 81 A N . 16514 1
374 . 1 1 82 82 ALA H H 1 8.019 0.001 . 1 . . . . 82 A H . 16514 1
375 . 1 1 82 82 ALA C C 13 179.072 0.000 . 1 . . . . 82 A C . 16514 1
376 . 1 1 82 82 ALA CA C 13 53.818 0.004 . 1 . . . . 82 A CA . 16514 1
377 . 1 1 82 82 ALA CB C 13 18.835 0.016 . 1 . . . . 82 A CB . 16514 1
378 . 1 1 82 82 ALA N N 15 121.714 0.004 . 1 . . . . 82 A N . 16514 1
379 . 1 1 83 83 LYS H H 1 7.964 0.000 . 1 . . . . 83 K H . 16514 1
380 . 1 1 83 83 LYS C C 13 177.646 0.000 . 1 . . . . 83 K C . 16514 1
381 . 1 1 83 83 LYS CA C 13 57.689 0.023 . 1 . . . . 83 K CA . 16514 1
382 . 1 1 83 83 LYS CB C 13 32.617 0.000 . 1 . . . . 83 K CB . 16514 1
383 . 1 1 83 83 LYS N N 15 118.916 0.069 . 1 . . . . 83 K N . 16514 1
384 . 1 1 84 84 LEU H H 1 7.897 0.000 . 1 . . . . 84 L H . 16514 1
385 . 1 1 84 84 LEU C C 13 177.862 0.000 . 1 . . . . 84 L C . 16514 1
386 . 1 1 84 84 LEU CA C 13 56.050 0.017 . 1 . . . . 84 L CA . 16514 1
387 . 1 1 84 84 LEU CB C 13 42.108 0.038 . 1 . . . . 84 L CB . 16514 1
388 . 1 1 84 84 LEU N N 15 121.005 0.006 . 1 . . . . 84 L N . 16514 1
389 . 1 1 85 85 LYS H H 1 7.950 0.002 . 1 . . . . 85 K H . 16514 1
390 . 1 1 85 85 LYS C C 13 177.076 0.000 . 1 . . . . 85 K C . 16514 1
391 . 1 1 85 85 LYS CA C 13 57.152 0.000 . 1 . . . . 85 K CA . 16514 1
392 . 1 1 85 85 LYS CB C 13 32.762 0.000 . 1 . . . . 85 K CB . 16514 1
393 . 1 1 85 85 LYS N N 15 120.404 0.016 . 1 . . . . 85 K N . 16514 1
394 . 1 1 86 86 ARG H H 1 7.928 0.001 . 1 . . . . 86 R H . 16514 1
395 . 1 1 86 86 ARG C C 13 176.541 0.000 . 1 . . . . 86 R C . 16514 1
396 . 1 1 86 86 ARG CA C 13 56.681 0.072 . 1 . . . . 86 R CA . 16514 1
397 . 1 1 86 86 ARG CB C 13 30.520 0.042 . 1 . . . . 86 R CB . 16514 1
398 . 1 1 86 86 ARG N N 15 120.349 0.006 . 1 . . . . 86 R N . 16514 1
399 . 1 1 87 87 LYS H H 1 7.984 0.001 . 1 . . . . 87 K H . 16514 1
400 . 1 1 87 87 LYS C C 13 176.898 0.000 . 1 . . . . 87 K C . 16514 1
401 . 1 1 87 87 LYS CA C 13 57.280 0.000 . 1 . . . . 87 K CA . 16514 1
402 . 1 1 87 87 LYS CB C 13 32.704 0.026 . 1 . . . . 87 K CB . 16514 1
403 . 1 1 87 87 LYS N N 15 121.013 0.012 . 1 . . . . 87 K N . 16514 1
404 . 1 1 88 88 TYR H H 1 8.000 0.002 . 1 . . . . 88 Y H . 16514 1
405 . 1 1 88 88 TYR C C 13 176.196 0.000 . 1 . . . . 88 Y C . 16514 1
406 . 1 1 88 88 TYR CA C 13 57.489 0.035 . 1 . . . . 88 Y CA . 16514 1
407 . 1 1 88 88 TYR CB C 13 37.672 0.022 . 1 . . . . 88 Y CB . 16514 1
408 . 1 1 88 88 TYR N N 15 118.706 0.025 . 1 . . . . 88 Y N . 16514 1
409 . 1 1 89 89 TRP H H 1 7.680 0.001 . 1 . . . . 89 W H . 16514 1
410 . 1 1 89 89 TRP C C 13 176.317 0.000 . 1 . . . . 89 W C . 16514 1
411 . 1 1 89 89 TRP CA C 13 58.065 0.000 . 1 . . . . 89 W CA . 16514 1
412 . 1 1 89 89 TRP CB C 13 29.048 0.000 . 1 . . . . 89 W CB . 16514 1
413 . 1 1 89 89 TRP N N 15 121.037 0.005 . 1 . . . . 89 W N . 16514 1
414 . 1 1 90 90 TRP H H 1 7.245 0.000 . 1 . . . . 90 W H . 16514 1
415 . 1 1 90 90 TRP C C 13 176.252 0.000 . 1 . . . . 90 W C . 16514 1
416 . 1 1 90 90 TRP CA C 13 57.663 0.044 . 1 . . . . 90 W CA . 16514 1
417 . 1 1 90 90 TRP CB C 13 28.627 0.069 . 1 . . . . 90 W CB . 16514 1
418 . 1 1 90 90 TRP N N 15 120.334 0.003 . 1 . . . . 90 W N . 16514 1
419 . 1 1 91 91 LYS H H 1 7.495 0.001 . 1 . . . . 91 K H . 16514 1
420 . 1 1 91 91 LYS C C 13 176.130 0.000 . 1 . . . . 91 K C . 16514 1
421 . 1 1 91 91 LYS CA C 13 56.949 0.001 . 1 . . . . 91 K CA . 16514 1
422 . 1 1 91 91 LYS CB C 13 32.689 0.019 . 1 . . . . 91 K CB . 16514 1
423 . 1 1 91 91 LYS N N 15 121.302 0.010 . 1 . . . . 91 K N . 16514 1
424 . 1 1 92 92 ASN H H 1 8.041 0.001 . 1 . . . . 92 N H . 16514 1
425 . 1 1 92 92 ASN C C 13 175.089 0.000 . 1 . . . . 92 N C . 16514 1
426 . 1 1 92 92 ASN CA C 13 53.342 0.014 . 1 . . . . 92 N CA . 16514 1
427 . 1 1 92 92 ASN CB C 13 38.809 0.071 . 1 . . . . 92 N CB . 16514 1
428 . 1 1 92 92 ASN N N 15 118.102 0.006 . 1 . . . . 92 N N . 16514 1
429 . 1 1 93 93 LEU H H 1 7.962 0.000 . 1 . . . . 93 L H . 16514 1
430 . 1 1 93 93 LEU C C 13 177.234 0.000 . 1 . . . . 93 L C . 16514 1
431 . 1 1 93 93 LEU CA C 13 55.544 0.008 . 1 . . . . 93 L CA . 16514 1
432 . 1 1 93 93 LEU CB C 13 42.433 0.023 . 1 . . . . 93 L CB . 16514 1
433 . 1 1 93 93 LEU N N 15 121.991 0.009 . 1 . . . . 93 L N . 16514 1
434 . 1 1 94 94 LYS H H 1 8.154 0.003 . 1 . . . . 94 K H . 16514 1
435 . 1 1 94 94 LYS C C 13 176.251 0.000 . 1 . . . . 94 K C . 16514 1
436 . 1 1 94 94 LYS CA C 13 56.377 0.044 . 1 . . . . 94 K CA . 16514 1
437 . 1 1 94 94 LYS CB C 13 32.754 0.000 . 1 . . . . 94 K CB . 16514 1
438 . 1 1 94 94 LYS N N 15 120.992 0.025 . 1 . . . . 94 K N . 16514 1
439 . 1 1 95 95 MET H H 1 8.207 0.001 . 1 . . . . 95 M H . 16514 1
440 . 1 1 95 95 MET C C 13 175.191 0.000 . 1 . . . . 95 M C . 16514 1
441 . 1 1 95 95 MET CA C 13 55.356 0.003 . 1 . . . . 95 M CA . 16514 1
442 . 1 1 95 95 MET CB C 13 32.841 0.016 . 1 . . . . 95 M CB . 16514 1
443 . 1 1 95 95 MET N N 15 121.593 0.010 . 1 . . . . 95 M N . 16514 1
444 . 1 1 96 96 MET H H 1 7.874 0.001 . 1 . . . . 96 M H . 16514 1
445 . 1 1 96 96 MET C C 13 180.700 0.000 . 1 . . . . 96 M C . 16514 1
446 . 1 1 96 96 MET CA C 13 57.026 0.000 . 1 . . . . 96 M CA . 16514 1
447 . 1 1 96 96 MET CB C 13 33.594 0.000 . 1 . . . . 96 M CB . 16514 1
448 . 1 1 96 96 MET N N 15 126.438 0.006 . 1 . . . . 96 M N . 16514 1
stop_
save_