Content for NMR-STAR saveframe, "assigned_chem_shift_list"
save_assigned_chem_shift_list
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list
_Assigned_chem_shift_list.Entry_ID 25750
_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
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference
_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 HNCACB' . . . 25750 1
4 '3D HNCO' . . . 25750 1
5 '3D HN(CA)CO' . . . 25750 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 3 3 MET H H 1 8.561 0.020 . . . . . A 593 MET H . 25750 1
2 . 1 1 3 3 MET HB2 H 1 2.025 0.020 . . . . . A 593 MET HB2 . 25750 1
3 . 1 1 3 3 MET HB3 H 1 1.937 0.020 . . . . . A 593 MET HB3 . 25750 1
4 . 1 1 3 3 MET HG2 H 1 2.512 0.020 . . . . . A 593 MET HG2 . 25750 1
5 . 1 1 3 3 MET HG3 H 1 2.512 0.020 . . . . . A 593 MET HG3 . 25750 1
6 . 1 1 3 3 MET C C 13 172.571 0.300 . . . . . A 593 MET C . 25750 1
7 . 1 1 3 3 MET CA C 13 55.315 0.300 . . . . . A 593 MET CA . 25750 1
8 . 1 1 3 3 MET CB C 13 32.362 0.300 . . . . . A 593 MET CB . 25750 1
9 . 1 1 3 3 MET N N 15 122.785 0.300 . . . . . A 593 MET N . 25750 1
10 . 1 1 4 4 GLU H H 1 8.539 0.020 . . . . . A 594 GLU H . 25750 1
11 . 1 1 4 4 GLU HB2 H 1 2.040 0.020 . . . . . A 594 GLU HB2 . 25750 1
12 . 1 1 4 4 GLU HB3 H 1 1.918 0.020 . . . . . A 594 GLU HB3 . 25750 1
13 . 1 1 4 4 GLU C C 13 173.462 0.300 . . . . . A 594 GLU C . 25750 1
14 . 1 1 4 4 GLU CA C 13 56.350 0.300 . . . . . A 594 GLU CA . 25750 1
15 . 1 1 4 4 GLU CB C 13 29.674 0.300 . . . . . A 594 GLU CB . 25750 1
16 . 1 1 4 4 GLU N N 15 122.917 0.300 . . . . . A 594 GLU N . 25750 1
17 . 1 1 5 5 GLY H H 1 8.387 0.020 . . . . . A 595 GLY H . 25750 1
18 . 1 1 5 5 GLY C C 13 170.285 0.300 . . . . . A 595 GLY C . 25750 1
19 . 1 1 5 5 GLY CA C 13 44.822 0.300 . . . . . A 595 GLY CA . 25750 1
20 . 1 1 5 5 GLY N N 15 109.978 0.300 . . . . . A 595 GLY N . 25750 1
21 . 1 1 6 6 LYS H H 1 8.137 0.020 . . . . . A 596 LYS H . 25750 1
22 . 1 1 6 6 LYS HB2 H 1 1.778 0.020 . . . . . A 596 LYS HB2 . 25750 1
23 . 1 1 6 6 LYS HB3 H 1 1.665 0.020 . . . . . A 596 LYS HB3 . 25750 1
24 . 1 1 6 6 LYS HG2 H 1 1.440 0.020 . . . . . A 596 LYS HG2 . 25750 1
25 . 1 1 6 6 LYS HG3 H 1 1.393 0.020 . . . . . A 596 LYS HG3 . 25750 1
26 . 1 1 6 6 LYS HE2 H 1 3.051 0.020 . . . . . A 596 LYS HE2 . 25750 1
27 . 1 1 6 6 LYS HE3 H 1 3.051 0.020 . . . . . A 596 LYS HE3 . 25750 1
28 . 1 1 6 6 LYS C C 13 171.403 0.300 . . . . . A 596 LYS C . 25750 1
29 . 1 1 6 6 LYS CA C 13 53.942 0.300 . . . . . A 596 LYS CA . 25750 1
30 . 1 1 6 6 LYS CB C 13 31.959 0.300 . . . . . A 596 LYS CB . 25750 1
31 . 1 1 6 6 LYS CG C 13 23.776 0.300 . . . . . A 596 LYS CG . 25750 1
32 . 1 1 6 6 LYS N N 15 121.849 0.300 . . . . . A 596 LYS N . 25750 1
33 . 1 1 7 7 PRO C C 13 173.560 0.300 . . . . . A 597 PRO C . 25750 1
34 . 1 1 7 7 PRO CA C 13 62.855 0.300 . . . . . A 597 PRO CA . 25750 1
35 . 1 1 7 7 PRO CB C 13 32.387 0.300 . . . . . A 597 PRO CB . 25750 1
36 . 1 1 8 8 LYS H H 1 8.382 0.020 . . . . . A 598 LYS H . 25750 1
37 . 1 1 8 8 LYS HB2 H 1 1.768 0.020 . . . . . A 598 LYS HB2 . 25750 1
38 . 1 1 8 8 LYS HB3 H 1 1.712 0.020 . . . . . A 598 LYS HB3 . 25750 1
39 . 1 1 8 8 LYS HG2 H 1 1.421 0.020 . . . . . A 598 LYS HG2 . 25750 1
40 . 1 1 8 8 LYS HG3 H 1 1.365 0.020 . . . . . A 598 LYS HG3 . 25750 1
41 . 1 1 8 8 LYS C C 13 173.209 0.300 . . . . . A 598 LYS C . 25750 1
42 . 1 1 8 8 LYS CA C 13 56.286 0.300 . . . . . A 598 LYS CA . 25750 1
43 . 1 1 8 8 LYS CB C 13 32.387 0.300 . . . . . A 598 LYS CB . 25750 1
44 . 1 1 8 8 LYS CG C 13 23.956 0.300 . . . . . A 598 LYS CG . 25750 1
45 . 1 1 8 8 LYS N N 15 121.659 0.300 . . . . . A 598 LYS N . 25750 1
46 . 1 1 9 9 MET H H 1 8.321 0.020 . . . . . A 599 MET H . 25750 1
47 . 1 1 9 9 MET HB2 H 1 2.002 0.020 . . . . . A 599 MET HB2 . 25750 1
48 . 1 1 9 9 MET HB3 H 1 1.936 0.020 . . . . . A 599 MET HB3 . 25750 1
49 . 1 1 9 9 MET HE1 H 1 2.059 0.020 . . . . . A 599 MET HE1 . 25750 1
50 . 1 1 9 9 MET HE2 H 1 2.059 0.020 . . . . . A 599 MET HE2 . 25750 1
51 . 1 1 9 9 MET HE3 H 1 2.059 0.020 . . . . . A 599 MET HE3 . 25750 1
52 . 1 1 9 9 MET C C 13 172.476 0.300 . . . . . A 599 MET C . 25750 1
53 . 1 1 9 9 MET CA C 13 55.038 0.300 . . . . . A 599 MET CA . 25750 1
54 . 1 1 9 9 MET CB C 13 32.708 0.300 . . . . . A 599 MET CB . 25750 1
55 . 1 1 9 9 MET CE C 13 16.421 0.300 . . . . . A 599 MET CE . 25750 1
56 . 1 1 9 9 MET N N 15 121.884 0.300 . . . . . A 599 MET N . 25750 1
57 . 1 1 10 10 GLU H H 1 8.456 0.020 . . . . . A 600 GLU H . 25750 1
58 . 1 1 10 10 GLU HB2 H 1 2.044 0.020 . . . . . A 600 GLU HB2 . 25750 1
59 . 1 1 10 10 GLU HB3 H 1 1.871 0.020 . . . . . A 600 GLU HB3 . 25750 1
60 . 1 1 10 10 GLU C C 13 171.293 0.300 . . . . . A 600 GLU C . 25750 1
61 . 1 1 10 10 GLU CA C 13 53.952 0.300 . . . . . A 600 GLU CA . 25750 1
62 . 1 1 10 10 GLU CB C 13 28.933 0.300 . . . . . A 600 GLU CB . 25750 1
63 . 1 1 10 10 GLU N N 15 124.028 0.300 . . . . . A 600 GLU N . 25750 1
64 . 1 1 11 11 PRO HG2 H 1 1.994 0.020 . . . . . A 601 PRO HG2 . 25750 1
65 . 1 1 11 11 PRO HG3 H 1 1.966 0.020 . . . . . A 601 PRO HG3 . 25750 1
66 . 1 1 11 11 PRO C C 13 173.683 0.300 . . . . . A 601 PRO C . 25750 1
67 . 1 1 11 11 PRO CA C 13 63.104 0.300 . . . . . A 601 PRO CA . 25750 1
68 . 1 1 11 11 PRO CB C 13 31.571 0.300 . . . . . A 601 PRO CB . 25750 1
69 . 1 1 11 11 PRO CG C 13 26.733 0.300 . . . . . A 601 PRO CG . 25750 1
70 . 1 1 12 12 ALA H H 1 8.446 0.020 . . . . . A 602 ALA H . 25750 1
71 . 1 1 12 12 ALA HB1 H 1 1.379 0.020 . . . . . A 602 ALA HB1 . 25750 1
72 . 1 1 12 12 ALA HB2 H 1 1.379 0.020 . . . . . A 602 ALA HB2 . 25750 1
73 . 1 1 12 12 ALA HB3 H 1 1.379 0.020 . . . . . A 602 ALA HB3 . 25750 1
74 . 1 1 12 12 ALA C C 13 174.973 0.300 . . . . . A 602 ALA C . 25750 1
75 . 1 1 12 12 ALA CA C 13 52.579 0.300 . . . . . A 602 ALA CA . 25750 1
76 . 1 1 12 12 ALA CB C 13 18.396 0.300 . . . . . A 602 ALA CB . 25750 1
77 . 1 1 12 12 ALA N N 15 123.810 0.300 . . . . . A 602 ALA N . 25750 1
78 . 1 1 13 13 ALA H H 1 8.331 0.020 . . . . . A 603 ALA H . 25750 1
79 . 1 1 13 13 ALA HB1 H 1 1.408 0.020 . . . . . A 603 ALA HB1 . 25750 1
80 . 1 1 13 13 ALA HB2 H 1 1.408 0.020 . . . . . A 603 ALA HB2 . 25750 1
81 . 1 1 13 13 ALA HB3 H 1 1.408 0.020 . . . . . A 603 ALA HB3 . 25750 1
82 . 1 1 13 13 ALA C C 13 174.957 0.300 . . . . . A 603 ALA C . 25750 1
83 . 1 1 13 13 ALA CA C 13 52.831 0.300 . . . . . A 603 ALA CA . 25750 1
84 . 1 1 13 13 ALA CB C 13 18.511 0.300 . . . . . A 603 ALA CB . 25750 1
85 . 1 1 13 13 ALA N N 15 123.060 0.300 . . . . . A 603 ALA N . 25750 1
86 . 1 1 14 14 SER H H 1 8.191 0.020 . . . . . A 604 SER H . 25750 1
87 . 1 1 14 14 SER HB2 H 1 4.010 0.020 . . . . . A 604 SER HB2 . 25750 1
88 . 1 1 14 14 SER HB3 H 1 4.010 0.020 . . . . . A 604 SER HB3 . 25750 1
89 . 1 1 14 14 SER C C 13 172.290 0.300 . . . . . A 604 SER C . 25750 1
90 . 1 1 14 14 SER CA C 13 58.565 0.300 . . . . . A 604 SER CA . 25750 1
91 . 1 1 14 14 SER CB C 13 63.553 0.300 . . . . . A 604 SER CB . 25750 1
92 . 1 1 14 14 SER N N 15 113.944 0.300 . . . . . A 604 SER N . 25750 1
93 . 1 1 15 15 SER H H 1 8.442 0.020 . . . . . A 605 SER H . 25750 1
94 . 1 1 15 15 SER HB2 H 1 3.999 0.020 . . . . . A 605 SER HB2 . 25750 1
95 . 1 1 15 15 SER HB3 H 1 3.999 0.020 . . . . . A 605 SER HB3 . 25750 1
96 . 1 1 15 15 SER C C 13 172.251 0.300 . . . . . A 605 SER C . 25750 1
97 . 1 1 15 15 SER CA C 13 59.674 0.300 . . . . . A 605 SER CA . 25750 1
98 . 1 1 15 15 SER CB C 13 63.467 0.300 . . . . . A 605 SER CB . 25750 1
99 . 1 1 15 15 SER N N 15 118.421 0.300 . . . . . A 605 SER N . 25750 1
100 . 1 1 16 16 GLN H H 1 8.361 0.020 . . . . . A 606 GLN H . 25750 1
101 . 1 1 16 16 GLN HB3 H 1 2.068 0.020 . . . . . A 606 GLN HB3 . 25750 1
102 . 1 1 16 16 GLN HG2 H 1 2.508 0.020 . . . . . A 606 GLN HG2 . 25750 1
103 . 1 1 16 16 GLN HG3 H 1 2.398 0.020 . . . . . A 606 GLN HG3 . 25750 1
104 . 1 1 16 16 GLN HE21 H 1 7.563 0.020 . . . . . A 606 GLN HE21 . 25750 1
105 . 1 1 16 16 GLN HE22 H 1 6.775 0.020 . . . . . A 606 GLN HE22 . 25750 1
106 . 1 1 16 16 GLN C C 13 174.393 0.300 . . . . . A 606 GLN C . 25750 1
107 . 1 1 16 16 GLN CA C 13 57.781 0.300 . . . . . A 606 GLN CA . 25750 1
108 . 1 1 16 16 GLN CB C 13 27.901 0.300 . . . . . A 606 GLN CB . 25750 1
109 . 1 1 16 16 GLN CG C 13 33.068 0.300 . . . . . A 606 GLN CG . 25750 1
110 . 1 1 16 16 GLN N N 15 121.762 0.300 . . . . . A 606 GLN N . 25750 1
111 . 1 1 16 16 GLN NE2 N 15 111.537 0.300 . . . . . A 606 GLN NE2 . 25750 1
112 . 1 1 17 17 ALA H H 1 8.189 0.020 . . . . . A 607 ALA H . 25750 1
113 . 1 1 17 17 ALA HB1 H 1 1.435 0.020 . . . . . A 607 ALA HB1 . 25750 1
114 . 1 1 17 17 ALA HB2 H 1 1.435 0.020 . . . . . A 607 ALA HB2 . 25750 1
115 . 1 1 17 17 ALA HB3 H 1 1.435 0.020 . . . . . A 607 ALA HB3 . 25750 1
116 . 1 1 17 17 ALA C C 13 176.737 0.300 . . . . . A 607 ALA C . 25750 1
117 . 1 1 17 17 ALA CA C 13 54.398 0.300 . . . . . A 607 ALA CA . 25750 1
118 . 1 1 17 17 ALA CB C 13 17.591 0.300 . . . . . A 607 ALA CB . 25750 1
119 . 1 1 17 17 ALA N N 15 122.525 0.300 . . . . . A 607 ALA N . 25750 1
120 . 1 1 18 18 ALA H H 1 8.054 0.020 . . . . . A 608 ALA H . 25750 1
121 . 1 1 18 18 ALA HB1 H 1 1.461 0.020 . . . . . A 608 ALA HB1 . 25750 1
122 . 1 1 18 18 ALA HB2 H 1 1.461 0.020 . . . . . A 608 ALA HB2 . 25750 1
123 . 1 1 18 18 ALA HB3 H 1 1.461 0.020 . . . . . A 608 ALA HB3 . 25750 1
124 . 1 1 18 18 ALA C C 13 177.306 0.300 . . . . . A 608 ALA C . 25750 1
125 . 1 1 18 18 ALA CA C 13 54.499 0.300 . . . . . A 608 ALA CA . 25750 1
126 . 1 1 18 18 ALA CB C 13 18.152 0.300 . . . . . A 608 ALA CB . 25750 1
127 . 1 1 18 18 ALA N N 15 121.011 0.300 . . . . . A 608 ALA N . 25750 1
128 . 1 1 19 19 VAL H H 1 7.884 0.020 . . . . . A 609 VAL H . 25750 1
129 . 1 1 19 19 VAL HG11 H 1 0.947 0.020 . . . . . A 609 VAL HG11 . 25750 1
130 . 1 1 19 19 VAL HG12 H 1 0.947 0.020 . . . . . A 609 VAL HG12 . 25750 1
131 . 1 1 19 19 VAL HG13 H 1 0.947 0.020 . . . . . A 609 VAL HG13 . 25750 1
132 . 1 1 19 19 VAL HG21 H 1 0.845 0.020 . . . . . A 609 VAL HG21 . 25750 1
133 . 1 1 19 19 VAL HG22 H 1 0.845 0.020 . . . . . A 609 VAL HG22 . 25750 1
134 . 1 1 19 19 VAL HG23 H 1 0.845 0.020 . . . . . A 609 VAL HG23 . 25750 1
135 . 1 1 19 19 VAL C C 13 174.481 0.300 . . . . . A 609 VAL C . 25750 1
136 . 1 1 19 19 VAL CA C 13 66.272 0.300 . . . . . A 609 VAL CA . 25750 1
137 . 1 1 19 19 VAL CB C 13 30.991 0.300 . . . . . A 609 VAL CB . 25750 1
138 . 1 1 19 19 VAL CG1 C 13 22.334 0.300 . . . . . A 609 VAL CG1 . 25750 1
139 . 1 1 19 19 VAL CG2 C 13 20.618 0.300 . . . . . A 609 VAL CG2 . 25750 1
140 . 1 1 19 19 VAL N N 15 117.809 0.300 . . . . . A 609 VAL N . 25750 1
141 . 1 1 20 20 GLU H H 1 8.050 0.020 . . . . . A 610 GLU H . 25750 1
142 . 1 1 20 20 GLU HG2 H 1 2.414 0.020 . . . . . A 610 GLU HG2 . 25750 1
143 . 1 1 20 20 GLU HG3 H 1 2.263 0.020 . . . . . A 610 GLU HG3 . 25750 1
144 . 1 1 20 20 GLU C C 13 176.189 0.300 . . . . . A 610 GLU C . 25750 1
145 . 1 1 20 20 GLU CA C 13 58.981 0.300 . . . . . A 610 GLU CA . 25750 1
146 . 1 1 20 20 GLU CB C 13 28.249 0.300 . . . . . A 610 GLU CB . 25750 1
147 . 1 1 20 20 GLU CG C 13 34.914 0.300 . . . . . A 610 GLU CG . 25750 1
148 . 1 1 20 20 GLU N N 15 119.578 0.300 . . . . . A 610 GLU N . 25750 1
149 . 1 1 21 21 GLU H H 1 8.084 0.020 . . . . . A 611 GLU H . 25750 1
150 . 1 1 21 21 GLU HG2 H 1 2.415 0.020 . . . . . A 611 GLU HG2 . 25750 1
151 . 1 1 21 21 GLU HG3 H 1 2.255 0.020 . . . . . A 611 GLU HG3 . 25750 1
152 . 1 1 21 21 GLU C C 13 176.102 0.300 . . . . . A 611 GLU C . 25750 1
153 . 1 1 21 21 GLU CA C 13 59.065 0.300 . . . . . A 611 GLU CA . 25750 1
154 . 1 1 21 21 GLU CB C 13 28.407 0.300 . . . . . A 611 GLU CB . 25750 1
155 . 1 1 21 21 GLU CG C 13 35.166 0.300 . . . . . A 611 GLU CG . 25750 1
156 . 1 1 21 21 GLU N N 15 119.896 0.300 . . . . . A 611 GLU N . 25750 1
157 . 1 1 22 22 LEU H H 1 7.890 0.020 . . . . . A 612 LEU H . 25750 1
158 . 1 1 22 22 LEU HD11 H 1 0.877 0.020 . . . . . A 612 LEU HD11 . 25750 1
159 . 1 1 22 22 LEU HD12 H 1 0.877 0.020 . . . . . A 612 LEU HD12 . 25750 1
160 . 1 1 22 22 LEU HD13 H 1 0.877 0.020 . . . . . A 612 LEU HD13 . 25750 1
161 . 1 1 22 22 LEU HD21 H 1 0.843 0.020 . . . . . A 612 LEU HD21 . 25750 1
162 . 1 1 22 22 LEU HD22 H 1 0.843 0.020 . . . . . A 612 LEU HD22 . 25750 1
163 . 1 1 22 22 LEU HD23 H 1 0.843 0.020 . . . . . A 612 LEU HD23 . 25750 1
164 . 1 1 22 22 LEU C C 13 175.499 0.300 . . . . . A 612 LEU C . 25750 1
165 . 1 1 22 22 LEU CA C 13 57.766 0.300 . . . . . A 612 LEU CA . 25750 1
166 . 1 1 22 22 LEU CB C 13 41.673 0.300 . . . . . A 612 LEU CB . 25750 1
167 . 1 1 22 22 LEU CD1 C 13 25.084 0.300 . . . . . A 612 LEU CD1 . 25750 1
168 . 1 1 22 22 LEU CD2 C 13 23.471 0.300 . . . . . A 612 LEU CD2 . 25750 1
169 . 1 1 22 22 LEU N N 15 120.255 0.300 . . . . . A 612 LEU N . 25750 1
170 . 1 1 23 23 ARG H H 1 8.664 0.020 . . . . . A 613 ARG H . 25750 1
171 . 1 1 23 23 ARG HG2 H 1 1.867 0.020 . . . . . A 613 ARG HG2 . 25750 1
172 . 1 1 23 23 ARG HG3 H 1 1.591 0.020 . . . . . A 613 ARG HG3 . 25750 1
173 . 1 1 23 23 ARG HE H 1 7.416 0.020 . . . . . A 613 ARG HE . 25750 1
174 . 1 1 23 23 ARG C C 13 176.375 0.300 . . . . . A 613 ARG C . 25750 1
175 . 1 1 23 23 ARG CA C 13 60.238 0.300 . . . . . A 613 ARG CA . 25750 1
176 . 1 1 23 23 ARG CB C 13 29.383 0.300 . . . . . A 613 ARG CB . 25750 1
177 . 1 1 23 23 ARG CG C 13 27.430 0.300 . . . . . A 613 ARG CG . 25750 1
178 . 1 1 23 23 ARG N N 15 119.566 0.300 . . . . . A 613 ARG N . 25750 1
179 . 1 1 24 24 THR H H 1 8.094 0.020 . . . . . A 614 THR H . 25750 1
180 . 1 1 24 24 THR HG21 H 1 1.243 0.020 . . . . . A 614 THR HG21 . 25750 1
181 . 1 1 24 24 THR HG22 H 1 1.243 0.020 . . . . . A 614 THR HG22 . 25750 1
182 . 1 1 24 24 THR HG23 H 1 1.243 0.020 . . . . . A 614 THR HG23 . 25750 1
183 . 1 1 24 24 THR C C 13 173.276 0.300 . . . . . A 614 THR C . 25750 1
184 . 1 1 24 24 THR CA C 13 66.523 0.300 . . . . . A 614 THR CA . 25750 1
185 . 1 1 24 24 THR CB C 13 68.157 0.300 . . . . . A 614 THR CB . 25750 1
186 . 1 1 24 24 THR CG2 C 13 21.221 0.300 . . . . . A 614 THR CG2 . 25750 1
187 . 1 1 24 24 THR N N 15 116.563 0.300 . . . . . A 614 THR N . 25750 1
188 . 1 1 25 25 GLN H H 1 8.130 0.020 . . . . . A 615 GLN H . 25750 1
189 . 1 1 25 25 GLN HE21 H 1 7.461 0.020 . . . . . A 615 GLN HE21 . 25750 1
190 . 1 1 25 25 GLN HE22 H 1 6.603 0.020 . . . . . A 615 GLN HE22 . 25750 1
191 . 1 1 25 25 GLN C C 13 176.025 0.300 . . . . . A 615 GLN C . 25750 1
192 . 1 1 25 25 GLN CA C 13 59.149 0.300 . . . . . A 615 GLN CA . 25750 1
193 . 1 1 25 25 GLN CB C 13 28.249 0.300 . . . . . A 615 GLN CB . 25750 1
194 . 1 1 25 25 GLN N N 15 121.133 0.300 . . . . . A 615 GLN N . 25750 1
195 . 1 1 25 25 GLN NE2 N 15 110.456 0.300 . . . . . A 615 GLN NE2 . 25750 1
196 . 1 1 26 26 VAL H H 1 8.663 0.020 . . . . . A 616 VAL H . 25750 1
197 . 1 1 26 26 VAL HG11 H 1 0.938 0.020 . . . . . A 616 VAL HG11 . 25750 1
198 . 1 1 26 26 VAL HG12 H 1 0.938 0.020 . . . . . A 616 VAL HG12 . 25750 1
199 . 1 1 26 26 VAL HG13 H 1 0.938 0.020 . . . . . A 616 VAL HG13 . 25750 1
200 . 1 1 26 26 VAL HG21 H 1 0.894 0.020 . . . . . A 616 VAL HG21 . 25750 1
201 . 1 1 26 26 VAL HG22 H 1 0.894 0.020 . . . . . A 616 VAL HG22 . 25750 1
202 . 1 1 26 26 VAL HG23 H 1 0.894 0.020 . . . . . A 616 VAL HG23 . 25750 1
203 . 1 1 26 26 VAL C C 13 174.130 0.300 . . . . . A 616 VAL C . 25750 1
204 . 1 1 26 26 VAL CA C 13 67.172 0.300 . . . . . A 616 VAL CA . 25750 1
205 . 1 1 26 26 VAL CB C 13 30.864 0.300 . . . . . A 616 VAL CB . 25750 1
206 . 1 1 26 26 VAL CG1 C 13 23.293 0.300 . . . . . A 616 VAL CG1 . 25750 1
207 . 1 1 26 26 VAL CG2 C 13 20.823 0.300 . . . . . A 616 VAL CG2 . 25750 1
208 . 1 1 26 26 VAL N N 15 119.974 0.300 . . . . . A 616 VAL N . 25750 1
209 . 1 1 27 27 ARG H H 1 7.942 0.020 . . . . . A 617 ARG H . 25750 1
210 . 1 1 27 27 ARG HG2 H 1 1.805 0.020 . . . . . A 617 ARG HG2 . 25750 1
211 . 1 1 27 27 ARG HG3 H 1 1.627 0.020 . . . . . A 617 ARG HG3 . 25750 1
212 . 1 1 27 27 ARG HE H 1 7.254 0.020 . . . . . A 617 ARG HE . 25750 1
213 . 1 1 27 27 ARG C C 13 176.463 0.300 . . . . . A 617 ARG C . 25750 1
214 . 1 1 27 27 ARG CA C 13 59.903 0.300 . . . . . A 617 ARG CA . 25750 1
215 . 1 1 27 27 ARG CB C 13 29.226 0.300 . . . . . A 617 ARG CB . 25750 1
216 . 1 1 27 27 ARG CG C 13 26.989 0.300 . . . . . A 617 ARG CG . 25750 1
217 . 1 1 27 27 ARG N N 15 120.178 0.300 . . . . . A 617 ARG N . 25750 1
218 . 1 1 28 28 GLU H H 1 8.206 0.020 . . . . . A 618 GLU H . 25750 1
219 . 1 1 28 28 GLU HG2 H 1 2.494 0.020 . . . . . A 618 GLU HG2 . 25750 1
220 . 1 1 28 28 GLU HG3 H 1 2.277 0.020 . . . . . A 618 GLU HG3 . 25750 1
221 . 1 1 28 28 GLU C C 13 176.091 0.300 . . . . . A 618 GLU C . 25750 1
222 . 1 1 28 28 GLU CA C 13 59.107 0.300 . . . . . A 618 GLU CA . 25750 1
223 . 1 1 28 28 GLU CB C 13 28.470 0.300 . . . . . A 618 GLU CB . 25750 1
224 . 1 1 28 28 GLU CG C 13 34.848 0.300 . . . . . A 618 GLU CG . 25750 1
225 . 1 1 28 28 GLU N N 15 120.055 0.300 . . . . . A 618 GLU N . 25750 1
226 . 1 1 29 29 LEU H H 1 8.339 0.020 . . . . . A 619 LEU H . 25750 1
227 . 1 1 29 29 LEU HD21 H 1 0.840 0.020 . . . . . A 619 LEU HD21 . 25750 1
228 . 1 1 29 29 LEU HD22 H 1 0.840 0.020 . . . . . A 619 LEU HD22 . 25750 1
229 . 1 1 29 29 LEU HD23 H 1 0.840 0.020 . . . . . A 619 LEU HD23 . 25750 1
230 . 1 1 29 29 LEU C C 13 175.412 0.300 . . . . . A 619 LEU C . 25750 1
231 . 1 1 29 29 LEU CA C 13 57.792 0.300 . . . . . A 619 LEU CA . 25750 1
232 . 1 1 29 29 LEU CB C 13 41.028 0.300 . . . . . A 619 LEU CB . 25750 1
233 . 1 1 29 29 LEU CD2 C 13 22.881 0.300 . . . . . A 619 LEU CD2 . 25750 1
234 . 1 1 29 29 LEU N N 15 119.596 0.300 . . . . . A 619 LEU N . 25750 1
235 . 1 1 30 30 ARG H H 1 8.405 0.020 . . . . . A 620 ARG H . 25750 1
236 . 1 1 30 30 ARG HG2 H 1 1.665 0.020 . . . . . A 620 ARG HG2 . 25750 1
237 . 1 1 30 30 ARG HG3 H 1 1.646 0.020 . . . . . A 620 ARG HG3 . 25750 1
238 . 1 1 30 30 ARG HE H 1 7.497 0.020 . . . . . A 620 ARG HE . 25750 1
239 . 1 1 30 30 ARG C C 13 175.160 0.300 . . . . . A 620 ARG C . 25750 1
240 . 1 1 30 30 ARG CA C 13 59.949 0.300 . . . . . A 620 ARG CA . 25750 1
241 . 1 1 30 30 ARG CB C 13 29.042 0.300 . . . . . A 620 ARG CB . 25750 1
242 . 1 1 30 30 ARG CG C 13 27.220 0.300 . . . . . A 620 ARG CG . 25750 1
243 . 1 1 30 30 ARG N N 15 118.253 0.300 . . . . . A 620 ARG N . 25750 1
244 . 1 1 31 31 SER H H 1 7.862 0.020 . . . . . A 621 SER H . 25750 1
245 . 1 1 31 31 SER HB2 H 1 4.089 0.020 . . . . . A 621 SER HB2 . 25750 1
246 . 1 1 31 31 SER HB3 H 1 4.089 0.020 . . . . . A 621 SER HB3 . 25750 1
247 . 1 1 31 31 SER C C 13 174.152 0.300 . . . . . A 621 SER C . 25750 1
248 . 1 1 31 31 SER CA C 13 61.594 0.300 . . . . . A 621 SER CA . 25750 1
249 . 1 1 31 31 SER CB C 13 62.577 0.300 . . . . . A 621 SER CB . 25750 1
250 . 1 1 31 31 SER N N 15 114.318 0.300 . . . . . A 621 SER N . 25750 1
251 . 1 1 32 32 ILE H H 1 8.331 0.020 . . . . . A 622 ILE H . 25750 1
252 . 1 1 32 32 ILE HG21 H 1 0.924 0.020 . . . . . A 622 ILE HG21 . 25750 1
253 . 1 1 32 32 ILE HG22 H 1 0.924 0.020 . . . . . A 622 ILE HG22 . 25750 1
254 . 1 1 32 32 ILE HG23 H 1 0.924 0.020 . . . . . A 622 ILE HG23 . 25750 1
255 . 1 1 32 32 ILE HD11 H 1 0.831 0.020 . . . . . A 622 ILE HD11 . 25750 1
256 . 1 1 32 32 ILE HD12 H 1 0.831 0.020 . . . . . A 622 ILE HD12 . 25750 1
257 . 1 1 32 32 ILE HD13 H 1 0.831 0.020 . . . . . A 622 ILE HD13 . 25750 1
258 . 1 1 32 32 ILE C C 13 175.893 0.300 . . . . . A 622 ILE C . 25750 1
259 . 1 1 32 32 ILE CA C 13 65.332 0.300 . . . . . A 622 ILE CA . 25750 1
260 . 1 1 32 32 ILE CB C 13 37.774 0.300 . . . . . A 622 ILE CB . 25750 1
261 . 1 1 32 32 ILE CG2 C 13 16.972 0.300 . . . . . A 622 ILE CG2 . 25750 1
262 . 1 1 32 32 ILE CD1 C 13 12.729 0.300 . . . . . A 622 ILE CD1 . 25750 1
263 . 1 1 32 32 ILE N N 15 123.691 0.300 . . . . . A 622 ILE N . 25750 1
264 . 1 1 33 33 ILE H H 1 8.351 0.020 . . . . . A 623 ILE H . 25750 1
265 . 1 1 33 33 ILE HG21 H 1 0.915 0.020 . . . . . A 623 ILE HG21 . 25750 1
266 . 1 1 33 33 ILE HG22 H 1 0.915 0.020 . . . . . A 623 ILE HG22 . 25750 1
267 . 1 1 33 33 ILE HG23 H 1 0.915 0.020 . . . . . A 623 ILE HG23 . 25750 1
268 . 1 1 33 33 ILE HD11 H 1 0.849 0.020 . . . . . A 623 ILE HD11 . 25750 1
269 . 1 1 33 33 ILE HD12 H 1 0.849 0.020 . . . . . A 623 ILE HD12 . 25750 1
270 . 1 1 33 33 ILE HD13 H 1 0.849 0.020 . . . . . A 623 ILE HD13 . 25750 1
271 . 1 1 33 33 ILE C C 13 174.404 0.300 . . . . . A 623 ILE C . 25750 1
272 . 1 1 33 33 ILE CA C 13 65.140 0.300 . . . . . A 623 ILE CA . 25750 1
273 . 1 1 33 33 ILE CB C 13 37.267 0.300 . . . . . A 623 ILE CB . 25750 1
274 . 1 1 33 33 ILE CG2 C 13 17.042 0.300 . . . . . A 623 ILE CG2 . 25750 1
275 . 1 1 33 33 ILE CD1 C 13 13.940 0.300 . . . . . A 623 ILE CD1 . 25750 1
276 . 1 1 33 33 ILE N N 15 121.094 0.300 . . . . . A 623 ILE N . 25750 1
277 . 1 1 34 34 GLU H H 1 8.251 0.020 . . . . . A 624 GLU H . 25750 1
278 . 1 1 34 34 GLU HG2 H 1 2.490 0.020 . . . . . A 624 GLU HG2 . 25750 1
279 . 1 1 34 34 GLU HG3 H 1 2.274 0.020 . . . . . A 624 GLU HG3 . 25750 1
280 . 1 1 34 34 GLU C C 13 176.485 0.300 . . . . . A 624 GLU C . 25750 1
281 . 1 1 34 34 GLU CA C 13 59.415 0.300 . . . . . A 624 GLU CA . 25750 1
282 . 1 1 34 34 GLU CB C 13 28.203 0.300 . . . . . A 624 GLU CB . 25750 1
283 . 1 1 34 34 GLU CG C 13 35.122 0.300 . . . . . A 624 GLU CG . 25750 1
284 . 1 1 34 34 GLU N N 15 119.352 0.300 . . . . . A 624 GLU N . 25750 1
285 . 1 1 35 35 THR H H 1 8.202 0.020 . . . . . A 625 THR H . 25750 1
286 . 1 1 35 35 THR HG21 H 1 1.281 0.020 . . . . . A 625 THR HG21 . 25750 1
287 . 1 1 35 35 THR HG22 H 1 1.281 0.020 . . . . . A 625 THR HG22 . 25750 1
288 . 1 1 35 35 THR HG23 H 1 1.281 0.020 . . . . . A 625 THR HG23 . 25750 1
289 . 1 1 35 35 THR C C 13 173.560 0.300 . . . . . A 625 THR C . 25750 1
290 . 1 1 35 35 THR CA C 13 66.507 0.300 . . . . . A 625 THR CA . 25750 1
291 . 1 1 35 35 THR CB C 13 68.259 0.300 . . . . . A 625 THR CB . 25750 1
292 . 1 1 35 35 THR CG2 C 13 21.046 0.300 . . . . . A 625 THR CG2 . 25750 1
293 . 1 1 35 35 THR N N 15 116.447 0.300 . . . . . A 625 THR N . 25750 1
294 . 1 1 36 36 MET H H 1 8.495 0.020 . . . . . A 626 MET H . 25750 1
295 . 1 1 36 36 MET HG2 H 1 2.642 0.020 . . . . . A 626 MET HG2 . 25750 1
296 . 1 1 36 36 MET HG3 H 1 2.642 0.020 . . . . . A 626 MET HG3 . 25750 1
297 . 1 1 36 36 MET HE1 H 1 2.035 0.020 . . . . . A 626 MET HE1 . 25750 1
298 . 1 1 36 36 MET HE2 H 1 2.035 0.020 . . . . . A 626 MET HE2 . 25750 1
299 . 1 1 36 36 MET HE3 H 1 2.035 0.020 . . . . . A 626 MET HE3 . 25750 1
300 . 1 1 36 36 MET C C 13 175.444 0.300 . . . . . A 626 MET C . 25750 1
301 . 1 1 36 36 MET CA C 13 59.415 0.300 . . . . . A 626 MET CA . 25750 1
302 . 1 1 36 36 MET CB C 13 32.915 0.300 . . . . . A 626 MET CB . 25750 1
303 . 1 1 36 36 MET CG C 13 31.003 0.300 . . . . . A 626 MET CG . 25750 1
304 . 1 1 36 36 MET CE C 13 15.976 0.300 . . . . . A 626 MET CE . 25750 1
305 . 1 1 36 36 MET N N 15 122.740 0.300 . . . . . A 626 MET N . 25750 1
306 . 1 1 37 37 LYS H H 1 8.580 0.020 . . . . . A 627 LYS H . 25750 1
307 . 1 1 37 37 LYS HB3 H 1 1.983 0.020 . . . . . A 627 LYS HB3 . 25750 1
308 . 1 1 37 37 LYS HG2 H 1 1.680 0.020 . . . . . A 627 LYS HG2 . 25750 1
309 . 1 1 37 37 LYS HG3 H 1 1.400 0.020 . . . . . A 627 LYS HG3 . 25750 1
310 . 1 1 37 37 LYS C C 13 176.080 0.300 . . . . . A 627 LYS C . 25750 1
311 . 1 1 37 37 LYS CA C 13 59.971 0.300 . . . . . A 627 LYS CA . 25750 1
312 . 1 1 37 37 LYS CB C 13 31.955 0.300 . . . . . A 627 LYS CB . 25750 1
313 . 1 1 37 37 LYS CG C 13 24.741 0.300 . . . . . A 627 LYS CG . 25750 1
314 . 1 1 37 37 LYS N N 15 120.543 0.300 . . . . . A 627 LYS N . 25750 1
315 . 1 1 38 38 ASP H H 1 7.762 0.020 . . . . . A 628 ASP H . 25750 1
316 . 1 1 38 38 ASP C C 13 175.236 0.300 . . . . . A 628 ASP C . 25750 1
317 . 1 1 38 38 ASP CA C 13 57.490 0.300 . . . . . A 628 ASP CA . 25750 1
318 . 1 1 38 38 ASP CB C 13 40.839 0.300 . . . . . A 628 ASP CB . 25750 1
319 . 1 1 38 38 ASP N N 15 119.427 0.300 . . . . . A 628 ASP N . 25750 1
320 . 1 1 39 39 GLN H H 1 8.456 0.020 . . . . . A 629 GLN H . 25750 1
321 . 1 1 39 39 GLN HG2 H 1 2.508 0.020 . . . . . A 629 GLN HG2 . 25750 1
322 . 1 1 39 39 GLN HG3 H 1 2.396 0.020 . . . . . A 629 GLN HG3 . 25750 1
323 . 1 1 39 39 GLN HE21 H 1 7.563 0.020 . . . . . A 629 GLN HE21 . 25750 1
324 . 1 1 39 39 GLN HE22 H 1 6.746 0.020 . . . . . A 629 GLN HE22 . 25750 1
325 . 1 1 39 39 GLN CA C 13 58.891 0.300 . . . . . A 629 GLN CA . 25750 1
326 . 1 1 39 39 GLN CB C 13 27.688 0.300 . . . . . A 629 GLN CB . 25750 1
327 . 1 1 39 39 GLN CG C 13 33.041 0.300 . . . . . A 629 GLN CG . 25750 1
328 . 1 1 39 39 GLN N N 15 119.617 0.300 . . . . . A 629 GLN N . 25750 1
329 . 1 1 39 39 GLN NE2 N 15 111.508 0.300 . . . . . A 629 GLN NE2 . 25750 1
330 . 1 1 40 40 GLN H H 1 8.548 0.020 . . . . . A 630 GLN H . 25750 1
331 . 1 1 40 40 GLN HE21 H 1 7.671 0.020 . . . . . A 630 GLN HE21 . 25750 1
332 . 1 1 40 40 GLN HE22 H 1 6.274 0.020 . . . . . A 630 GLN HE22 . 25750 1
333 . 1 1 40 40 GLN C C 13 174.973 0.300 . . . . . A 630 GLN C . 25750 1
334 . 1 1 40 40 GLN CA C 13 59.140 0.300 . . . . . A 630 GLN CA . 25750 1
335 . 1 1 40 40 GLN CB C 13 27.563 0.300 . . . . . A 630 GLN CB . 25750 1
336 . 1 1 40 40 GLN N N 15 119.192 0.300 . . . . . A 630 GLN N . 25750 1
337 . 1 1 40 40 GLN NE2 N 15 107.448 0.300 . . . . . A 630 GLN NE2 . 25750 1
338 . 1 1 41 41 LYS H H 1 7.722 0.020 . . . . . A 631 LYS H . 25750 1
339 . 1 1 41 41 LYS HB3 H 1 1.987 0.020 . . . . . A 631 LYS HB3 . 25750 1
340 . 1 1 41 41 LYS HG2 H 1 1.609 0.020 . . . . . A 631 LYS HG2 . 25750 1
341 . 1 1 41 41 LYS HG3 H 1 1.440 0.020 . . . . . A 631 LYS HG3 . 25750 1
342 . 1 1 41 41 LYS C C 13 176.222 0.300 . . . . . A 631 LYS C . 25750 1
343 . 1 1 41 41 LYS CA C 13 59.409 0.300 . . . . . A 631 LYS CA . 25750 1
344 . 1 1 41 41 LYS CB C 13 31.684 0.300 . . . . . A 631 LYS CB . 25750 1
345 . 1 1 41 41 LYS CG C 13 24.191 0.300 . . . . . A 631 LYS CG . 25750 1
346 . 1 1 41 41 LYS N N 15 118.024 0.300 . . . . . A 631 LYS N . 25750 1
347 . 1 1 42 42 ARG H H 1 7.773 0.020 . . . . . A 632 ARG H . 25750 1
348 . 1 1 42 42 ARG HG2 H 1 1.796 0.020 . . . . . A 632 ARG HG2 . 25750 1
349 . 1 1 42 42 ARG HG3 H 1 1.608 0.020 . . . . . A 632 ARG HG3 . 25750 1
350 . 1 1 42 42 ARG HE H 1 7.381 0.020 . . . . . A 632 ARG HE . 25750 1
351 . 1 1 42 42 ARG C C 13 176.156 0.300 . . . . . A 632 ARG C . 25750 1
352 . 1 1 42 42 ARG CA C 13 59.409 0.300 . . . . . A 632 ARG CA . 25750 1
353 . 1 1 42 42 ARG CB C 13 29.624 0.300 . . . . . A 632 ARG CB . 25750 1
354 . 1 1 42 42 ARG CG C 13 27.353 0.300 . . . . . A 632 ARG CG . 25750 1
355 . 1 1 42 42 ARG N N 15 118.369 0.300 . . . . . A 632 ARG N . 25750 1
356 . 1 1 43 43 GLU H H 1 8.391 0.020 . . . . . A 633 GLU H . 25750 1
357 . 1 1 43 43 GLU C C 13 175.883 0.300 . . . . . A 633 GLU C . 25750 1
358 . 1 1 43 43 GLU CA C 13 59.014 0.300 . . . . . A 633 GLU CA . 25750 1
359 . 1 1 43 43 GLU CB C 13 28.284 0.300 . . . . . A 633 GLU CB . 25750 1
360 . 1 1 43 43 GLU N N 15 119.542 0.300 . . . . . A 633 GLU N . 25750 1
361 . 1 1 44 44 ILE H H 1 8.363 0.020 . . . . . A 634 ILE H . 25750 1
362 . 1 1 44 44 ILE HG21 H 1 0.904 0.020 . . . . . A 634 ILE HG21 . 25750 1
363 . 1 1 44 44 ILE HG22 H 1 0.904 0.020 . . . . . A 634 ILE HG22 . 25750 1
364 . 1 1 44 44 ILE HG23 H 1 0.904 0.020 . . . . . A 634 ILE HG23 . 25750 1
365 . 1 1 44 44 ILE HD11 H 1 0.703 0.020 . . . . . A 634 ILE HD11 . 25750 1
366 . 1 1 44 44 ILE HD12 H 1 0.703 0.020 . . . . . A 634 ILE HD12 . 25750 1
367 . 1 1 44 44 ILE HD13 H 1 0.703 0.020 . . . . . A 634 ILE HD13 . 25750 1
368 . 1 1 44 44 ILE C C 13 174.437 0.300 . . . . . A 634 ILE C . 25750 1
369 . 1 1 44 44 ILE CA C 13 63.516 0.300 . . . . . A 634 ILE CA . 25750 1
370 . 1 1 44 44 ILE CB C 13 35.626 0.300 . . . . . A 634 ILE CB . 25750 1
371 . 1 1 44 44 ILE CG2 C 13 16.703 0.300 . . . . . A 634 ILE CG2 . 25750 1
372 . 1 1 44 44 ILE CD1 C 13 10.142 0.300 . . . . . A 634 ILE CD1 . 25750 1
373 . 1 1 44 44 ILE N N 15 119.324 0.300 . . . . . A 634 ILE N . 25750 1
374 . 1 1 45 45 LYS H H 1 7.844 0.020 . . . . . A 635 LYS H . 25750 1
375 . 1 1 45 45 LYS HB3 H 1 1.955 0.020 . . . . . A 635 LYS HB3 . 25750 1
376 . 1 1 45 45 LYS HG2 H 1 1.543 0.020 . . . . . A 635 LYS HG2 . 25750 1
377 . 1 1 45 45 LYS HG3 H 1 1.433 0.020 . . . . . A 635 LYS HG3 . 25750 1
378 . 1 1 45 45 LYS C C 13 176.397 0.300 . . . . . A 635 LYS C . 25750 1
379 . 1 1 45 45 LYS CA C 13 59.858 0.300 . . . . . A 635 LYS CA . 25750 1
380 . 1 1 45 45 LYS CB C 13 31.484 0.300 . . . . . A 635 LYS CB . 25750 1
381 . 1 1 45 45 LYS CG C 13 24.326 0.300 . . . . . A 635 LYS CG . 25750 1
382 . 1 1 45 45 LYS N N 15 119.273 0.300 . . . . . A 635 LYS N . 25750 1
383 . 1 1 46 46 GLN H H 1 7.894 0.020 . . . . . A 636 GLN H . 25750 1
384 . 1 1 46 46 GLN HE21 H 1 7.435 0.020 . . . . . A 636 GLN HE21 . 25750 1
385 . 1 1 46 46 GLN HE22 H 1 6.816 0.020 . . . . . A 636 GLN HE22 . 25750 1
386 . 1 1 46 46 GLN C C 13 175.532 0.300 . . . . . A 636 GLN C . 25750 1
387 . 1 1 46 46 GLN CA C 13 58.878 0.300 . . . . . A 636 GLN CA . 25750 1
388 . 1 1 46 46 GLN CB C 13 27.688 0.300 . . . . . A 636 GLN CB . 25750 1
389 . 1 1 46 46 GLN N N 15 119.213 0.300 . . . . . A 636 GLN N . 25750 1
390 . 1 1 46 46 GLN NE2 N 15 111.160 0.300 . . . . . A 636 GLN NE2 . 25750 1
391 . 1 1 47 47 LEU H H 1 8.093 0.020 . . . . . A 637 LEU H . 25750 1
392 . 1 1 47 47 LEU HD11 H 1 0.886 0.020 . . . . . A 637 LEU HD11 . 25750 1
393 . 1 1 47 47 LEU HD12 H 1 0.886 0.020 . . . . . A 637 LEU HD12 . 25750 1
394 . 1 1 47 47 LEU HD13 H 1 0.886 0.020 . . . . . A 637 LEU HD13 . 25750 1
395 . 1 1 47 47 LEU HD21 H 1 0.840 0.020 . . . . . A 637 LEU HD21 . 25750 1
396 . 1 1 47 47 LEU HD22 H 1 0.840 0.020 . . . . . A 637 LEU HD22 . 25750 1
397 . 1 1 47 47 LEU HD23 H 1 0.840 0.020 . . . . . A 637 LEU HD23 . 25750 1
398 . 1 1 47 47 LEU C C 13 175.937 0.300 . . . . . A 637 LEU C . 25750 1
399 . 1 1 47 47 LEU CA C 13 58.486 0.300 . . . . . A 637 LEU CA . 25750 1
400 . 1 1 47 47 LEU CB C 13 41.412 0.300 . . . . . A 637 LEU CB . 25750 1
401 . 1 1 47 47 LEU CD1 C 13 25.293 0.300 . . . . . A 637 LEU CD1 . 25750 1
402 . 1 1 47 47 LEU CD2 C 13 23.501 0.300 . . . . . A 637 LEU CD2 . 25750 1
403 . 1 1 47 47 LEU N N 15 121.234 0.300 . . . . . A 637 LEU N . 25750 1
404 . 1 1 48 48 LEU H H 1 8.795 0.020 . . . . . A 638 LEU H . 25750 1
405 . 1 1 48 48 LEU HD11 H 1 0.859 0.020 . . . . . A 638 LEU HD11 . 25750 1
406 . 1 1 48 48 LEU HD12 H 1 0.859 0.020 . . . . . A 638 LEU HD12 . 25750 1
407 . 1 1 48 48 LEU HD13 H 1 0.859 0.020 . . . . . A 638 LEU HD13 . 25750 1
408 . 1 1 48 48 LEU HD21 H 1 0.853 0.020 . . . . . A 638 LEU HD21 . 25750 1
409 . 1 1 48 48 LEU HD22 H 1 0.853 0.020 . . . . . A 638 LEU HD22 . 25750 1
410 . 1 1 48 48 LEU HD23 H 1 0.853 0.020 . . . . . A 638 LEU HD23 . 25750 1
411 . 1 1 48 48 LEU C C 13 176.912 0.300 . . . . . A 638 LEU C . 25750 1
412 . 1 1 48 48 LEU CA C 13 58.051 0.300 . . . . . A 638 LEU CA . 25750 1
413 . 1 1 48 48 LEU CB C 13 40.846 0.300 . . . . . A 638 LEU CB . 25750 1
414 . 1 1 48 48 LEU CD1 C 13 24.677 0.300 . . . . . A 638 LEU CD1 . 25750 1
415 . 1 1 48 48 LEU CD2 C 13 22.679 0.300 . . . . . A 638 LEU CD2 . 25750 1
416 . 1 1 48 48 LEU N N 15 118.970 0.300 . . . . . A 638 LEU N . 25750 1
417 . 1 1 49 49 SER H H 1 8.145 0.020 . . . . . A 639 SER H . 25750 1
418 . 1 1 49 49 SER HB2 H 1 4.087 0.020 . . . . . A 639 SER HB2 . 25750 1
419 . 1 1 49 49 SER HB3 H 1 4.087 0.020 . . . . . A 639 SER HB3 . 25750 1
420 . 1 1 49 49 SER C C 13 174.130 0.300 . . . . . A 639 SER C . 25750 1
421 . 1 1 49 49 SER CA C 13 61.609 0.300 . . . . . A 639 SER CA . 25750 1
422 . 1 1 49 49 SER CB C 13 62.457 0.300 . . . . . A 639 SER CB . 25750 1
423 . 1 1 49 49 SER N N 15 115.296 0.300 . . . . . A 639 SER N . 25750 1
424 . 1 1 50 50 GLU H H 1 8.123 0.020 . . . . . A 640 GLU H . 25750 1
425 . 1 1 50 50 GLU C C 13 176.529 0.300 . . . . . A 640 GLU C . 25750 1
426 . 1 1 50 50 GLU CA C 13 59.157 0.300 . . . . . A 640 GLU CA . 25750 1
427 . 1 1 50 50 GLU CB C 13 28.003 0.300 . . . . . A 640 GLU CB . 25750 1
428 . 1 1 50 50 GLU N N 15 122.437 0.300 . . . . . A 640 GLU N . 25750 1
429 . 1 1 51 51 LEU H H 1 8.663 0.020 . . . . . A 641 LEU H . 25750 1
430 . 1 1 51 51 LEU HD11 H 1 0.858 0.020 . . . . . A 641 LEU HD11 . 25750 1
431 . 1 1 51 51 LEU HD12 H 1 0.858 0.020 . . . . . A 641 LEU HD12 . 25750 1
432 . 1 1 51 51 LEU HD13 H 1 0.858 0.020 . . . . . A 641 LEU HD13 . 25750 1
433 . 1 1 51 51 LEU C C 13 175.718 0.300 . . . . . A 641 LEU C . 25750 1
434 . 1 1 51 51 LEU CA C 13 58.037 0.300 . . . . . A 641 LEU CA . 25750 1
435 . 1 1 51 51 LEU CB C 13 40.591 0.300 . . . . . A 641 LEU CB . 25750 1
436 . 1 1 51 51 LEU CD1 C 13 24.534 0.300 . . . . . A 641 LEU CD1 . 25750 1
437 . 1 1 51 51 LEU N N 15 121.845 0.300 . . . . . A 641 LEU N . 25750 1
438 . 1 1 52 52 ASP H H 1 8.527 0.020 . . . . . A 642 ASP H . 25750 1
439 . 1 1 52 52 ASP C C 13 175.587 0.300 . . . . . A 642 ASP C . 25750 1
440 . 1 1 52 52 ASP CA C 13 57.772 0.300 . . . . . A 642 ASP CA . 25750 1
441 . 1 1 52 52 ASP CB C 13 40.312 0.300 . . . . . A 642 ASP CB . 25750 1
442 . 1 1 52 52 ASP N N 15 120.749 0.300 . . . . . A 642 ASP N . 25750 1
443 . 1 1 53 53 GLU H H 1 8.035 0.020 . . . . . A 643 GLU H . 25750 1
444 . 1 1 53 53 GLU HG3 H 1 2.405 0.020 . . . . . A 643 GLU HG3 . 25750 1
445 . 1 1 53 53 GLU C C 13 175.619 0.300 . . . . . A 643 GLU C . 25750 1
446 . 1 1 53 53 GLU CA C 13 58.956 0.300 . . . . . A 643 GLU CA . 25750 1
447 . 1 1 53 53 GLU CB C 13 28.236 0.300 . . . . . A 643 GLU CB . 25750 1
448 . 1 1 53 53 GLU CG C 13 34.506 0.300 . . . . . A 643 GLU CG . 25750 1
449 . 1 1 53 53 GLU N N 15 119.649 0.300 . . . . . A 643 GLU N . 25750 1
450 . 1 1 54 54 GLU H H 1 8.024 0.020 . . . . . A 644 GLU H . 25750 1
451 . 1 1 54 54 GLU C C 13 176.102 0.300 . . . . . A 644 GLU C . 25750 1
452 . 1 1 54 54 GLU CA C 13 58.867 0.300 . . . . . A 644 GLU CA . 25750 1
453 . 1 1 54 54 GLU CB C 13 27.909 0.300 . . . . . A 644 GLU CB . 25750 1
454 . 1 1 54 54 GLU N N 15 118.804 0.300 . . . . . A 644 GLU N . 25750 1
455 . 1 1 55 55 LYS H H 1 7.889 0.020 . . . . . A 645 LYS H . 25750 1
456 . 1 1 55 55 LYS HG2 H 1 1.628 0.020 . . . . . A 645 LYS HG2 . 25750 1
457 . 1 1 55 55 LYS HG3 H 1 1.379 0.020 . . . . . A 645 LYS HG3 . 25750 1
458 . 1 1 55 55 LYS C C 13 176.848 0.300 . . . . . A 645 LYS C . 25750 1
459 . 1 1 55 55 LYS CA C 13 60.234 0.300 . . . . . A 645 LYS CA . 25750 1
460 . 1 1 55 55 LYS CB C 13 31.593 0.300 . . . . . A 645 LYS CB . 25750 1
461 . 1 1 55 55 LYS CG C 13 24.994 0.300 . . . . . A 645 LYS CG . 25750 1
462 . 1 1 55 55 LYS N N 15 118.824 0.300 . . . . . A 645 LYS N . 25750 1
463 . 1 1 56 56 LYS H H 1 8.042 0.020 . . . . . A 646 LYS H . 25750 1
464 . 1 1 56 56 LYS C C 13 176.933 0.300 . . . . . A 646 LYS C . 25750 1
465 . 1 1 56 56 LYS CA C 13 60.264 0.300 . . . . . A 646 LYS CA . 25750 1
466 . 1 1 56 56 LYS CB C 13 31.437 0.300 . . . . . A 646 LYS CB . 25750 1
467 . 1 1 56 56 LYS N N 15 119.745 0.300 . . . . . A 646 LYS N . 25750 1
468 . 1 1 57 57 ILE H H 1 8.038 0.020 . . . . . A 647 ILE H . 25750 1
469 . 1 1 57 57 ILE HG21 H 1 0.849 0.020 . . . . . A 647 ILE HG21 . 25750 1
470 . 1 1 57 57 ILE HG22 H 1 0.849 0.020 . . . . . A 647 ILE HG22 . 25750 1
471 . 1 1 57 57 ILE HG23 H 1 0.849 0.020 . . . . . A 647 ILE HG23 . 25750 1
472 . 1 1 57 57 ILE HD11 H 1 0.814 0.020 . . . . . A 647 ILE HD11 . 25750 1
473 . 1 1 57 57 ILE HD12 H 1 0.814 0.020 . . . . . A 647 ILE HD12 . 25750 1
474 . 1 1 57 57 ILE HD13 H 1 0.814 0.020 . . . . . A 647 ILE HD13 . 25750 1
475 . 1 1 57 57 ILE C C 13 175.433 0.300 . . . . . A 647 ILE C . 25750 1
476 . 1 1 57 57 ILE CA C 13 64.886 0.300 . . . . . A 647 ILE CA . 25750 1
477 . 1 1 57 57 ILE CB C 13 37.714 0.300 . . . . . A 647 ILE CB . 25750 1
478 . 1 1 57 57 ILE CG2 C 13 16.815 0.300 . . . . . A 647 ILE CG2 . 25750 1
479 . 1 1 57 57 ILE CD1 C 13 12.613 0.300 . . . . . A 647 ILE CD1 . 25750 1
480 . 1 1 57 57 ILE N N 15 119.713 0.300 . . . . . A 647 ILE N . 25750 1
481 . 1 1 58 58 ARG H H 1 8.121 0.020 . . . . . A 648 ARG H . 25750 1
482 . 1 1 58 58 ARG HE H 1 7.457 0.020 . . . . . A 648 ARG HE . 25750 1
483 . 1 1 58 58 ARG C C 13 174.721 0.300 . . . . . A 648 ARG C . 25750 1
484 . 1 1 58 58 ARG CA C 13 60.218 0.300 . . . . . A 648 ARG CA . 25750 1
485 . 1 1 58 58 ARG N N 15 120.784 0.300 . . . . . A 648 ARG N . 25750 1
486 . 1 1 59 59 LEU H H 1 8.613 0.020 . . . . . A 649 LEU H . 25750 1
487 . 1 1 59 59 LEU HD11 H 1 0.877 0.020 . . . . . A 649 LEU HD11 . 25750 1
488 . 1 1 59 59 LEU HD12 H 1 0.877 0.020 . . . . . A 649 LEU HD12 . 25750 1
489 . 1 1 59 59 LEU HD13 H 1 0.877 0.020 . . . . . A 649 LEU HD13 . 25750 1
490 . 1 1 59 59 LEU HD21 H 1 0.871 0.020 . . . . . A 649 LEU HD21 . 25750 1
491 . 1 1 59 59 LEU HD22 H 1 0.871 0.020 . . . . . A 649 LEU HD22 . 25750 1
492 . 1 1 59 59 LEU HD23 H 1 0.871 0.020 . . . . . A 649 LEU HD23 . 25750 1
493 . 1 1 59 59 LEU C C 13 176.573 0.300 . . . . . A 649 LEU C . 25750 1
494 . 1 1 59 59 LEU CA C 13 58.047 0.300 . . . . . A 649 LEU CA . 25750 1
495 . 1 1 59 59 LEU CB C 13 40.730 0.300 . . . . . A 649 LEU CB . 25750 1
496 . 1 1 59 59 LEU CD1 C 13 24.120 0.300 . . . . . A 649 LEU CD1 . 25750 1
497 . 1 1 59 59 LEU CD2 C 13 24.054 0.300 . . . . . A 649 LEU CD2 . 25750 1
498 . 1 1 59 59 LEU N N 15 121.582 0.300 . . . . . A 649 LEU N . 25750 1
499 . 1 1 60 60 ARG H H 1 7.644 0.020 . . . . . A 650 ARG H . 25750 1
500 . 1 1 60 60 ARG HG2 H 1 1.786 0.020 . . . . . A 650 ARG HG2 . 25750 1
501 . 1 1 60 60 ARG HG3 H 1 1.659 0.020 . . . . . A 650 ARG HG3 . 25750 1
502 . 1 1 60 60 ARG HE H 1 7.257 0.020 . . . . . A 650 ARG HE . 25750 1
503 . 1 1 60 60 ARG C C 13 175.992 0.300 . . . . . A 650 ARG C . 25750 1
504 . 1 1 60 60 ARG CA C 13 59.145 0.300 . . . . . A 650 ARG CA . 25750 1
505 . 1 1 60 60 ARG CB C 13 28.829 0.300 . . . . . A 650 ARG CB . 25750 1
506 . 1 1 60 60 ARG CG C 13 26.596 0.300 . . . . . A 650 ARG CG . 25750 1
507 . 1 1 60 60 ARG N N 15 119.686 0.300 . . . . . A 650 ARG N . 25750 1
508 . 1 1 61 61 LEU H H 1 8.175 0.020 . . . . . A 651 LEU H . 25750 1
509 . 1 1 61 61 LEU HD11 H 1 0.805 0.020 . . . . . A 651 LEU HD11 . 25750 1
510 . 1 1 61 61 LEU HD12 H 1 0.805 0.020 . . . . . A 651 LEU HD12 . 25750 1
511 . 1 1 61 61 LEU HD13 H 1 0.805 0.020 . . . . . A 651 LEU HD13 . 25750 1
512 . 1 1 61 61 LEU HD21 H 1 0.858 0.020 . . . . . A 651 LEU HD21 . 25750 1
513 . 1 1 61 61 LEU HD22 H 1 0.858 0.020 . . . . . A 651 LEU HD22 . 25750 1
514 . 1 1 61 61 LEU HD23 H 1 0.858 0.020 . . . . . A 651 LEU HD23 . 25750 1
515 . 1 1 61 61 LEU C C 13 175.433 0.300 . . . . . A 651 LEU C . 25750 1
516 . 1 1 61 61 LEU CA C 13 57.772 0.300 . . . . . A 651 LEU CA . 25750 1
517 . 1 1 61 61 LEU CB C 13 41.644 0.300 . . . . . A 651 LEU CB . 25750 1
518 . 1 1 61 61 LEU CD1 C 13 24.120 0.300 . . . . . A 651 LEU CD1 . 25750 1
519 . 1 1 61 61 LEU CD2 C 13 23.985 0.300 . . . . . A 651 LEU CD2 . 25750 1
520 . 1 1 61 61 LEU N N 15 121.140 0.300 . . . . . A 651 LEU N . 25750 1
521 . 1 1 62 62 GLN H H 1 8.686 0.020 . . . . . A 652 GLN H . 25750 1
522 . 1 1 62 62 GLN HG3 H 1 2.377 0.020 . . . . . A 652 GLN HG3 . 25750 1
523 . 1 1 62 62 GLN HE21 H 1 7.467 0.020 . . . . . A 652 GLN HE21 . 25750 1
524 . 1 1 62 62 GLN HE22 H 1 7.056 0.020 . . . . . A 652 GLN HE22 . 25750 1
525 . 1 1 62 62 GLN C C 13 175.160 0.300 . . . . . A 652 GLN C . 25750 1
526 . 1 1 62 62 GLN CA C 13 59.020 0.300 . . . . . A 652 GLN CA . 25750 1
527 . 1 1 62 62 GLN CB C 13 28.517 0.300 . . . . . A 652 GLN CB . 25750 1
528 . 1 1 62 62 GLN CG C 13 33.193 0.300 . . . . . A 652 GLN CG . 25750 1
529 . 1 1 62 62 GLN N N 15 118.409 0.300 . . . . . A 652 GLN N . 25750 1
530 . 1 1 62 62 GLN NE2 N 15 113.333 0.300 . . . . . A 652 GLN NE2 . 25750 1
531 . 1 1 63 63 MET H H 1 7.883 0.020 . . . . . A 653 MET H . 25750 1
532 . 1 1 63 63 MET HG2 H 1 2.626 0.020 . . . . . A 653 MET HG2 . 25750 1
533 . 1 1 63 63 MET HG3 H 1 2.626 0.020 . . . . . A 653 MET HG3 . 25750 1
534 . 1 1 63 63 MET HE1 H 1 2.096 0.020 . . . . . A 653 MET HE1 . 25750 1
535 . 1 1 63 63 MET HE2 H 1 2.096 0.020 . . . . . A 653 MET HE2 . 25750 1
536 . 1 1 63 63 MET HE3 H 1 2.096 0.020 . . . . . A 653 MET HE3 . 25750 1
537 . 1 1 63 63 MET C C 13 175.247 0.300 . . . . . A 653 MET C . 25750 1
538 . 1 1 63 63 MET CA C 13 60.242 0.300 . . . . . A 653 MET CA . 25750 1
539 . 1 1 63 63 MET CB C 13 31.589 0.300 . . . . . A 653 MET CB . 25750 1
540 . 1 1 63 63 MET CG C 13 31.274 0.300 . . . . . A 653 MET CG . 25750 1
541 . 1 1 63 63 MET CE C 13 16.552 0.300 . . . . . A 653 MET CE . 25750 1
542 . 1 1 63 63 MET N N 15 118.707 0.300 . . . . . A 653 MET N . 25750 1
543 . 1 1 64 64 GLU H H 1 8.080 0.020 . . . . . A 654 GLU H . 25750 1
544 . 1 1 64 64 GLU HG3 H 1 2.273 0.020 . . . . . A 654 GLU HG3 . 25750 1
545 . 1 1 64 64 GLU C C 13 176.277 0.300 . . . . . A 654 GLU C . 25750 1
546 . 1 1 64 64 GLU CA C 13 59.145 0.300 . . . . . A 654 GLU CA . 25750 1
547 . 1 1 64 64 GLU CB C 13 28.818 0.300 . . . . . A 654 GLU CB . 25750 1
548 . 1 1 64 64 GLU CG C 13 34.639 0.300 . . . . . A 654 GLU CG . 25750 1
549 . 1 1 64 64 GLU N N 15 119.578 0.300 . . . . . A 654 GLU N . 25750 1
550 . 1 1 65 65 VAL H H 1 8.620 0.020 . . . . . A 655 VAL H . 25750 1
551 . 1 1 65 65 VAL HG11 H 1 0.898 0.020 . . . . . A 655 VAL HG11 . 25750 1
552 . 1 1 65 65 VAL HG12 H 1 0.898 0.020 . . . . . A 655 VAL HG12 . 25750 1
553 . 1 1 65 65 VAL HG13 H 1 0.898 0.020 . . . . . A 655 VAL HG13 . 25750 1
554 . 1 1 65 65 VAL HG21 H 1 0.811 0.020 . . . . . A 655 VAL HG21 . 25750 1
555 . 1 1 65 65 VAL HG22 H 1 0.811 0.020 . . . . . A 655 VAL HG22 . 25750 1
556 . 1 1 65 65 VAL HG23 H 1 0.811 0.020 . . . . . A 655 VAL HG23 . 25750 1
557 . 1 1 65 65 VAL C C 13 174.218 0.300 . . . . . A 655 VAL C . 25750 1
558 . 1 1 65 65 VAL CA C 13 67.083 0.300 . . . . . A 655 VAL CA . 25750 1
559 . 1 1 65 65 VAL CB C 13 30.702 0.300 . . . . . A 655 VAL CB . 25750 1
560 . 1 1 65 65 VAL CG1 C 13 23.779 0.300 . . . . . A 655 VAL CG1 . 25750 1
561 . 1 1 65 65 VAL CG2 C 13 20.550 0.300 . . . . . A 655 VAL CG2 . 25750 1
562 . 1 1 65 65 VAL N N 15 119.714 0.300 . . . . . A 655 VAL N . 25750 1
563 . 1 1 66 66 ASN H H 1 8.353 0.020 . . . . . A 656 ASN H . 25750 1
564 . 1 1 66 66 ASN HD21 H 1 7.682 0.020 . . . . . A 656 ASN HD21 . 25750 1
565 . 1 1 66 66 ASN HD22 H 1 7.007 0.020 . . . . . A 656 ASN HD22 . 25750 1
566 . 1 1 66 66 ASN CA C 13 56.151 0.300 . . . . . A 656 ASN CA . 25750 1
567 . 1 1 66 66 ASN CB C 13 37.274 0.300 . . . . . A 656 ASN CB . 25750 1
568 . 1 1 66 66 ASN N N 15 119.340 0.300 . . . . . A 656 ASN N . 25750 1
569 . 1 1 66 66 ASN ND2 N 15 111.533 0.300 . . . . . A 656 ASN ND2 . 25750 1
570 . 1 1 67 67 ASP H H 1 8.103 0.020 . . . . . A 657 ASP H . 25750 1
571 . 1 1 67 67 ASP C C 13 176.091 0.300 . . . . . A 657 ASP C . 25750 1
572 . 1 1 67 67 ASP CA C 13 57.510 0.300 . . . . . A 657 ASP CA . 25750 1
573 . 1 1 67 67 ASP CB C 13 39.460 0.300 . . . . . A 657 ASP CB . 25750 1
574 . 1 1 67 67 ASP N N 15 121.097 0.300 . . . . . A 657 ASP N . 25750 1
575 . 1 1 68 68 ILE H H 1 8.099 0.020 . . . . . A 658 ILE H . 25750 1
576 . 1 1 68 68 ILE HG21 H 1 0.873 0.020 . . . . . A 658 ILE HG21 . 25750 1
577 . 1 1 68 68 ILE HG22 H 1 0.873 0.020 . . . . . A 658 ILE HG22 . 25750 1
578 . 1 1 68 68 ILE HG23 H 1 0.873 0.020 . . . . . A 658 ILE HG23 . 25750 1
579 . 1 1 68 68 ILE HD11 H 1 0.812 0.020 . . . . . A 658 ILE HD11 . 25750 1
580 . 1 1 68 68 ILE HD12 H 1 0.812 0.020 . . . . . A 658 ILE HD12 . 25750 1
581 . 1 1 68 68 ILE HD13 H 1 0.812 0.020 . . . . . A 658 ILE HD13 . 25750 1
582 . 1 1 68 68 ILE C C 13 174.218 0.300 . . . . . A 658 ILE C . 25750 1
583 . 1 1 68 68 ILE CA C 13 65.171 0.300 . . . . . A 658 ILE CA . 25750 1
584 . 1 1 68 68 ILE CB C 13 37.547 0.300 . . . . . A 658 ILE CB . 25750 1
585 . 1 1 68 68 ILE CG2 C 13 17.659 0.300 . . . . . A 658 ILE CG2 . 25750 1
586 . 1 1 68 68 ILE CD1 C 13 13.738 0.300 . . . . . A 658 ILE CD1 . 25750 1
587 . 1 1 68 68 ILE N N 15 122.946 0.300 . . . . . A 658 ILE N . 25750 1
588 . 1 1 69 69 LYS H H 1 8.428 0.020 . . . . . A 659 LYS H . 25750 1
589 . 1 1 69 69 LYS HB3 H 1 1.886 0.020 . . . . . A 659 LYS HB3 . 25750 1
590 . 1 1 69 69 LYS HG2 H 1 1.624 0.020 . . . . . A 659 LYS HG2 . 25750 1
591 . 1 1 69 69 LYS HG3 H 1 1.356 0.020 . . . . . A 659 LYS HG3 . 25750 1
592 . 1 1 69 69 LYS C C 13 176.255 0.300 . . . . . A 659 LYS C . 25750 1
593 . 1 1 69 69 LYS CA C 13 60.204 0.300 . . . . . A 659 LYS CA . 25750 1
594 . 1 1 69 69 LYS CB C 13 31.486 0.300 . . . . . A 659 LYS CB . 25750 1
595 . 1 1 69 69 LYS CG C 13 24.856 0.300 . . . . . A 659 LYS CG . 25750 1
596 . 1 1 69 69 LYS N N 15 118.621 0.300 . . . . . A 659 LYS N . 25750 1
597 . 1 1 70 70 LYS H H 1 7.809 0.020 . . . . . A 660 LYS H . 25750 1
598 . 1 1 70 70 LYS HB3 H 1 1.918 0.020 . . . . . A 660 LYS HB3 . 25750 1
599 . 1 1 70 70 LYS HG2 H 1 1.543 0.020 . . . . . A 660 LYS HG2 . 25750 1
600 . 1 1 70 70 LYS HG3 H 1 1.543 0.020 . . . . . A 660 LYS HG3 . 25750 1
601 . 1 1 70 70 LYS C C 13 175.806 0.300 . . . . . A 660 LYS C . 25750 1
602 . 1 1 70 70 LYS CA C 13 58.869 0.300 . . . . . A 660 LYS CA . 25750 1
603 . 1 1 70 70 LYS CB C 13 31.618 0.300 . . . . . A 660 LYS CB . 25750 1
604 . 1 1 70 70 LYS CG C 13 24.192 0.300 . . . . . A 660 LYS CG . 25750 1
605 . 1 1 70 70 LYS N N 15 117.734 0.300 . . . . . A 660 LYS N . 25750 1
606 . 1 1 71 71 ALA H H 1 7.758 0.020 . . . . . A 661 ALA H . 25750 1
607 . 1 1 71 71 ALA HB1 H 1 1.533 0.020 . . . . . A 661 ALA HB1 . 25750 1
608 . 1 1 71 71 ALA HB2 H 1 1.533 0.020 . . . . . A 661 ALA HB2 . 25750 1
609 . 1 1 71 71 ALA HB3 H 1 1.533 0.020 . . . . . A 661 ALA HB3 . 25750 1
610 . 1 1 71 71 ALA C C 13 176.744 0.300 . . . . . A 661 ALA C . 25750 1
611 . 1 1 71 71 ALA CA C 13 54.060 0.300 . . . . . A 661 ALA CA . 25750 1
612 . 1 1 71 71 ALA CB C 13 17.727 0.300 . . . . . A 661 ALA CB . 25750 1
613 . 1 1 71 71 ALA N N 15 122.152 0.300 . . . . . A 661 ALA N . 25750 1
614 . 1 1 72 72 LEU H H 1 7.898 0.020 . . . . . A 662 LEU H . 25750 1
615 . 1 1 72 72 LEU HD11 H 1 0.834 0.020 . . . . . A 662 LEU HD11 . 25750 1
616 . 1 1 72 72 LEU HD12 H 1 0.834 0.020 . . . . . A 662 LEU HD12 . 25750 1
617 . 1 1 72 72 LEU HD13 H 1 0.834 0.020 . . . . . A 662 LEU HD13 . 25750 1
618 . 1 1 72 72 LEU HD21 H 1 0.821 0.020 . . . . . A 662 LEU HD21 . 25750 1
619 . 1 1 72 72 LEU HD22 H 1 0.821 0.020 . . . . . A 662 LEU HD22 . 25750 1
620 . 1 1 72 72 LEU HD23 H 1 0.821 0.020 . . . . . A 662 LEU HD23 . 25750 1
621 . 1 1 72 72 LEU C C 13 174.864 0.300 . . . . . A 662 LEU C . 25750 1
622 . 1 1 72 72 LEU CA C 13 56.138 0.300 . . . . . A 662 LEU CA . 25750 1
623 . 1 1 72 72 LEU CB C 13 41.646 0.300 . . . . . A 662 LEU CB . 25750 1
624 . 1 1 72 72 LEU CD1 C 13 25.154 0.300 . . . . . A 662 LEU CD1 . 25750 1
625 . 1 1 72 72 LEU CD2 C 13 22.747 0.300 . . . . . A 662 LEU CD2 . 25750 1
626 . 1 1 72 72 LEU N N 15 117.559 0.300 . . . . . A 662 LEU N . 25750 1
627 . 1 1 73 73 GLN H H 1 7.711 0.020 . . . . . A 663 GLN H . 25750 1
628 . 1 1 73 73 GLN HB3 H 1 2.121 0.020 . . . . . A 663 GLN HB3 . 25750 1
629 . 1 1 73 73 GLN HG2 H 1 2.508 0.020 . . . . . A 663 GLN HG2 . 25750 1
630 . 1 1 73 73 GLN HG3 H 1 2.431 0.020 . . . . . A 663 GLN HG3 . 25750 1
631 . 1 1 73 73 GLN HE21 H 1 7.485 0.020 . . . . . A 663 GLN HE21 . 25750 1
632 . 1 1 73 73 GLN HE22 H 1 6.822 0.020 . . . . . A 663 GLN HE22 . 25750 1
633 . 1 1 73 73 GLN C C 13 173.002 0.300 . . . . . A 663 GLN C . 25750 1
634 . 1 1 73 73 GLN CA C 13 56.399 0.300 . . . . . A 663 GLN CA . 25750 1
635 . 1 1 73 73 GLN CB C 13 28.458 0.300 . . . . . A 663 GLN CB . 25750 1
636 . 1 1 73 73 GLN CG C 13 33.404 0.300 . . . . . A 663 GLN CG . 25750 1
637 . 1 1 73 73 GLN N N 15 117.521 0.300 . . . . . A 663 GLN N . 25750 1
638 . 1 1 73 73 GLN NE2 N 15 111.531 0.300 . . . . . A 663 GLN NE2 . 25750 1
639 . 1 1 74 74 SER H H 1 7.891 0.020 . . . . . A 664 SER H . 25750 1
640 . 1 1 74 74 SER HB2 H 1 3.932 0.020 . . . . . A 664 SER HB2 . 25750 1
641 . 1 1 74 74 SER HB3 H 1 3.932 0.020 . . . . . A 664 SER HB3 . 25750 1
642 . 1 1 74 74 SER C C 13 170.285 0.300 . . . . . A 664 SER C . 25750 1
643 . 1 1 74 74 SER CA C 13 58.598 0.300 . . . . . A 664 SER CA . 25750 1
644 . 1 1 74 74 SER CB C 13 63.777 0.300 . . . . . A 664 SER CB . 25750 1
645 . 1 1 74 74 SER N N 15 115.466 0.300 . . . . . A 664 SER N . 25750 1
646 . 1 1 75 75 LYS H H 1 7.805 0.020 . . . . . A 665 LYS H . 25750 1
647 . 1 1 75 75 LYS HB2 H 1 1.833 0.020 . . . . . A 665 LYS HB2 . 25750 1
648 . 1 1 75 75 LYS HB3 H 1 1.728 0.020 . . . . . A 665 LYS HB3 . 25750 1
649 . 1 1 75 75 LYS HG2 H 1 1.402 0.020 . . . . . A 665 LYS HG2 . 25750 1
650 . 1 1 75 75 LYS HG3 H 1 1.264 0.020 . . . . . A 665 LYS HG3 . 25750 1
651 . 1 1 75 75 LYS HD2 H 1 1.739 0.020 . . . . . A 665 LYS HD2 . 25750 1
652 . 1 1 75 75 LYS HD3 H 1 1.739 0.020 . . . . . A 665 LYS HD3 . 25750 1
653 . 1 1 75 75 LYS C C 13 177.690 0.300 . . . . . A 665 LYS C . 25750 1
654 . 1 1 75 75 LYS CA C 13 57.494 0.300 . . . . . A 665 LYS CA . 25750 1
655 . 1 1 75 75 LYS CB C 13 32.885 0.300 . . . . . A 665 LYS CB . 25750 1
656 . 1 1 75 75 LYS CG C 13 23.848 0.300 . . . . . A 665 LYS CG . 25750 1
657 . 1 1 75 75 LYS N N 15 127.142 0.300 . . . . . A 665 LYS N . 25750 1
stop_
save_