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 53479
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name assigned_chemical_shifts
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '3D HNCA' . . . 53479 1
2 '3D HNCACB' . . . 53479 1
3 '3D HCCH-TOCSY' . . . 53479 1
4 '2D 1H-15N HSQC' . . . 53479 1
5 '2D 1H-13C HSQC' . . . 53479 1
6 '3D HCACO' . . . 53479 1
7 '3D HNCO' . . . 53479 1
8 '3D HN(COCA)CB' . . . 53479 1
9 '3D HN(CO)CA' . . . 53479 1
13 '3D 1H-15N TOCSY' . . . 53479 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 . . 53479 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 4 4 MET C C 13 176.473 0.000 . 1 . . . . . 4 MET C . 53479 1
2 . 1 . 1 4 4 MET CA C 13 55.596 0.000 . 1 . . . . . 4 MET CA . 53479 1
3 . 1 . 1 5 5 GLY H H 1 8.294 0.004 . 1 . . . . . 5 GLY H . 53479 1
4 . 1 . 1 5 5 GLY HA2 H 1 3.874 0.003 . 2 . . . . . 5 GLY HA2 . 53479 1
5 . 1 . 1 5 5 GLY HA3 H 1 3.511 0.000 . 2 . . . . . 5 GLY HA3 . 53479 1
6 . 1 . 1 5 5 GLY C C 13 173.967 0.009 . 1 . . . . . 5 GLY C . 53479 1
7 . 1 . 1 5 5 GLY CA C 13 45.295 0.028 . 1 . . . . . 5 GLY CA . 53479 1
8 . 1 . 1 5 5 GLY N N 15 109.546 0.039 . 1 . . . . . 5 GLY N . 53479 1
9 . 1 . 1 6 6 GLU H H 1 8.088 0.006 . 1 . . . . . 6 GLU H . 53479 1
10 . 1 . 1 6 6 GLU HA H 1 4.390 0.004 . 1 . . . . . 6 GLU HA . 53479 1
11 . 1 . 1 6 6 GLU HB2 H 1 2.065 0.007 . 2 . . . . . 6 GLU HB2 . 53479 1
12 . 1 . 1 6 6 GLU HB3 H 1 1.886 0.008 . 2 . . . . . 6 GLU HB3 . 53479 1
13 . 1 . 1 6 6 GLU HG2 H 1 2.196 0.005 . 2 . . . . . 6 GLU HG2 . 53479 1
14 . 1 . 1 6 6 GLU HG3 H 1 2.196 0.005 . 2 . . . . . 6 GLU HG3 . 53479 1
15 . 1 . 1 6 6 GLU C C 13 176.104 0.003 . 1 . . . . . 6 GLU C . 53479 1
16 . 1 . 1 6 6 GLU CA C 13 56.235 0.044 . 1 . . . . . 6 GLU CA . 53479 1
17 . 1 . 1 6 6 GLU CB C 13 30.561 0.038 . 1 . . . . . 6 GLU CB . 53479 1
18 . 1 . 1 6 6 GLU CG C 13 36.344 0.001 . 1 . . . . . 6 GLU CG . 53479 1
19 . 1 . 1 6 6 GLU N N 15 120.075 0.075 . 1 . . . . . 6 GLU N . 53479 1
20 . 1 . 1 7 7 GLN H H 1 8.458 0.002 . 1 . . . . . 7 GLN H . 53479 1
21 . 1 . 1 7 7 GLN HA H 1 4.731 0.003 . 1 . . . . . 7 GLN HA . 53479 1
22 . 1 . 1 7 7 GLN HB2 H 1 2.062 0.005 . 2 . . . . . 7 GLN HB2 . 53479 1
23 . 1 . 1 7 7 GLN HB3 H 1 1.901 0.001 . 2 . . . . . 7 GLN HB3 . 53479 1
24 . 1 . 1 7 7 GLN HG2 H 1 2.346 0.000 . 2 . . . . . 7 GLN HG2 . 53479 1
25 . 1 . 1 7 7 GLN HG3 H 1 2.346 0.000 . 2 . . . . . 7 GLN HG3 . 53479 1
26 . 1 . 1 7 7 GLN C C 13 173.556 0.000 . 1 . . . . . 7 GLN C . 53479 1
27 . 1 . 1 7 7 GLN CA C 13 52.965 0.033 . 1 . . . . . 7 GLN CA . 53479 1
28 . 1 . 1 7 7 GLN CB C 13 29.376 0.055 . 1 . . . . . 7 GLN CB . 53479 1
29 . 1 . 1 7 7 GLN CG C 13 33.296 0.000 . 1 . . . . . 7 GLN CG . 53479 1
30 . 1 . 1 7 7 GLN N N 15 120.838 0.016 . 1 . . . . . 7 GLN N . 53479 1
31 . 1 . 1 8 8 PRO C C 13 177.048 0.001 . 1 . . . . . 8 PRO C . 53479 1
32 . 1 . 1 8 8 PRO CA C 13 62.396 0.079 . 1 . . . . . 8 PRO CA . 53479 1
33 . 1 . 1 8 8 PRO CB C 13 32.000 0.010 . 1 . . . . . 8 PRO CB . 53479 1
34 . 1 . 1 9 9 ILE H H 1 8.487 0.003 . 1 . . . . . 9 ILE H . 53479 1
35 . 1 . 1 9 9 ILE HA H 1 4.141 0.001 . 1 . . . . . 9 ILE HA . 53479 1
36 . 1 . 1 9 9 ILE HB H 1 1.717 0.002 . 1 . . . . . 9 ILE HB . 53479 1
37 . 1 . 1 9 9 ILE HG21 H 1 0.962 0.003 . 1 . . . . . 9 ILE QG2 . 53479 1
38 . 1 . 1 9 9 ILE HG22 H 1 0.962 0.003 . 1 . . . . . 9 ILE QG2 . 53479 1
39 . 1 . 1 9 9 ILE HG23 H 1 0.962 0.003 . 1 . . . . . 9 ILE QG2 . 53479 1
40 . 1 . 1 9 9 ILE C C 13 176.320 0.011 . 1 . . . . . 9 ILE C . 53479 1
41 . 1 . 1 9 9 ILE CA C 13 61.867 0.060 . 1 . . . . . 9 ILE CA . 53479 1
42 . 1 . 1 9 9 ILE CB C 13 38.938 0.071 . 1 . . . . . 9 ILE CB . 53479 1
43 . 1 . 1 9 9 ILE CG2 C 13 18.218 0.030 . 1 . . . . . 9 ILE CG2 . 53479 1
44 . 1 . 1 9 9 ILE N N 15 119.026 0.018 . 1 . . . . . 9 ILE N . 53479 1
45 . 1 . 1 10 10 PHE H H 1 7.165 0.004 . 1 . . . . . 10 PHE H . 53479 1
46 . 1 . 1 10 10 PHE HA H 1 4.640 0.003 . 1 . . . . . 10 PHE HA . 53479 1
47 . 1 . 1 10 10 PHE HB2 H 1 2.628 0.005 . 2 . . . . . 10 PHE HB2 . 53479 1
48 . 1 . 1 10 10 PHE HB3 H 1 2.628 0.005 . 2 . . . . . 10 PHE HB3 . 53479 1
49 . 1 . 1 10 10 PHE C C 13 173.394 0.008 . 1 . . . . . 10 PHE C . 53479 1
50 . 1 . 1 10 10 PHE CA C 13 58.316 0.054 . 1 . . . . . 10 PHE CA . 53479 1
51 . 1 . 1 10 10 PHE CB C 13 41.901 0.031 . 1 . . . . . 10 PHE CB . 53479 1
52 . 1 . 1 10 10 PHE N N 15 118.676 0.096 . 1 . . . . . 10 PHE N . 53479 1
53 . 1 . 1 11 11 SER H H 1 7.823 0.003 . 1 . . . . . 11 SER H . 53479 1
54 . 1 . 1 11 11 SER HB2 H 1 3.548 0.000 . 2 . . . . . 11 SER HB2 . 53479 1
55 . 1 . 1 11 11 SER HB3 H 1 3.306 0.001 . 2 . . . . . 11 SER HB3 . 53479 1
56 . 1 . 1 11 11 SER C C 13 170.600 0.013 . 1 . . . . . 11 SER C . 53479 1
57 . 1 . 1 11 11 SER CA C 13 57.393 0.034 . 1 . . . . . 11 SER CA . 53479 1
58 . 1 . 1 11 11 SER CB C 13 66.431 0.042 . 1 . . . . . 11 SER CB . 53479 1
59 . 1 . 1 11 11 SER N N 15 123.112 0.068 . 1 . . . . . 11 SER N . 53479 1
60 . 1 . 1 12 12 THR H H 1 8.805 0.005 . 1 . . . . . 12 THR H . 53479 1
61 . 1 . 1 12 12 THR HA H 1 4.530 0.001 . 1 . . . . . 12 THR HA . 53479 1
62 . 1 . 1 12 12 THR HB H 1 4.095 0.009 . 1 . . . . . 12 THR HB . 53479 1
63 . 1 . 1 12 12 THR HG21 H 1 1.289 0.004 . 1 . . . . . 12 THR QG2 . 53479 1
64 . 1 . 1 12 12 THR HG22 H 1 1.289 0.004 . 1 . . . . . 12 THR QG2 . 53479 1
65 . 1 . 1 12 12 THR HG23 H 1 1.289 0.004 . 1 . . . . . 12 THR QG2 . 53479 1
66 . 1 . 1 12 12 THR C C 13 171.598 0.004 . 1 . . . . . 12 THR C . 53479 1
67 . 1 . 1 12 12 THR CA C 13 59.419 0.058 . 1 . . . . . 12 THR CA . 53479 1
68 . 1 . 1 12 12 THR CB C 13 69.892 0.070 . 1 . . . . . 12 THR CB . 53479 1
69 . 1 . 1 12 12 THR CG2 C 13 20.338 0.009 . 1 . . . . . 12 THR CG2 . 53479 1
70 . 1 . 1 12 12 THR N N 15 118.155 0.045 . 1 . . . . . 12 THR N . 53479 1
71 . 1 . 1 13 13 ARG H H 1 8.090 0.004 . 1 . . . . . 13 ARG H . 53479 1
72 . 1 . 1 13 13 ARG HB2 H 1 1.542 0.008 . 2 . . . . . 13 ARG HB2 . 53479 1
73 . 1 . 1 13 13 ARG HB3 H 1 1.372 0.012 . 2 . . . . . 13 ARG HB3 . 53479 1
74 . 1 . 1 13 13 ARG C C 13 174.917 0.004 . 1 . . . . . 13 ARG C . 53479 1
75 . 1 . 1 13 13 ARG CA C 13 54.240 0.047 . 1 . . . . . 13 ARG CA . 53479 1
76 . 1 . 1 13 13 ARG CB C 13 32.589 0.051 . 1 . . . . . 13 ARG CB . 53479 1
77 . 1 . 1 13 13 ARG N N 15 123.111 0.027 . 1 . . . . . 13 ARG N . 53479 1
78 . 1 . 1 14 14 ALA H H 1 8.908 0.003 . 1 . . . . . 14 ALA H . 53479 1
79 . 1 . 1 14 14 ALA HA H 1 4.403 0.002 . 1 . . . . . 14 ALA HA . 53479 1
80 . 1 . 1 14 14 ALA HB1 H 1 0.416 0.002 . 1 . . . . . 14 ALA HB# . 53479 1
81 . 1 . 1 14 14 ALA HB2 H 1 0.416 0.002 . 1 . . . . . 14 ALA HB# . 53479 1
82 . 1 . 1 14 14 ALA HB3 H 1 0.416 0.002 . 1 . . . . . 14 ALA HB# . 53479 1
83 . 1 . 1 14 14 ALA C C 13 175.782 0.003 . 1 . . . . . 14 ALA C . 53479 1
84 . 1 . 1 14 14 ALA CA C 13 51.369 0.021 . 1 . . . . . 14 ALA CA . 53479 1
85 . 1 . 1 14 14 ALA CB C 13 22.072 0.034 . 1 . . . . . 14 ALA CB . 53479 1
86 . 1 . 1 14 14 ALA N N 15 123.187 0.014 . 1 . . . . . 14 ALA N . 53479 1
87 . 1 . 1 15 15 HIS H H 1 8.559 0.003 . 1 . . . . . 15 HIS H . 53479 1
88 . 1 . 1 15 15 HIS HA H 1 4.141 0.010 . 1 . . . . . 15 HIS HA . 53479 1
89 . 1 . 1 15 15 HIS HB2 H 1 2.923 0.006 . 2 . . . . . 15 HIS HB2 . 53479 1
90 . 1 . 1 15 15 HIS HB3 H 1 2.738 0.003 . 2 . . . . . 15 HIS HB3 . 53479 1
91 . 1 . 1 15 15 HIS C C 13 174.590 0.003 . 1 . . . . . 15 HIS C . 53479 1
92 . 1 . 1 15 15 HIS CA C 13 57.919 0.068 . 1 . . . . . 15 HIS CA . 53479 1
93 . 1 . 1 15 15 HIS CB C 13 31.687 0.072 . 1 . . . . . 15 HIS CB . 53479 1
94 . 1 . 1 15 15 HIS N N 15 119.910 0.026 . 1 . . . . . 15 HIS N . 53479 1
95 . 1 . 1 16 16 VAL H H 1 7.873 0.009 . 1 . . . . . 16 VAL H . 53479 1
96 . 1 . 1 16 16 VAL HA H 1 4.530 0.005 . 1 . . . . . 16 VAL HA . 53479 1
97 . 1 . 1 16 16 VAL HB H 1 1.490 0.009 . 1 . . . . . 16 VAL HB . 53479 1
98 . 1 . 1 16 16 VAL HG11 H 1 0.842 0.002 . 2 . . . . . 16 VAL QG1 . 53479 1
99 . 1 . 1 16 16 VAL HG12 H 1 0.842 0.002 . 2 . . . . . 16 VAL QG1 . 53479 1
100 . 1 . 1 16 16 VAL HG13 H 1 0.842 0.002 . 2 . . . . . 16 VAL QG1 . 53479 1
101 . 1 . 1 16 16 VAL HG21 H 1 0.840 0.002 . 2 . . . . . 16 VAL QG2 . 53479 1
102 . 1 . 1 16 16 VAL HG22 H 1 0.840 0.002 . 2 . . . . . 16 VAL QG2 . 53479 1
103 . 1 . 1 16 16 VAL HG23 H 1 0.840 0.002 . 2 . . . . . 16 VAL QG2 . 53479 1
104 . 1 . 1 16 16 VAL C C 13 175.153 0.007 . 1 . . . . . 16 VAL C . 53479 1
105 . 1 . 1 16 16 VAL CA C 13 62.050 0.044 . 1 . . . . . 16 VAL CA . 53479 1
106 . 1 . 1 16 16 VAL CB C 13 32.955 0.020 . 1 . . . . . 16 VAL CB . 53479 1
107 . 1 . 1 16 16 VAL CG1 C 13 22.421 0.005 . 2 . . . . . 16 VAL CG1 . 53479 1
108 . 1 . 1 16 16 VAL CG2 C 13 21.750 0.012 . 2 . . . . . 16 VAL CG2 . 53479 1
109 . 1 . 1 16 16 VAL N N 15 122.468 0.051 . 1 . . . . . 16 VAL N . 53479 1
110 . 1 . 1 17 17 PHE H H 1 9.598 0.004 . 1 . . . . . 17 PHE H . 53479 1
111 . 1 . 1 17 17 PHE HA H 1 5.406 0.006 . 1 . . . . . 17 PHE HA . 53479 1
112 . 1 . 1 17 17 PHE HB2 H 1 3.185 0.013 . 2 . . . . . 17 PHE HB2 . 53479 1
113 . 1 . 1 17 17 PHE HB3 H 1 2.539 0.005 . 2 . . . . . 17 PHE HB3 . 53479 1
114 . 1 . 1 17 17 PHE C C 13 174.972 0.000 . 1 . . . . . 17 PHE C . 53479 1
115 . 1 . 1 17 17 PHE CA C 13 56.201 0.038 . 1 . . . . . 17 PHE CA . 53479 1
116 . 1 . 1 17 17 PHE CB C 13 45.072 0.052 . 1 . . . . . 17 PHE CB . 53479 1
117 . 1 . 1 17 17 PHE N N 15 127.564 0.037 . 1 . . . . . 17 PHE N . 53479 1
118 . 1 . 1 18 18 GLN H H 1 9.145 0.004 . 1 . . . . . 18 GLN H . 53479 1
119 . 1 . 1 18 18 GLN HA H 1 5.548 0.004 . 1 . . . . . 18 GLN HA . 53479 1
120 . 1 . 1 18 18 GLN HB2 H 1 2.279 0.000 . 2 . . . . . 18 GLN HB2 . 53479 1
121 . 1 . 1 18 18 GLN HB3 H 1 2.279 0.000 . 2 . . . . . 18 GLN HB3 . 53479 1
122 . 1 . 1 18 18 GLN C C 13 175.427 0.020 . 1 . . . . . 18 GLN C . 53479 1
123 . 1 . 1 18 18 GLN CA C 13 54.496 0.066 . 1 . . . . . 18 GLN CA . 53479 1
124 . 1 . 1 18 18 GLN CB C 13 34.125 0.036 . 1 . . . . . 18 GLN CB . 53479 1
125 . 1 . 1 18 18 GLN N N 15 117.642 0.017 . 1 . . . . . 18 GLN N . 53479 1
126 . 1 . 1 19 19 ILE H H 1 7.960 0.006 . 1 . . . . . 19 ILE H . 53479 1
127 . 1 . 1 19 19 ILE HA H 1 3.794 0.002 . 1 . . . . . 19 ILE HA . 53479 1
128 . 1 . 1 19 19 ILE HB H 1 0.998 0.006 . 1 . . . . . 19 ILE HB . 53479 1
129 . 1 . 1 19 19 ILE C C 13 175.263 0.008 . 1 . . . . . 19 ILE C . 53479 1
130 . 1 . 1 19 19 ILE CA C 13 59.727 0.045 . 1 . . . . . 19 ILE CA . 53479 1
131 . 1 . 1 19 19 ILE CB C 13 38.742 0.031 . 1 . . . . . 19 ILE CB . 53479 1
132 . 1 . 1 19 19 ILE N N 15 124.102 0.062 . 1 . . . . . 19 ILE N . 53479 1
133 . 1 . 1 20 20 ASP H H 1 8.214 0.008 . 1 . . . . . 20 ASP H . 53479 1
134 . 1 . 1 20 20 ASP HA H 1 4.527 0.005 . 1 . . . . . 20 ASP HA . 53479 1
135 . 1 . 1 20 20 ASP HB2 H 1 2.783 0.014 . 2 . . . . . 20 ASP HB2 . 53479 1
136 . 1 . 1 20 20 ASP HB3 H 1 2.783 0.014 . 2 . . . . . 20 ASP HB3 . 53479 1
137 . 1 . 1 20 20 ASP CA C 13 51.695 0.088 . 1 . . . . . 20 ASP CA . 53479 1
138 . 1 . 1 20 20 ASP CB C 13 42.350 0.024 . 1 . . . . . 20 ASP CB . 53479 1
139 . 1 . 1 20 20 ASP N N 15 127.689 0.035 . 1 . . . . . 20 ASP N . 53479 1
140 . 1 . 1 21 21 PRO C C 13 177.239 0.001 . 1 . . . . . 21 PRO C . 53479 1
141 . 1 . 1 21 21 PRO CA C 13 64.016 0.022 . 1 . . . . . 21 PRO CA . 53479 1
142 . 1 . 1 21 21 PRO CB C 13 32.047 0.013 . 1 . . . . . 21 PRO CB . 53479 1
143 . 1 . 1 22 22 ASN H H 1 8.364 0.002 . 1 . . . . . 22 ASN H . 53479 1
144 . 1 . 1 22 22 ASN HA H 1 4.579 0.004 . 1 . . . . . 22 ASN HA . 53479 1
145 . 1 . 1 22 22 ASN HB2 H 1 2.853 0.005 . 2 . . . . . 22 ASN HB2 . 53479 1
146 . 1 . 1 22 22 ASN HB3 H 1 2.771 0.001 . 2 . . . . . 22 ASN HB3 . 53479 1
147 . 1 . 1 22 22 ASN C C 13 175.915 0.009 . 1 . . . . . 22 ASN C . 53479 1
148 . 1 . 1 22 22 ASN CA C 13 54.890 0.025 . 1 . . . . . 22 ASN CA . 53479 1
149 . 1 . 1 22 22 ASN CB C 13 39.045 0.017 . 1 . . . . . 22 ASN CB . 53479 1
150 . 1 . 1 22 22 ASN N N 15 115.801 0.090 . 1 . . . . . 22 ASN N . 53479 1
151 . 1 . 1 23 23 THR H H 1 7.819 0.004 . 1 . . . . . 23 THR H . 53479 1
152 . 1 . 1 23 23 THR HA H 1 4.269 0.002 . 1 . . . . . 23 THR HA . 53479 1
153 . 1 . 1 23 23 THR HB H 1 4.108 0.002 . 1 . . . . . 23 THR HB . 53479 1
154 . 1 . 1 23 23 THR C C 13 174.705 0.003 . 1 . . . . . 23 THR C . 53479 1
155 . 1 . 1 23 23 THR CA C 13 61.693 0.066 . 1 . . . . . 23 THR CA . 53479 1
156 . 1 . 1 23 23 THR CB C 13 70.569 0.022 . 1 . . . . . 23 THR CB . 53479 1
157 . 1 . 1 23 23 THR N N 15 109.634 0.035 . 1 . . . . . 23 THR N . 53479 1
158 . 1 . 1 24 24 LYS H H 1 8.136 0.009 . 1 . . . . . 24 LYS H . 53479 1
159 . 1 . 1 24 24 LYS HA H 1 4.059 0.000 . 1 . . . . . 24 LYS HA . 53479 1
160 . 1 . 1 24 24 LYS HB2 H 1 2.243 0.006 . 2 . . . . . 24 LYS HB2 . 53479 1
161 . 1 . 1 24 24 LYS HB3 H 1 2.124 0.002 . 2 . . . . . 24 LYS HB3 . 53479 1
162 . 1 . 1 24 24 LYS C C 13 176.014 0.002 . 1 . . . . . 24 LYS C . 53479 1
163 . 1 . 1 24 24 LYS CA C 13 57.536 0.061 . 1 . . . . . 24 LYS CA . 53479 1
164 . 1 . 1 24 24 LYS CB C 13 30.344 0.024 . 1 . . . . . 24 LYS CB . 53479 1
165 . 1 . 1 24 24 LYS N N 15 117.753 0.059 . 1 . . . . . 24 LYS N . 53479 1
166 . 1 . 1 25 25 LYS H H 1 7.768 0.005 . 1 . . . . . 25 LYS H . 53479 1
167 . 1 . 1 25 25 LYS HA H 1 4.132 0.003 . 1 . . . . . 25 LYS HA . 53479 1
168 . 1 . 1 25 25 LYS HB2 H 1 1.645 0.002 . 2 . . . . . 25 LYS HB2 . 53479 1
169 . 1 . 1 25 25 LYS HB3 H 1 1.478 0.008 . 2 . . . . . 25 LYS HB3 . 53479 1
170 . 1 . 1 25 25 LYS HG2 H 1 1.189 0.005 . 2 . . . . . 25 LYS HG2 . 53479 1
171 . 1 . 1 25 25 LYS HG3 H 1 1.189 0.005 . 2 . . . . . 25 LYS HG3 . 53479 1
172 . 1 . 1 25 25 LYS C C 13 174.927 0.006 . 1 . . . . . 25 LYS C . 53479 1
173 . 1 . 1 25 25 LYS CA C 13 56.398 0.058 . 1 . . . . . 25 LYS CA . 53479 1
174 . 1 . 1 25 25 LYS CB C 13 34.202 0.050 . 1 . . . . . 25 LYS CB . 53479 1
175 . 1 . 1 25 25 LYS CG C 13 24.711 0.037 . 1 . . . . . 25 LYS CG . 53479 1
176 . 1 . 1 25 25 LYS N N 15 115.825 0.086 . 1 . . . . . 25 LYS N . 53479 1
177 . 1 . 1 26 26 ASN H H 1 7.355 0.006 . 1 . . . . . 26 ASN H . 53479 1
178 . 1 . 1 26 26 ASN HA H 1 4.596 0.003 . 1 . . . . . 26 ASN HA . 53479 1
179 . 1 . 1 26 26 ASN HB2 H 1 2.667 0.002 . 2 . . . . . 26 ASN HB2 . 53479 1
180 . 1 . 1 26 26 ASN HB3 H 1 2.541 0.003 . 2 . . . . . 26 ASN HB3 . 53479 1
181 . 1 . 1 26 26 ASN C C 13 173.224 0.040 . 1 . . . . . 26 ASN C . 53479 1
182 . 1 . 1 26 26 ASN CA C 13 52.425 0.042 . 1 . . . . . 26 ASN CA . 53479 1
183 . 1 . 1 26 26 ASN CB C 13 40.352 0.023 . 1 . . . . . 26 ASN CB . 53479 1
184 . 1 . 1 26 26 ASN N N 15 115.648 0.032 . 1 . . . . . 26 ASN N . 53479 1
185 . 1 . 1 27 27 TRP H H 1 8.379 0.003 . 1 . . . . . 27 TRP H . 53479 1
186 . 1 . 1 27 27 TRP HA H 1 4.715 0.061 . 1 . . . . . 27 TRP HA . 53479 1
187 . 1 . 1 27 27 TRP HB2 H 1 2.903 0.016 . 2 . . . . . 27 TRP HB2 . 53479 1
188 . 1 . 1 27 27 TRP HB3 H 1 2.773 0.052 . 2 . . . . . 27 TRP HB3 . 53479 1
189 . 1 . 1 27 27 TRP C C 13 176.472 0.005 . 1 . . . . . 27 TRP C . 53479 1
190 . 1 . 1 27 27 TRP CA C 13 56.677 0.087 . 1 . . . . . 27 TRP CA . 53479 1
191 . 1 . 1 27 27 TRP CB C 13 30.954 0.049 . 1 . . . . . 27 TRP CB . 53479 1
192 . 1 . 1 27 27 TRP N N 15 121.398 0.056 . 1 . . . . . 27 TRP N . 53479 1
193 . 1 . 1 28 28 VAL H H 1 9.564 0.004 . 1 . . . . . 28 VAL H . 53479 1
194 . 1 . 1 28 28 VAL HA H 1 4.805 0.003 . 1 . . . . . 28 VAL HA . 53479 1
195 . 1 . 1 28 28 VAL HB H 1 2.214 0.007 . 1 . . . . . 28 VAL HB . 53479 1
196 . 1 . 1 28 28 VAL HG11 H 1 0.949 0.001 . 2 . . . . . 28 VAL QG1 . 53479 1
197 . 1 . 1 28 28 VAL HG12 H 1 0.949 0.001 . 2 . . . . . 28 VAL QG1 . 53479 1
198 . 1 . 1 28 28 VAL HG13 H 1 0.949 0.001 . 2 . . . . . 28 VAL QG1 . 53479 1
199 . 1 . 1 28 28 VAL HG21 H 1 0.937 0.006 . 2 . . . . . 28 VAL QG2 . 53479 1
200 . 1 . 1 28 28 VAL HG22 H 1 0.937 0.006 . 2 . . . . . 28 VAL QG2 . 53479 1
201 . 1 . 1 28 28 VAL HG23 H 1 0.937 0.006 . 2 . . . . . 28 VAL QG2 . 53479 1
202 . 1 . 1 28 28 VAL C C 13 174.387 0.000 . 1 . . . . . 28 VAL C . 53479 1
203 . 1 . 1 28 28 VAL CA C 13 59.009 0.028 . 1 . . . . . 28 VAL CA . 53479 1
204 . 1 . 1 28 28 VAL CB C 13 33.997 0.097 . 1 . . . . . 28 VAL CB . 53479 1
205 . 1 . 1 28 28 VAL CG1 C 13 20.773 0.044 . 2 . . . . . 28 VAL CG1 . 53479 1
206 . 1 . 1 28 28 VAL CG2 C 13 20.236 0.050 . 2 . . . . . 28 VAL CG2 . 53479 1
207 . 1 . 1 28 28 VAL N N 15 124.494 0.032 . 1 . . . . . 28 VAL N . 53479 1
208 . 1 . 1 29 29 PRO C C 13 177.490 0.003 . 1 . . . . . 29 PRO C . 53479 1
209 . 1 . 1 29 29 PRO CA C 13 63.272 0.034 . 1 . . . . . 29 PRO CA . 53479 1
210 . 1 . 1 29 29 PRO CB C 13 32.030 0.003 . 1 . . . . . 29 PRO CB . 53479 1
211 . 1 . 1 30 30 THR H H 1 8.829 0.005 . 1 . . . . . 30 THR H . 53479 1
212 . 1 . 1 30 30 THR HA H 1 4.262 0.006 . 1 . . . . . 30 THR HA . 53479 1
213 . 1 . 1 30 30 THR HB H 1 4.100 0.005 . 1 . . . . . 30 THR HB . 53479 1
214 . 1 . 1 30 30 THR C C 13 174.694 0.002 . 1 . . . . . 30 THR C . 53479 1
215 . 1 . 1 30 30 THR CA C 13 62.799 0.077 . 1 . . . . . 30 THR CA . 53479 1
216 . 1 . 1 30 30 THR CB C 13 68.943 0.072 . 1 . . . . . 30 THR CB . 53479 1
217 . 1 . 1 30 30 THR N N 15 118.219 0.029 . 1 . . . . . 30 THR N . 53479 1
218 . 1 . 1 31 31 SER H H 1 7.356 0.003 . 1 . . . . . 31 SER H . 53479 1
219 . 1 . 1 31 31 SER HA H 1 4.519 0.003 . 1 . . . . . 31 SER HA . 53479 1
220 . 1 . 1 31 31 SER HB2 H 1 3.958 0.014 . 2 . . . . . 31 SER HB2 . 53479 1
221 . 1 . 1 31 31 SER HB3 H 1 3.411 0.003 . 2 . . . . . 31 SER HB3 . 53479 1
222 . 1 . 1 31 31 SER C C 13 173.808 0.000 . 1 . . . . . 31 SER C . 53479 1
223 . 1 . 1 31 31 SER CA C 13 56.799 0.025 . 1 . . . . . 31 SER CA . 53479 1
224 . 1 . 1 31 31 SER CB C 13 65.516 0.064 . 1 . . . . . 31 SER CB . 53479 1
225 . 1 . 1 31 31 SER N N 15 114.109 0.034 . 1 . . . . . 31 SER N . 53479 1
226 . 1 . 1 32 32 LYS C C 13 175.876 0.007 . 1 . . . . . 32 LYS C . 53479 1
227 . 1 . 1 32 32 LYS CA C 13 57.692 0.033 . 1 . . . . . 32 LYS CA . 53479 1
228 . 1 . 1 32 32 LYS CB C 13 32.447 0.000 . 1 . . . . . 32 LYS CB . 53479 1
229 . 1 . 1 33 33 HIS H H 1 7.474 0.004 . 1 . . . . . 33 HIS H . 53479 1
230 . 1 . 1 33 33 HIS HA H 1 4.646 0.004 . 1 . . . . . 33 HIS HA . 53479 1
231 . 1 . 1 33 33 HIS HB2 H 1 3.140 0.001 . 2 . . . . . 33 HIS HB2 . 53479 1
232 . 1 . 1 33 33 HIS HB3 H 1 2.864 0.006 . 2 . . . . . 33 HIS HB3 . 53479 1
233 . 1 . 1 33 33 HIS C C 13 173.923 0.010 . 1 . . . . . 33 HIS C . 53479 1
234 . 1 . 1 33 33 HIS CA C 13 53.323 0.056 . 1 . . . . . 33 HIS CA . 53479 1
235 . 1 . 1 33 33 HIS CB C 13 32.243 0.035 . 1 . . . . . 33 HIS CB . 53479 1
236 . 1 . 1 33 33 HIS N N 15 115.332 0.032 . 1 . . . . . 33 HIS N . 53479 1
237 . 1 . 1 34 34 ALA H H 1 8.220 0.005 . 1 . . . . . 34 ALA H . 53479 1
238 . 1 . 1 34 34 ALA HA H 1 3.394 0.002 . 1 . . . . . 34 ALA HA . 53479 1
239 . 1 . 1 34 34 ALA HB1 H 1 0.798 0.002 . 1 . . . . . 34 ALA HB# . 53479 1
240 . 1 . 1 34 34 ALA HB2 H 1 0.798 0.002 . 1 . . . . . 34 ALA HB# . 53479 1
241 . 1 . 1 34 34 ALA HB3 H 1 0.798 0.002 . 1 . . . . . 34 ALA HB# . 53479 1
242 . 1 . 1 34 34 ALA C C 13 176.889 0.003 . 1 . . . . . 34 ALA C . 53479 1
243 . 1 . 1 34 34 ALA CA C 13 52.600 0.027 . 1 . . . . . 34 ALA CA . 53479 1
244 . 1 . 1 34 34 ALA CB C 13 17.795 0.028 . 1 . . . . . 34 ALA CB . 53479 1
245 . 1 . 1 34 34 ALA N N 15 123.224 0.034 . 1 . . . . . 34 ALA N . 53479 1
246 . 1 . 1 35 35 VAL H H 1 8.310 0.005 . 1 . . . . . 35 VAL H . 53479 1
247 . 1 . 1 35 35 VAL HA H 1 4.527 0.002 . 1 . . . . . 35 VAL HA . 53479 1
248 . 1 . 1 35 35 VAL HB H 1 2.148 0.004 . 1 . . . . . 35 VAL HB . 53479 1
249 . 1 . 1 35 35 VAL HG11 H 1 0.632 0.002 . 2 . . . . . 35 VAL QG1 . 53479 1
250 . 1 . 1 35 35 VAL HG12 H 1 0.632 0.002 . 2 . . . . . 35 VAL QG1 . 53479 1
251 . 1 . 1 35 35 VAL HG13 H 1 0.632 0.002 . 2 . . . . . 35 VAL QG1 . 53479 1
252 . 1 . 1 35 35 VAL HG21 H 1 0.627 0.003 . 2 . . . . . 35 VAL QG2 . 53479 1
253 . 1 . 1 35 35 VAL HG22 H 1 0.627 0.003 . 2 . . . . . 35 VAL QG2 . 53479 1
254 . 1 . 1 35 35 VAL HG23 H 1 0.627 0.003 . 2 . . . . . 35 VAL QG2 . 53479 1
255 . 1 . 1 35 35 VAL C C 13 175.147 0.016 . 1 . . . . . 35 VAL C . 53479 1
256 . 1 . 1 35 35 VAL CA C 13 59.061 0.056 . 1 . . . . . 35 VAL CA . 53479 1
257 . 1 . 1 35 35 VAL CB C 13 35.323 0.027 . 1 . . . . . 35 VAL CB . 53479 1
258 . 1 . 1 35 35 VAL CG1 C 13 19.598 0.097 . 2 . . . . . 35 VAL CG1 . 53479 1
259 . 1 . 1 35 35 VAL CG2 C 13 18.909 0.010 . 2 . . . . . 35 VAL CG2 . 53479 1
260 . 1 . 1 35 35 VAL N N 15 116.278 0.081 . 1 . . . . . 35 VAL N . 53479 1
261 . 1 . 1 36 36 THR H H 1 8.618 0.002 . 1 . . . . . 36 THR H . 53479 1
262 . 1 . 1 36 36 THR HA H 1 4.619 0.007 . 1 . . . . . 36 THR HA . 53479 1
263 . 1 . 1 36 36 THR HB H 1 4.033 0.003 . 1 . . . . . 36 THR HB . 53479 1
264 . 1 . 1 36 36 THR HG21 H 1 1.158 0.002 . 1 . . . . . 36 THR QG2 . 53479 1
265 . 1 . 1 36 36 THR HG22 H 1 1.158 0.002 . 1 . . . . . 36 THR QG2 . 53479 1
266 . 1 . 1 36 36 THR HG23 H 1 1.158 0.002 . 1 . . . . . 36 THR QG2 . 53479 1
267 . 1 . 1 36 36 THR C C 13 175.243 0.008 . 1 . . . . . 36 THR C . 53479 1
268 . 1 . 1 36 36 THR CA C 13 63.645 0.069 . 1 . . . . . 36 THR CA . 53479 1
269 . 1 . 1 36 36 THR CB C 13 68.828 0.059 . 1 . . . . . 36 THR CB . 53479 1
270 . 1 . 1 36 36 THR CG2 C 13 22.244 0.015 . 1 . . . . . 36 THR CG2 . 53479 1
271 . 1 . 1 36 36 THR N N 15 117.079 0.092 . 1 . . . . . 36 THR N . 53479 1
272 . 1 . 1 37 37 VAL H H 1 9.110 0.006 . 1 . . . . . 37 VAL H . 53479 1
273 . 1 . 1 37 37 VAL HA H 1 4.237 0.002 . 1 . . . . . 37 VAL HA . 53479 1
274 . 1 . 1 37 37 VAL HB H 1 1.670 0.006 . 1 . . . . . 37 VAL HB . 53479 1
275 . 1 . 1 37 37 VAL HG11 H 1 0.649 0.004 . 2 . . . . . 37 VAL QG1 . 53479 1
276 . 1 . 1 37 37 VAL HG12 H 1 0.649 0.004 . 2 . . . . . 37 VAL QG1 . 53479 1
277 . 1 . 1 37 37 VAL HG13 H 1 0.649 0.004 . 2 . . . . . 37 VAL QG1 . 53479 1
278 . 1 . 1 37 37 VAL HG21 H 1 0.622 0.011 . 2 . . . . . 37 VAL QG2 . 53479 1
279 . 1 . 1 37 37 VAL HG22 H 1 0.622 0.011 . 2 . . . . . 37 VAL QG2 . 53479 1
280 . 1 . 1 37 37 VAL HG23 H 1 0.622 0.011 . 2 . . . . . 37 VAL QG2 . 53479 1
281 . 1 . 1 37 37 VAL C C 13 174.520 0.011 . 1 . . . . . 37 VAL C . 53479 1
282 . 1 . 1 37 37 VAL CA C 13 62.136 0.060 . 1 . . . . . 37 VAL CA . 53479 1
283 . 1 . 1 37 37 VAL CB C 13 33.556 0.029 . 1 . . . . . 37 VAL CB . 53479 1
284 . 1 . 1 37 37 VAL CG1 C 13 21.784 0.002 . 2 . . . . . 37 VAL CG1 . 53479 1
285 . 1 . 1 37 37 VAL CG2 C 13 20.181 0.020 . 2 . . . . . 37 VAL CG2 . 53479 1
286 . 1 . 1 37 37 VAL N N 15 132.085 0.080 . 1 . . . . . 37 VAL N . 53479 1
287 . 1 . 1 38 38 SER H H 1 8.531 0.003 . 1 . . . . . 38 SER H . 53479 1
288 . 1 . 1 38 38 SER HA H 1 5.622 0.003 . 1 . . . . . 38 SER HA . 53479 1
289 . 1 . 1 38 38 SER HB2 H 1 3.562 0.011 . 2 . . . . . 38 SER HB2 . 53479 1
290 . 1 . 1 38 38 SER HB3 H 1 3.503 0.031 . 2 . . . . . 38 SER HB3 . 53479 1
291 . 1 . 1 38 38 SER C C 13 172.181 0.004 . 1 . . . . . 38 SER C . 53479 1
292 . 1 . 1 38 38 SER CA C 13 57.173 0.063 . 1 . . . . . 38 SER CA . 53479 1
293 . 1 . 1 38 38 SER CB C 13 67.379 0.041 . 1 . . . . . 38 SER CB . 53479 1
294 . 1 . 1 38 38 SER N N 15 120.711 0.089 . 1 . . . . . 38 SER N . 53479 1
295 . 1 . 1 39 39 TYR H H 1 8.615 0.002 . 1 . . . . . 39 TYR H . 53479 1
296 . 1 . 1 39 39 TYR HA H 1 5.586 0.004 . 1 . . . . . 39 TYR HA . 53479 1
297 . 1 . 1 39 39 TYR HB2 H 1 2.652 0.007 . 2 . . . . . 39 TYR HB2 . 53479 1
298 . 1 . 1 39 39 TYR HB3 H 1 2.430 0.000 . 2 . . . . . 39 TYR HB3 . 53479 1
299 . 1 . 1 39 39 TYR C C 13 175.453 0.003 . 1 . . . . . 39 TYR C . 53479 1
300 . 1 . 1 39 39 TYR CA C 13 56.614 0.038 . 1 . . . . . 39 TYR CA . 53479 1
301 . 1 . 1 39 39 TYR CB C 13 41.537 0.066 . 1 . . . . . 39 TYR CB . 53479 1
302 . 1 . 1 39 39 TYR N N 15 118.842 0.035 . 1 . . . . . 39 TYR N . 53479 1
303 . 1 . 1 40 40 PHE H H 1 9.402 0.005 . 1 . . . . . 40 PHE H . 53479 1
304 . 1 . 1 40 40 PHE HA H 1 4.792 0.005 . 1 . . . . . 40 PHE HA . 53479 1
305 . 1 . 1 40 40 PHE HB2 H 1 2.922 0.006 . 2 . . . . . 40 PHE HB2 . 53479 1
306 . 1 . 1 40 40 PHE HB3 H 1 2.449 0.003 . 2 . . . . . 40 PHE HB3 . 53479 1
307 . 1 . 1 40 40 PHE C C 13 173.944 0.009 . 1 . . . . . 40 PHE C . 53479 1
308 . 1 . 1 40 40 PHE CA C 13 56.821 0.047 . 1 . . . . . 40 PHE CA . 53479 1
309 . 1 . 1 40 40 PHE CB C 13 43.658 0.013 . 1 . . . . . 40 PHE CB . 53479 1
310 . 1 . 1 40 40 PHE N N 15 120.058 0.098 . 1 . . . . . 40 PHE N . 53479 1
311 . 1 . 1 41 41 TYR H H 1 8.982 0.006 . 1 . . . . . 41 TYR H . 53479 1
312 . 1 . 1 41 41 TYR HA H 1 4.569 0.004 . 1 . . . . . 41 TYR HA . 53479 1
313 . 1 . 1 41 41 TYR HB2 H 1 2.606 0.003 . 2 . . . . . 41 TYR HB2 . 53479 1
314 . 1 . 1 41 41 TYR HB3 H 1 2.500 0.006 . 2 . . . . . 41 TYR HB3 . 53479 1
315 . 1 . 1 41 41 TYR C C 13 173.592 0.008 . 1 . . . . . 41 TYR C . 53479 1
316 . 1 . 1 41 41 TYR CA C 13 56.130 0.037 . 1 . . . . . 41 TYR CA . 53479 1
317 . 1 . 1 41 41 TYR CB C 13 40.202 0.047 . 1 . . . . . 41 TYR CB . 53479 1
318 . 1 . 1 41 41 TYR N N 15 121.206 0.020 . 1 . . . . . 41 TYR N . 53479 1
319 . 1 . 1 42 42 ASP H H 1 8.221 0.006 . 1 . . . . . 42 ASP H . 53479 1
320 . 1 . 1 42 42 ASP HA H 1 4.528 0.002 . 1 . . . . . 42 ASP HA . 53479 1
321 . 1 . 1 42 42 ASP HB2 H 1 2.673 0.001 . 2 . . . . . 42 ASP HB2 . 53479 1
322 . 1 . 1 42 42 ASP HB3 H 1 2.132 0.006 . 2 . . . . . 42 ASP HB3 . 53479 1
323 . 1 . 1 42 42 ASP C C 13 175.790 0.004 . 1 . . . . . 42 ASP C . 53479 1
324 . 1 . 1 42 42 ASP CA C 13 51.613 0.079 . 1 . . . . . 42 ASP CA . 53479 1
325 . 1 . 1 42 42 ASP CB C 13 41.481 0.067 . 1 . . . . . 42 ASP CB . 53479 1
326 . 1 . 1 42 42 ASP N N 15 128.384 0.020 . 1 . . . . . 42 ASP N . 53479 1
327 . 1 . 1 43 43 SER H H 1 8.413 0.002 . 1 . . . . . 43 SER H . 53479 1
328 . 1 . 1 43 43 SER HA H 1 3.634 0.004 . 1 . . . . . 43 SER HA . 53479 1
329 . 1 . 1 43 43 SER HB2 H 1 3.994 0.000 . 2 . . . . . 43 SER HB2 . 53479 1
330 . 1 . 1 43 43 SER HB3 H 1 3.763 0.000 . 2 . . . . . 43 SER HB3 . 53479 1
331 . 1 . 1 43 43 SER C C 13 175.527 0.000 . 1 . . . . . 43 SER C . 53479 1
332 . 1 . 1 43 43 SER CA C 13 59.914 0.055 . 1 . . . . . 43 SER CA . 53479 1
333 . 1 . 1 43 43 SER CB C 13 63.047 0.070 . 1 . . . . . 43 SER CB . 53479 1
334 . 1 . 1 43 43 SER N N 15 120.304 0.030 . 1 . . . . . 43 SER N . 53479 1
335 . 1 . 1 44 44 THR H H 1 8.161 0.004 . 1 . . . . . 44 THR H . 53479 1
336 . 1 . 1 44 44 THR HA H 1 4.039 0.010 . 1 . . . . . 44 THR HA . 53479 1
337 . 1 . 1 44 44 THR HB H 1 4.114 0.003 . 1 . . . . . 44 THR HB . 53479 1
338 . 1 . 1 44 44 THR HG21 H 1 1.094 0.004 . 1 . . . . . 44 THR QG2 . 53479 1
339 . 1 . 1 44 44 THR HG22 H 1 1.094 0.004 . 1 . . . . . 44 THR QG2 . 53479 1
340 . 1 . 1 44 44 THR HG23 H 1 1.094 0.004 . 1 . . . . . 44 THR QG2 . 53479 1
341 . 1 . 1 44 44 THR C C 13 175.782 0.012 . 1 . . . . . 44 THR C . 53479 1
342 . 1 . 1 44 44 THR CA C 13 65.048 0.047 . 1 . . . . . 44 THR CA . 53479 1
343 . 1 . 1 44 44 THR CB C 13 68.293 0.063 . 1 . . . . . 44 THR CB . 53479 1
344 . 1 . 1 44 44 THR CG2 C 13 21.707 0.003 . 1 . . . . . 44 THR CG2 . 53479 1
345 . 1 . 1 44 44 THR N N 15 117.862 0.029 . 1 . . . . . 44 THR N . 53479 1
346 . 1 . 1 45 45 ARG H H 1 7.133 0.002 . 1 . . . . . 45 ARG H . 53479 1
347 . 1 . 1 45 45 ARG HA H 1 4.179 0.004 . 1 . . . . . 45 ARG HA . 53479 1
348 . 1 . 1 45 45 ARG HB2 H 1 1.785 0.002 . 2 . . . . . 45 ARG HB2 . 53479 1
349 . 1 . 1 45 45 ARG HB3 H 1 1.119 0.003 . 2 . . . . . 45 ARG HB3 . 53479 1
350 . 1 . 1 45 45 ARG C C 13 175.231 0.006 . 1 . . . . . 45 ARG C . 53479 1
351 . 1 . 1 45 45 ARG CA C 13 55.396 0.030 . 1 . . . . . 45 ARG CA . 53479 1
352 . 1 . 1 45 45 ARG CB C 13 31.825 0.076 . 1 . . . . . 45 ARG CB . 53479 1
353 . 1 . 1 45 45 ARG N N 15 118.745 0.035 . 1 . . . . . 45 ARG N . 53479 1
354 . 1 . 1 46 46 ASN H H 1 7.863 0.006 . 1 . . . . . 46 ASN H . 53479 1
355 . 1 . 1 46 46 ASN HA H 1 3.991 0.002 . 1 . . . . . 46 ASN HA . 53479 1
356 . 1 . 1 46 46 ASN HB2 H 1 3.187 0.002 . 2 . . . . . 46 ASN HB2 . 53479 1
357 . 1 . 1 46 46 ASN HB3 H 1 2.550 0.001 . 2 . . . . . 46 ASN HB3 . 53479 1
358 . 1 . 1 46 46 ASN C C 13 173.609 0.004 . 1 . . . . . 46 ASN C . 53479 1
359 . 1 . 1 46 46 ASN CA C 13 53.835 0.064 . 1 . . . . . 46 ASN CA . 53479 1
360 . 1 . 1 46 46 ASN CB C 13 36.499 0.023 . 1 . . . . . 46 ASN CB . 53479 1
361 . 1 . 1 46 46 ASN N N 15 117.886 0.025 . 1 . . . . . 46 ASN N . 53479 1
362 . 1 . 1 47 47 VAL H H 1 6.898 0.005 . 1 . . . . . 47 VAL H . 53479 1
363 . 1 . 1 47 47 VAL HA H 1 4.593 0.003 . 1 . . . . . 47 VAL HA . 53479 1
364 . 1 . 1 47 47 VAL HB H 1 1.953 0.004 . 1 . . . . . 47 VAL HB . 53479 1
365 . 1 . 1 47 47 VAL HG11 H 1 0.608 0.004 . 2 . . . . . 47 VAL QG . 53479 1
366 . 1 . 1 47 47 VAL HG12 H 1 0.608 0.004 . 2 . . . . . 47 VAL QG . 53479 1
367 . 1 . 1 47 47 VAL HG13 H 1 0.608 0.004 . 2 . . . . . 47 VAL QG . 53479 1
368 . 1 . 1 47 47 VAL HG21 H 1 0.790 0.004 . 2 . . . . . 47 VAL QG . 53479 1
369 . 1 . 1 47 47 VAL HG22 H 1 0.790 0.004 . 2 . . . . . 47 VAL QG . 53479 1
370 . 1 . 1 47 47 VAL HG23 H 1 0.790 0.004 . 2 . . . . . 47 VAL QG . 53479 1
371 . 1 . 1 47 47 VAL C C 13 173.282 0.005 . 1 . . . . . 47 VAL C . 53479 1
372 . 1 . 1 47 47 VAL CA C 13 59.128 0.043 . 1 . . . . . 47 VAL CA . 53479 1
373 . 1 . 1 47 47 VAL CB C 13 36.224 0.066 . 1 . . . . . 47 VAL CB . 53479 1
374 . 1 . 1 47 47 VAL N N 15 110.503 0.045 . 1 . . . . . 47 VAL N . 53479 1
375 . 1 . 1 48 48 TYR H H 1 9.435 0.004 . 1 . . . . . 48 TYR H . 53479 1
376 . 1 . 1 48 48 TYR HA H 1 5.158 0.005 . 1 . . . . . 48 TYR HA . 53479 1
377 . 1 . 1 48 48 TYR HB2 H 1 2.684 0.003 . 2 . . . . . 48 TYR HB2 . 53479 1
378 . 1 . 1 48 48 TYR HB3 H 1 2.411 0.001 . 2 . . . . . 48 TYR HB3 . 53479 1
379 . 1 . 1 48 48 TYR C C 13 175.122 0.004 . 1 . . . . . 48 TYR C . 53479 1
380 . 1 . 1 48 48 TYR CA C 13 57.568 0.084 . 1 . . . . . 48 TYR CA . 53479 1
381 . 1 . 1 48 48 TYR CB C 13 40.872 0.057 . 1 . . . . . 48 TYR CB . 53479 1
382 . 1 . 1 48 48 TYR N N 15 122.632 0.027 . 1 . . . . . 48 TYR N . 53479 1
383 . 1 . 1 49 49 ARG H H 1 9.103 0.003 . 1 . . . . . 49 ARG H . 53479 1
384 . 1 . 1 49 49 ARG HA H 1 5.272 0.002 . 1 . . . . . 49 ARG HA . 53479 1
385 . 1 . 1 49 49 ARG HB2 H 1 1.646 0.010 . 2 . . . . . 49 ARG HB2 . 53479 1
386 . 1 . 1 49 49 ARG HB3 H 1 1.331 0.008 . 2 . . . . . 49 ARG HB3 . 53479 1
387 . 1 . 1 49 49 ARG C C 13 174.596 0.006 . 1 . . . . . 49 ARG C . 53479 1
388 . 1 . 1 49 49 ARG CA C 13 54.171 0.027 . 1 . . . . . 49 ARG CA . 53479 1
389 . 1 . 1 49 49 ARG CB C 13 35.023 0.037 . 1 . . . . . 49 ARG CB . 53479 1
390 . 1 . 1 49 49 ARG N N 15 118.764 0.032 . 1 . . . . . 49 ARG N . 53479 1
391 . 1 . 1 50 50 ILE H H 1 8.935 0.002 . 1 . . . . . 50 ILE H . 53479 1
392 . 1 . 1 50 50 ILE HA H 1 4.757 0.004 . 1 . . . . . 50 ILE HA . 53479 1
393 . 1 . 1 50 50 ILE HB H 1 1.373 0.004 . 1 . . . . . 50 ILE HB . 53479 1
394 . 1 . 1 50 50 ILE HG21 H 1 0.539 0.008 . 1 . . . . . 50 ILE QG2 . 53479 1
395 . 1 . 1 50 50 ILE HG22 H 1 0.539 0.008 . 1 . . . . . 50 ILE QG2 . 53479 1
396 . 1 . 1 50 50 ILE HG23 H 1 0.539 0.008 . 1 . . . . . 50 ILE QG2 . 53479 1
397 . 1 . 1 50 50 ILE C C 13 174.594 0.012 . 1 . . . . . 50 ILE C . 53479 1
398 . 1 . 1 50 50 ILE CA C 13 59.945 0.061 . 1 . . . . . 50 ILE CA . 53479 1
399 . 1 . 1 50 50 ILE CB C 13 39.836 0.044 . 1 . . . . . 50 ILE CB . 53479 1
400 . 1 . 1 50 50 ILE CG2 C 13 17.786 0.022 . 1 . . . . . 50 ILE CG2 . 53479 1
401 . 1 . 1 50 50 ILE N N 15 121.448 0.031 . 1 . . . . . 50 ILE N . 53479 1
402 . 1 . 1 51 51 ILE H H 1 8.951 0.004 . 1 . . . . . 51 ILE H . 53479 1
403 . 1 . 1 51 51 ILE HA H 1 4.877 0.002 . 1 . . . . . 51 ILE HA . 53479 1
404 . 1 . 1 51 51 ILE HB H 1 1.620 0.004 . 1 . . . . . 51 ILE HB . 53479 1
405 . 1 . 1 51 51 ILE HG12 H 1 0.384 0.008 . 1 . . . . . 51 ILE QG1 . 53479 1
406 . 1 . 1 51 51 ILE HG13 H 1 0.384 0.008 . 1 . . . . . 51 ILE QG1 . 53479 1
407 . 1 . 1 51 51 ILE HG21 H 1 0.712 0.002 . 1 . . . . . 51 ILE QG2 . 53479 1
408 . 1 . 1 51 51 ILE HG22 H 1 0.712 0.002 . 1 . . . . . 51 ILE QG2 . 53479 1
409 . 1 . 1 51 51 ILE HG23 H 1 0.712 0.002 . 1 . . . . . 51 ILE QG2 . 53479 1
410 . 1 . 1 51 51 ILE C C 13 175.634 0.011 . 1 . . . . . 51 ILE C . 53479 1
411 . 1 . 1 51 51 ILE CA C 13 58.541 0.068 . 1 . . . . . 51 ILE CA . 53479 1
412 . 1 . 1 51 51 ILE CB C 13 42.056 0.043 . 1 . . . . . 51 ILE CB . 53479 1
413 . 1 . 1 51 51 ILE CG1 C 13 12.350 0.054 . 1 . . . . . 51 ILE CG1 . 53479 1
414 . 1 . 1 51 51 ILE CG2 C 13 16.867 0.018 . 1 . . . . . 51 ILE CG2 . 53479 1
415 . 1 . 1 51 51 ILE N N 15 124.944 0.097 . 1 . . . . . 51 ILE N . 53479 1
416 . 1 . 1 52 52 SER H H 1 8.378 0.008 . 1 . . . . . 52 SER H . 53479 1
417 . 1 . 1 52 52 SER HA H 1 4.805 0.002 . 1 . . . . . 52 SER HA . 53479 1
418 . 1 . 1 52 52 SER HB2 H 1 3.503 0.007 . 2 . . . . . 52 SER HB2 . 53479 1
419 . 1 . 1 52 52 SER HB3 H 1 3.266 0.005 . 2 . . . . . 52 SER HB3 . 53479 1
420 . 1 . 1 52 52 SER C C 13 173.350 0.040 . 1 . . . . . 52 SER C . 53479 1
421 . 1 . 1 52 52 SER CA C 13 57.548 0.021 . 1 . . . . . 52 SER CA . 53479 1
422 . 1 . 1 52 52 SER CB C 13 66.131 0.048 . 1 . . . . . 52 SER CB . 53479 1
423 . 1 . 1 52 52 SER N N 15 121.381 0.085 . 1 . . . . . 52 SER N . 53479 1
424 . 1 . 1 53 53 LEU H H 1 8.960 0.004 . 1 . . . . . 53 LEU H . 53479 1
425 . 1 . 1 53 53 LEU HA H 1 5.022 0.007 . 1 . . . . . 53 LEU HA . 53479 1
426 . 1 . 1 53 53 LEU HB2 H 1 1.571 0.002 . 2 . . . . . 53 LEU HB2 . 53479 1
427 . 1 . 1 53 53 LEU HB3 H 1 1.410 0.004 . 2 . . . . . 53 LEU HB3 . 53479 1
428 . 1 . 1 53 53 LEU HG H 1 0.621 0.004 . 1 . . . . . 53 LEU HG . 53479 1
429 . 1 . 1 53 53 LEU C C 13 175.518 0.005 . 1 . . . . . 53 LEU C . 53479 1
430 . 1 . 1 53 53 LEU CA C 13 54.138 0.052 . 1 . . . . . 53 LEU CA . 53479 1
431 . 1 . 1 53 53 LEU CB C 13 44.480 0.034 . 1 . . . . . 53 LEU CB . 53479 1
432 . 1 . 1 53 53 LEU CG C 13 23.597 0.009 . 1 . . . . . 53 LEU CG . 53479 1
433 . 1 . 1 53 53 LEU N N 15 130.024 0.026 . 1 . . . . . 53 LEU N . 53479 1
434 . 1 . 1 54 54 ASP H H 1 8.714 0.004 . 1 . . . . . 54 ASP H . 53479 1
435 . 1 . 1 54 54 ASP HA H 1 4.802 0.001 . 1 . . . . . 54 ASP HA . 53479 1
436 . 1 . 1 54 54 ASP HB2 H 1 2.752 0.005 . 2 . . . . . 54 ASP HB2 . 53479 1
437 . 1 . 1 54 54 ASP HB3 H 1 2.342 0.009 . 2 . . . . . 54 ASP HB3 . 53479 1
438 . 1 . 1 54 54 ASP C C 13 176.927 0.013 . 1 . . . . . 54 ASP C . 53479 1
439 . 1 . 1 54 54 ASP CA C 13 52.551 0.034 . 1 . . . . . 54 ASP CA . 53479 1
440 . 1 . 1 54 54 ASP CB C 13 41.959 0.074 . 1 . . . . . 54 ASP CB . 53479 1
441 . 1 . 1 54 54 ASP N N 15 120.860 0.020 . 1 . . . . . 54 ASP N . 53479 1
442 . 1 . 1 55 55 GLY H H 1 8.587 0.007 . 1 . . . . . 55 GLY H . 53479 1
443 . 1 . 1 55 55 GLY HA2 H 1 4.031 0.002 . 2 . . . . . 55 GLY HA2 . 53479 1
444 . 1 . 1 55 55 GLY HA3 H 1 3.570 0.000 . 2 . . . . . 55 GLY HA3 . 53479 1
445 . 1 . 1 55 55 GLY C C 13 174.649 0.000 . 1 . . . . . 55 GLY C . 53479 1
446 . 1 . 1 55 55 GLY CA C 13 46.919 0.018 . 1 . . . . . 55 GLY CA . 53479 1
447 . 1 . 1 55 55 GLY N N 15 115.075 0.041 . 1 . . . . . 55 GLY N . 53479 1
448 . 1 . 1 56 56 SER C C 13 173.633 0.005 . 1 . . . . . 56 SER C . 53479 1
449 . 1 . 1 56 56 SER CA C 13 58.450 0.057 . 1 . . . . . 56 SER CA . 53479 1
450 . 1 . 1 56 56 SER CB C 13 63.702 0.022 . 1 . . . . . 56 SER CB . 53479 1
451 . 1 . 1 57 57 LYS H H 1 7.731 0.006 . 1 . . . . . 57 LYS H . 53479 1
452 . 1 . 1 57 57 LYS HA H 1 4.333 0.002 . 1 . . . . . 57 LYS HA . 53479 1
453 . 1 . 1 57 57 LYS HB2 H 1 1.851 0.003 . 2 . . . . . 57 LYS HB2 . 53479 1
454 . 1 . 1 57 57 LYS HB3 H 1 1.759 0.003 . 2 . . . . . 57 LYS HB3 . 53479 1
455 . 1 . 1 57 57 LYS HG2 H 1 1.339 0.005 . 2 . . . . . 57 LYS HG2 . 53479 1
456 . 1 . 1 57 57 LYS HG3 H 1 1.221 0.003 . 2 . . . . . 57 LYS HG3 . 53479 1
457 . 1 . 1 57 57 LYS HD2 H 1 1.616 0.008 . 2 . . . . . 57 LYS HD2 . 53479 1
458 . 1 . 1 57 57 LYS HD3 H 1 1.616 0.008 . 2 . . . . . 57 LYS HD3 . 53479 1
459 . 1 . 1 57 57 LYS HE2 H 1 2.910 0.004 . 2 . . . . . 57 LYS HE2 . 53479 1
460 . 1 . 1 57 57 LYS HE3 H 1 2.910 0.004 . 2 . . . . . 57 LYS HE3 . 53479 1
461 . 1 . 1 57 57 LYS C C 13 174.893 0.025 . 1 . . . . . 57 LYS C . 53479 1
462 . 1 . 1 57 57 LYS CA C 13 55.254 0.035 . 1 . . . . . 57 LYS CA . 53479 1
463 . 1 . 1 57 57 LYS CB C 13 34.082 0.058 . 1 . . . . . 57 LYS CB . 53479 1
464 . 1 . 1 57 57 LYS CG C 13 24.472 0.046 . 1 . . . . . 57 LYS CG . 53479 1
465 . 1 . 1 57 57 LYS CD C 13 29.130 0.009 . 1 . . . . . 57 LYS CD . 53479 1
466 . 1 . 1 57 57 LYS CE C 13 41.872 0.018 . 1 . . . . . 57 LYS CE . 53479 1
467 . 1 . 1 57 57 LYS N N 15 123.015 0.030 . 1 . . . . . 57 LYS N . 53479 1
468 . 1 . 1 58 58 ALA H H 1 8.696 0.005 . 1 . . . . . 58 ALA H . 53479 1
469 . 1 . 1 58 58 ALA HA H 1 4.675 0.011 . 1 . . . . . 58 ALA HA . 53479 1
470 . 1 . 1 58 58 ALA HB1 H 1 1.203 0.003 . 1 . . . . . 58 ALA HB# . 53479 1
471 . 1 . 1 58 58 ALA HB2 H 1 1.203 0.003 . 1 . . . . . 58 ALA HB# . 53479 1
472 . 1 . 1 58 58 ALA HB3 H 1 1.203 0.003 . 1 . . . . . 58 ALA HB# . 53479 1
473 . 1 . 1 58 58 ALA C C 13 177.271 0.004 . 1 . . . . . 58 ALA C . 53479 1
474 . 1 . 1 58 58 ALA CA C 13 52.068 0.032 . 1 . . . . . 58 ALA CA . 53479 1
475 . 1 . 1 58 58 ALA CB C 13 17.299 0.043 . 1 . . . . . 58 ALA CB . 53479 1
476 . 1 . 1 58 58 ALA N N 15 128.202 0.019 . 1 . . . . . 58 ALA N . 53479 1
477 . 1 . 1 59 59 ILE H H 1 8.557 0.003 . 1 . . . . . 59 ILE H . 53479 1
478 . 1 . 1 59 59 ILE HA H 1 4.212 0.002 . 1 . . . . . 59 ILE HA . 53479 1
479 . 1 . 1 59 59 ILE HB H 1 1.788 0.003 . 1 . . . . . 59 ILE HB . 53479 1
480 . 1 . 1 59 59 ILE C C 13 176.148 0.008 . 1 . . . . . 59 ILE C . 53479 1
481 . 1 . 1 59 59 ILE CA C 13 62.524 0.026 . 1 . . . . . 59 ILE CA . 53479 1
482 . 1 . 1 59 59 ILE CB C 13 38.587 0.021 . 1 . . . . . 59 ILE CB . 53479 1
483 . 1 . 1 59 59 ILE N N 15 122.189 0.026 . 1 . . . . . 59 ILE N . 53479 1
484 . 1 . 1 60 60 ILE H H 1 7.521 0.002 . 1 . . . . . 60 ILE H . 53479 1
485 . 1 . 1 60 60 ILE HA H 1 3.770 0.001 . 1 . . . . . 60 ILE HA . 53479 1
486 . 1 . 1 60 60 ILE HB H 1 1.149 0.002 . 1 . . . . . 60 ILE HB . 53479 1
487 . 1 . 1 60 60 ILE HG21 H 1 0.418 0.006 . 1 . . . . . 60 ILE QG2 . 53479 1
488 . 1 . 1 60 60 ILE HG22 H 1 0.418 0.006 . 1 . . . . . 60 ILE QG2 . 53479 1
489 . 1 . 1 60 60 ILE HG23 H 1 0.418 0.006 . 1 . . . . . 60 ILE QG2 . 53479 1
490 . 1 . 1 60 60 ILE C C 13 174.814 0.005 . 1 . . . . . 60 ILE C . 53479 1
491 . 1 . 1 60 60 ILE CA C 13 62.193 0.068 . 1 . . . . . 60 ILE CA . 53479 1
492 . 1 . 1 60 60 ILE CB C 13 42.207 0.029 . 1 . . . . . 60 ILE CB . 53479 1
493 . 1 . 1 60 60 ILE CG2 C 13 16.901 0.017 . 1 . . . . . 60 ILE CG2 . 53479 1
494 . 1 . 1 60 60 ILE N N 15 117.441 0.088 . 1 . . . . . 60 ILE N . 53479 1
495 . 1 . 1 61 61 ASN H H 1 7.994 0.008 . 1 . . . . . 61 ASN H . 53479 1
496 . 1 . 1 61 61 ASN HA H 1 5.110 0.002 . 1 . . . . . 61 ASN HA . 53479 1
497 . 1 . 1 61 61 ASN HB2 H 1 2.847 0.008 . 2 . . . . . 61 ASN HB2 . 53479 1
498 . 1 . 1 61 61 ASN HB3 H 1 2.460 0.005 . 2 . . . . . 61 ASN HB3 . 53479 1
499 . 1 . 1 61 61 ASN C C 13 174.566 0.008 . 1 . . . . . 61 ASN C . 53479 1
500 . 1 . 1 61 61 ASN CA C 13 53.162 0.065 . 1 . . . . . 61 ASN CA . 53479 1
501 . 1 . 1 61 61 ASN CB C 13 37.804 0.072 . 1 . . . . . 61 ASN CB . 53479 1
502 . 1 . 1 61 61 ASN N N 15 124.264 0.040 . 1 . . . . . 61 ASN N . 53479 1
503 . 1 . 1 62 62 SER H H 1 8.904 0.004 . 1 . . . . . 62 SER H . 53479 1
504 . 1 . 1 62 62 SER HA H 1 5.139 0.014 . 1 . . . . . 62 SER HA . 53479 1
505 . 1 . 1 62 62 SER HB2 H 1 3.894 0.003 . 2 . . . . . 62 SER HB2 . 53479 1
506 . 1 . 1 62 62 SER HB3 H 1 3.765 0.006 . 2 . . . . . 62 SER HB3 . 53479 1
507 . 1 . 1 62 62 SER C C 13 174.316 0.001 . 1 . . . . . 62 SER C . 53479 1
508 . 1 . 1 62 62 SER CA C 13 57.249 0.089 . 1 . . . . . 62 SER CA . 53479 1
509 . 1 . 1 62 62 SER CB C 13 66.139 0.031 . 1 . . . . . 62 SER CB . 53479 1
510 . 1 . 1 62 62 SER N N 15 118.709 0.021 . 1 . . . . . 62 SER N . 53479 1
511 . 1 . 1 63 63 THR H H 1 8.962 0.009 . 1 . . . . . 63 THR H . 53479 1
512 . 1 . 1 63 63 THR HA H 1 4.540 0.005 . 1 . . . . . 63 THR HA . 53479 1
513 . 1 . 1 63 63 THR HB H 1 4.035 0.002 . 1 . . . . . 63 THR HB . 53479 1
514 . 1 . 1 63 63 THR C C 13 173.959 0.038 . 1 . . . . . 63 THR C . 53479 1
515 . 1 . 1 63 63 THR CA C 13 63.046 0.071 . 1 . . . . . 63 THR CA . 53479 1
516 . 1 . 1 63 63 THR CB C 13 69.661 0.080 . 1 . . . . . 63 THR CB . 53479 1
517 . 1 . 1 63 63 THR N N 15 123.445 0.050 . 1 . . . . . 63 THR N . 53479 1
518 . 1 . 1 64 64 ILE H H 1 8.719 0.005 . 1 . . . . . 64 ILE H . 53479 1
519 . 1 . 1 64 64 ILE HA H 1 3.861 0.003 . 1 . . . . . 64 ILE HA . 53479 1
520 . 1 . 1 64 64 ILE HB H 1 1.850 0.006 . 1 . . . . . 64 ILE HB . 53479 1
521 . 1 . 1 64 64 ILE HG21 H 1 0.499 0.002 . 1 . . . . . 64 ILE QG2 . 53479 1
522 . 1 . 1 64 64 ILE HG22 H 1 0.499 0.002 . 1 . . . . . 64 ILE QG2 . 53479 1
523 . 1 . 1 64 64 ILE HG23 H 1 0.499 0.002 . 1 . . . . . 64 ILE QG2 . 53479 1
524 . 1 . 1 64 64 ILE C C 13 174.724 0.006 . 1 . . . . . 64 ILE C . 53479 1
525 . 1 . 1 64 64 ILE CA C 13 62.556 0.052 . 1 . . . . . 64 ILE CA . 53479 1
526 . 1 . 1 64 64 ILE CB C 13 36.130 0.030 . 1 . . . . . 64 ILE CB . 53479 1
527 . 1 . 1 64 64 ILE CG2 C 13 12.171 0.043 . 1 . . . . . 64 ILE CG2 . 53479 1
528 . 1 . 1 64 64 ILE N N 15 125.892 0.088 . 1 . . . . . 64 ILE N . 53479 1
529 . 1 . 1 65 65 THR H H 1 6.754 0.003 . 1 . . . . . 65 THR H . 53479 1
530 . 1 . 1 65 65 THR HA H 1 4.913 0.006 . 1 . . . . . 65 THR HA . 53479 1
531 . 1 . 1 65 65 THR HB H 1 3.903 0.000 . 1 . . . . . 65 THR HB . 53479 1
532 . 1 . 1 65 65 THR C C 13 172.964 0.000 . 1 . . . . . 65 THR C . 53479 1
533 . 1 . 1 65 65 THR CA C 13 58.821 0.086 . 1 . . . . . 65 THR CA . 53479 1
534 . 1 . 1 65 65 THR CB C 13 68.832 0.075 . 1 . . . . . 65 THR CB . 53479 1
535 . 1 . 1 65 65 THR N N 15 118.679 0.094 . 1 . . . . . 65 THR N . 53479 1
536 . 1 . 1 67 67 ASN C C 13 174.793 0.012 . 1 . . . . . 67 ASN C . 53479 1
537 . 1 . 1 67 67 ASN CA C 13 53.090 0.016 . 1 . . . . . 67 ASN CA . 53479 1
538 . 1 . 1 67 67 ASN CB C 13 39.338 0.055 . 1 . . . . . 67 ASN CB . 53479 1
539 . 1 . 1 68 68 ILE H H 1 7.360 0.003 . 1 . . . . . 68 ILE H . 53479 1
540 . 1 . 1 68 68 ILE HA H 1 4.706 0.000 . 1 . . . . . 68 ILE HA . 53479 1
541 . 1 . 1 68 68 ILE HB H 1 2.147 0.006 . 1 . . . . . 68 ILE HB . 53479 1
542 . 1 . 1 68 68 ILE HG21 H 1 1.037 0.002 . 1 . . . . . 68 ILE QG2 . 53479 1
543 . 1 . 1 68 68 ILE HG22 H 1 1.037 0.002 . 1 . . . . . 68 ILE QG2 . 53479 1
544 . 1 . 1 68 68 ILE HG23 H 1 1.037 0.002 . 1 . . . . . 68 ILE QG2 . 53479 1
545 . 1 . 1 68 68 ILE C C 13 175.029 0.015 . 1 . . . . . 68 ILE C . 53479 1
546 . 1 . 1 68 68 ILE CA C 13 61.345 0.063 . 1 . . . . . 68 ILE CA . 53479 1
547 . 1 . 1 68 68 ILE CB C 13 39.567 0.083 . 1 . . . . . 68 ILE CB . 53479 1
548 . 1 . 1 68 68 ILE CG2 C 13 17.793 0.016 . 1 . . . . . 68 ILE CG2 . 53479 1
549 . 1 . 1 68 68 ILE N N 15 121.169 0.093 . 1 . . . . . 68 ILE N . 53479 1
550 . 1 . 1 69 69 THR H H 1 8.726 0.006 . 1 . . . . . 69 THR H . 53479 1
551 . 1 . 1 69 69 THR HA H 1 4.666 0.008 . 1 . . . . . 69 THR HA . 53479 1
552 . 1 . 1 69 69 THR HB H 1 3.944 0.007 . 1 . . . . . 69 THR HB . 53479 1
553 . 1 . 1 69 69 THR HG21 H 1 1.106 0.000 . 1 . . . . . 69 THR QG2 . 53479 1
554 . 1 . 1 69 69 THR HG22 H 1 1.106 0.000 . 1 . . . . . 69 THR QG2 . 53479 1
555 . 1 . 1 69 69 THR HG23 H 1 1.106 0.000 . 1 . . . . . 69 THR QG2 . 53479 1
556 . 1 . 1 69 69 THR C C 13 172.142 0.007 . 1 . . . . . 69 THR C . 53479 1
557 . 1 . 1 69 69 THR CA C 13 61.494 0.067 . 1 . . . . . 69 THR CA . 53479 1
558 . 1 . 1 69 69 THR CB C 13 72.144 0.040 . 1 . . . . . 69 THR CB . 53479 1
559 . 1 . 1 69 69 THR N N 15 119.684 0.042 . 1 . . . . . 69 THR N . 53479 1
560 . 1 . 1 70 70 PHE H H 1 8.387 0.007 . 1 . . . . . 70 PHE H . 53479 1
561 . 1 . 1 70 70 PHE HA H 1 5.013 0.004 . 1 . . . . . 70 PHE HA . 53479 1
562 . 1 . 1 70 70 PHE HB2 H 1 2.284 0.013 . 2 . . . . . 70 PHE HB2 . 53479 1
563 . 1 . 1 70 70 PHE HB3 H 1 0.936 0.013 . 2 . . . . . 70 PHE HB3 . 53479 1
564 . 1 . 1 70 70 PHE C C 13 174.835 0.012 . 1 . . . . . 70 PHE C . 53479 1
565 . 1 . 1 70 70 PHE CA C 13 56.659 0.072 . 1 . . . . . 70 PHE CA . 53479 1
566 . 1 . 1 70 70 PHE CB C 13 39.068 0.019 . 1 . . . . . 70 PHE CB . 53479 1
567 . 1 . 1 70 70 PHE N N 15 128.266 0.034 . 1 . . . . . 70 PHE N . 53479 1
568 . 1 . 1 71 71 THR H H 1 8.535 0.005 . 1 . . . . . 71 THR H . 53479 1
569 . 1 . 1 71 71 THR HA H 1 4.323 0.001 . 1 . . . . . 71 THR HA . 53479 1
570 . 1 . 1 71 71 THR HB H 1 3.642 0.003 . 1 . . . . . 71 THR HB . 53479 1
571 . 1 . 1 71 71 THR HG21 H 1 1.007 0.004 . 1 . . . . . 71 THR QG2 . 53479 1
572 . 1 . 1 71 71 THR HG22 H 1 1.007 0.004 . 1 . . . . . 71 THR QG2 . 53479 1
573 . 1 . 1 71 71 THR HG23 H 1 1.007 0.004 . 1 . . . . . 71 THR QG2 . 53479 1
574 . 1 . 1 71 71 THR C C 13 172.871 0.001 . 1 . . . . . 71 THR C . 53479 1
575 . 1 . 1 71 71 THR CA C 13 60.718 0.031 . 1 . . . . . 71 THR CA . 53479 1
576 . 1 . 1 71 71 THR CB C 13 70.956 0.029 . 1 . . . . . 71 THR CB . 53479 1
577 . 1 . 1 71 71 THR CG2 C 13 21.478 0.002 . 1 . . . . . 71 THR CG2 . 53479 1
578 . 1 . 1 71 71 THR N N 15 123.822 0.034 . 1 . . . . . 71 THR N . 53479 1
579 . 1 . 1 72 72 LYS H H 1 8.738 0.004 . 1 . . . . . 72 LYS H . 53479 1
580 . 1 . 1 72 72 LYS HA H 1 4.466 0.002 . 1 . . . . . 72 LYS HA . 53479 1
581 . 1 . 1 72 72 LYS C C 13 175.986 0.002 . 1 . . . . . 72 LYS C . 53479 1
582 . 1 . 1 72 72 LYS CA C 13 56.519 0.071 . 1 . . . . . 72 LYS CA . 53479 1
583 . 1 . 1 72 72 LYS CB C 13 32.302 0.089 . 1 . . . . . 72 LYS CB . 53479 1
584 . 1 . 1 72 72 LYS N N 15 126.674 0.032 . 1 . . . . . 72 LYS N . 53479 1
585 . 1 . 1 73 73 THR H H 1 8.619 0.003 . 1 . . . . . 73 THR H . 53479 1
586 . 1 . 1 73 73 THR HA H 1 4.289 0.006 . 1 . . . . . 73 THR HA . 53479 1
587 . 1 . 1 73 73 THR HB H 1 4.154 0.008 . 1 . . . . . 73 THR HB . 53479 1
588 . 1 . 1 73 73 THR HG21 H 1 1.091 0.005 . 1 . . . . . 73 THR QG2 . 53479 1
589 . 1 . 1 73 73 THR HG22 H 1 1.091 0.005 . 1 . . . . . 73 THR QG2 . 53479 1
590 . 1 . 1 73 73 THR HG23 H 1 1.091 0.005 . 1 . . . . . 73 THR QG2 . 53479 1
591 . 1 . 1 73 73 THR C C 13 174.244 0.009 . 1 . . . . . 73 THR C . 53479 1
592 . 1 . 1 73 73 THR CA C 13 63.273 0.047 . 1 . . . . . 73 THR CA . 53479 1
593 . 1 . 1 73 73 THR CB C 13 69.221 0.037 . 1 . . . . . 73 THR CB . 53479 1
594 . 1 . 1 73 73 THR CG2 C 13 22.040 0.065 . 1 . . . . . 73 THR CG2 . 53479 1
595 . 1 . 1 73 73 THR N N 15 120.275 0.028 . 1 . . . . . 73 THR N . 53479 1
596 . 1 . 1 74 74 SER H H 1 8.443 0.002 . 1 . . . . . 74 SER H . 53479 1
597 . 1 . 1 74 74 SER HA H 1 4.518 0.004 . 1 . . . . . 74 SER HA . 53479 1
598 . 1 . 1 74 74 SER HB2 H 1 4.068 0.003 . 2 . . . . . 74 SER HB2 . 53479 1
599 . 1 . 1 74 74 SER HB3 H 1 3.917 0.002 . 2 . . . . . 74 SER HB3 . 53479 1
600 . 1 . 1 74 74 SER C C 13 173.668 0.000 . 1 . . . . . 74 SER C . 53479 1
601 . 1 . 1 74 74 SER CA C 13 57.288 0.081 . 1 . . . . . 74 SER CA . 53479 1
602 . 1 . 1 74 74 SER CB C 13 63.614 0.025 . 1 . . . . . 74 SER CB . 53479 1
603 . 1 . 1 74 74 SER N N 15 116.238 0.023 . 1 . . . . . 74 SER N . 53479 1
604 . 1 . 1 76 76 LYS CA C 13 55.543 0.015 . 1 . . . . . 76 LYS CA . 53479 1
605 . 1 . 1 76 76 LYS CB C 13 33.576 0.040 . 1 . . . . . 76 LYS CB . 53479 1
606 . 1 . 1 77 77 PHE H H 1 7.414 0.007 . 1 . . . . . 77 PHE H . 53479 1
607 . 1 . 1 77 77 PHE HA H 1 5.938 0.003 . 1 . . . . . 77 PHE HA . 53479 1
608 . 1 . 1 77 77 PHE HB2 H 1 2.816 0.001 . 2 . . . . . 77 PHE HB2 . 53479 1
609 . 1 . 1 77 77 PHE HB3 H 1 2.520 0.009 . 2 . . . . . 77 PHE HB3 . 53479 1
610 . 1 . 1 77 77 PHE C C 13 174.050 0.037 . 1 . . . . . 77 PHE C . 53479 1
611 . 1 . 1 77 77 PHE CA C 13 56.378 0.036 . 1 . . . . . 77 PHE CA . 53479 1
612 . 1 . 1 77 77 PHE CB C 13 44.084 0.042 . 1 . . . . . 77 PHE CB . 53479 1
613 . 1 . 1 77 77 PHE N N 15 123.878 0.021 . 1 . . . . . 77 PHE N . 53479 1
614 . 1 . 1 78 78 GLY H H 1 8.081 0.004 . 1 . . . . . 78 GLY H . 53479 1
615 . 1 . 1 78 78 GLY HA2 H 1 4.809 0.006 . 2 . . . . . 78 GLY HA2 . 53479 1
616 . 1 . 1 78 78 GLY HA3 H 1 4.800 0.008 . 2 . . . . . 78 GLY HA3 . 53479 1
617 . 1 . 1 78 78 GLY C C 13 169.715 0.000 . 1 . . . . . 78 GLY C . 53479 1
618 . 1 . 1 78 78 GLY CA C 13 45.292 0.042 . 1 . . . . . 78 GLY CA . 53479 1
619 . 1 . 1 78 78 GLY N N 15 112.194 0.019 . 1 . . . . . 78 GLY N . 53479 1
620 . 1 . 1 79 79 GLN H H 1 8.100 0.006 . 1 . . . . . 79 GLN H . 53479 1
621 . 1 . 1 79 79 GLN HA H 1 5.668 0.002 . 1 . . . . . 79 GLN HA . 53479 1
622 . 1 . 1 79 79 GLN HB2 H 1 2.015 0.010 . 2 . . . . . 79 GLN HB2 . 53479 1
623 . 1 . 1 79 79 GLN HB3 H 1 1.873 0.012 . 2 . . . . . 79 GLN HB3 . 53479 1
624 . 1 . 1 79 79 GLN C C 13 173.801 0.012 . 1 . . . . . 79 GLN C . 53479 1
625 . 1 . 1 79 79 GLN CA C 13 53.793 0.057 . 1 . . . . . 79 GLN CA . 53479 1
626 . 1 . 1 79 79 GLN CB C 13 34.888 0.050 . 1 . . . . . 79 GLN CB . 53479 1
627 . 1 . 1 79 79 GLN N N 15 114.149 0.038 . 1 . . . . . 79 GLN N . 53479 1
628 . 1 . 1 80 80 TRP H H 1 9.098 0.005 . 1 . . . . . 80 TRP H . 53479 1
629 . 1 . 1 80 80 TRP HA H 1 5.206 0.004 . 1 . . . . . 80 TRP HA . 53479 1
630 . 1 . 1 80 80 TRP HB2 H 1 3.467 0.002 . 2 . . . . . 80 TRP HB2 . 53479 1
631 . 1 . 1 80 80 TRP HB3 H 1 3.290 0.001 . 2 . . . . . 80 TRP HB3 . 53479 1
632 . 1 . 1 80 80 TRP C C 13 172.263 0.017 . 1 . . . . . 80 TRP C . 53479 1
633 . 1 . 1 80 80 TRP CA C 13 57.838 0.026 . 1 . . . . . 80 TRP CA . 53479 1
634 . 1 . 1 80 80 TRP CB C 13 33.695 0.040 . 1 . . . . . 80 TRP CB . 53479 1
635 . 1 . 1 80 80 TRP N N 15 121.202 0.076 . 1 . . . . . 80 TRP N . 53479 1
636 . 1 . 1 81 81 ALA H H 1 8.602 0.003 . 1 . . . . . 81 ALA H . 53479 1
637 . 1 . 1 81 81 ALA HA H 1 4.850 0.004 . 1 . . . . . 81 ALA HA . 53479 1
638 . 1 . 1 81 81 ALA HB1 H 1 1.412 0.003 . 1 . . . . . 81 ALA HB# . 53479 1
639 . 1 . 1 81 81 ALA HB2 H 1 1.412 0.003 . 1 . . . . . 81 ALA HB# . 53479 1
640 . 1 . 1 81 81 ALA HB3 H 1 1.412 0.003 . 1 . . . . . 81 ALA HB# . 53479 1
641 . 1 . 1 81 81 ALA C C 13 176.462 0.004 . 1 . . . . . 81 ALA C . 53479 1
642 . 1 . 1 81 81 ALA CA C 13 51.069 0.052 . 1 . . . . . 81 ALA CA . 53479 1
643 . 1 . 1 81 81 ALA CB C 13 20.536 0.006 . 1 . . . . . 81 ALA CB . 53479 1
644 . 1 . 1 81 81 ALA N N 15 124.284 0.026 . 1 . . . . . 81 ALA N . 53479 1
645 . 1 . 1 82 82 ASP H H 1 8.442 0.005 . 1 . . . . . 82 ASP H . 53479 1
646 . 1 . 1 82 82 ASP HA H 1 5.108 0.002 . 1 . . . . . 82 ASP HA . 53479 1
647 . 1 . 1 82 82 ASP HB2 H 1 3.057 0.009 . 2 . . . . . 82 ASP HB2 . 53479 1
648 . 1 . 1 82 82 ASP HB3 H 1 2.577 0.006 . 2 . . . . . 82 ASP HB3 . 53479 1
649 . 1 . 1 82 82 ASP C C 13 176.768 0.000 . 1 . . . . . 82 ASP C . 53479 1
650 . 1 . 1 82 82 ASP CA C 13 52.575 0.096 . 1 . . . . . 82 ASP CA . 53479 1
651 . 1 . 1 82 82 ASP CB C 13 43.817 0.042 . 1 . . . . . 82 ASP CB . 53479 1
652 . 1 . 1 82 82 ASP N N 15 122.194 0.020 . 1 . . . . . 82 ASP N . 53479 1
653 . 1 . 1 83 83 SER C C 13 176.225 0.000 . 1 . . . . . 83 SER C . 53479 1
654 . 1 . 1 83 83 SER CA C 13 60.738 0.015 . 1 . . . . . 83 SER CA . 53479 1
655 . 1 . 1 83 83 SER CB C 13 63.009 0.025 . 1 . . . . . 83 SER CB . 53479 1
656 . 1 . 1 84 84 ARG H H 1 8.355 0.002 . 1 . . . . . 84 ARG H . 53479 1
657 . 1 . 1 84 84 ARG HA H 1 3.576 0.000 . 1 . . . . . 84 ARG HA . 53479 1
658 . 1 . 1 84 84 ARG HB2 H 1 1.637 0.002 . 2 . . . . . 84 ARG HB2 . 53479 1
659 . 1 . 1 84 84 ARG HB3 H 1 1.502 0.000 . 2 . . . . . 84 ARG HB3 . 53479 1
660 . 1 . 1 84 84 ARG C C 13 177.422 0.020 . 1 . . . . . 84 ARG C . 53479 1
661 . 1 . 1 84 84 ARG CA C 13 58.136 0.053 . 1 . . . . . 84 ARG CA . 53479 1
662 . 1 . 1 84 84 ARG CB C 13 29.862 0.077 . 1 . . . . . 84 ARG CB . 53479 1
663 . 1 . 1 84 84 ARG N N 15 123.202 0.084 . 1 . . . . . 84 ARG N . 53479 1
664 . 1 . 1 85 85 ALA H H 1 7.922 0.004 . 1 . . . . . 85 ALA H . 53479 1
665 . 1 . 1 85 85 ALA HA H 1 4.310 0.003 . 1 . . . . . 85 ALA HA . 53479 1
666 . 1 . 1 85 85 ALA HB1 H 1 1.379 0.003 . 1 . . . . . 85 ALA HB# . 53479 1
667 . 1 . 1 85 85 ALA HB2 H 1 1.379 0.003 . 1 . . . . . 85 ALA HB# . 53479 1
668 . 1 . 1 85 85 ALA HB3 H 1 1.379 0.003 . 1 . . . . . 85 ALA HB# . 53479 1
669 . 1 . 1 85 85 ALA C C 13 176.956 0.003 . 1 . . . . . 85 ALA C . 53479 1
670 . 1 . 1 85 85 ALA CA C 13 51.706 0.020 . 1 . . . . . 85 ALA CA . 53479 1
671 . 1 . 1 85 85 ALA CB C 13 19.603 0.006 . 1 . . . . . 85 ALA CB . 53479 1
672 . 1 . 1 85 85 ALA N N 15 120.503 0.029 . 1 . . . . . 85 ALA N . 53479 1
673 . 1 . 1 86 86 ASN H H 1 7.994 0.004 . 1 . . . . . 86 ASN H . 53479 1
674 . 1 . 1 86 86 ASN HB2 H 1 3.079 0.008 . 2 . . . . . 86 ASN HB2 . 53479 1
675 . 1 . 1 86 86 ASN HB3 H 1 2.544 0.010 . 2 . . . . . 86 ASN HB3 . 53479 1
676 . 1 . 1 86 86 ASN C C 13 173.828 0.010 . 1 . . . . . 86 ASN C . 53479 1
677 . 1 . 1 86 86 ASN CA C 13 53.606 0.036 . 1 . . . . . 86 ASN CA . 53479 1
678 . 1 . 1 86 86 ASN CB C 13 37.192 0.095 . 1 . . . . . 86 ASN CB . 53479 1
679 . 1 . 1 86 86 ASN N N 15 116.211 0.085 . 1 . . . . . 86 ASN N . 53479 1
680 . 1 . 1 87 87 THR H H 1 7.584 0.004 . 1 . . . . . 87 THR H . 53479 1
681 . 1 . 1 87 87 THR HA H 1 4.404 0.010 . 1 . . . . . 87 THR HA . 53479 1
682 . 1 . 1 87 87 THR HB H 1 3.669 0.009 . 1 . . . . . 87 THR HB . 53479 1
683 . 1 . 1 87 87 THR HG21 H 1 0.435 0.007 . 1 . . . . . 87 THR QG2 . 53479 1
684 . 1 . 1 87 87 THR HG22 H 1 0.435 0.007 . 1 . . . . . 87 THR QG2 . 53479 1
685 . 1 . 1 87 87 THR HG23 H 1 0.435 0.007 . 1 . . . . . 87 THR QG2 . 53479 1
686 . 1 . 1 87 87 THR C C 13 172.303 0.022 . 1 . . . . . 87 THR C . 53479 1
687 . 1 . 1 87 87 THR CA C 13 60.287 0.049 . 1 . . . . . 87 THR CA . 53479 1
688 . 1 . 1 87 87 THR CB C 13 70.374 0.032 . 1 . . . . . 87 THR CB . 53479 1
689 . 1 . 1 87 87 THR CG2 C 13 19.047 0.036 . 1 . . . . . 87 THR CG2 . 53479 1
690 . 1 . 1 87 87 THR N N 15 110.573 0.086 . 1 . . . . . 87 THR N . 53479 1
691 . 1 . 1 88 88 VAL H H 1 7.865 0.007 . 1 . . . . . 88 VAL H . 53479 1
692 . 1 . 1 88 88 VAL HA H 1 4.468 0.000 . 1 . . . . . 88 VAL HA . 53479 1
693 . 1 . 1 88 88 VAL HB H 1 1.633 0.010 . 1 . . . . . 88 VAL HB . 53479 1
694 . 1 . 1 88 88 VAL HG11 H 1 0.799 0.009 . 2 . . . . . 88 VAL QG1 . 53479 1
695 . 1 . 1 88 88 VAL HG12 H 1 0.799 0.009 . 2 . . . . . 88 VAL QG1 . 53479 1
696 . 1 . 1 88 88 VAL HG13 H 1 0.799 0.009 . 2 . . . . . 88 VAL QG1 . 53479 1
697 . 1 . 1 88 88 VAL HG21 H 1 0.736 0.002 . 2 . . . . . 88 VAL QG2 . 53479 1
698 . 1 . 1 88 88 VAL HG22 H 1 0.736 0.002 . 2 . . . . . 88 VAL QG2 . 53479 1
699 . 1 . 1 88 88 VAL HG23 H 1 0.736 0.002 . 2 . . . . . 88 VAL QG2 . 53479 1
700 . 1 . 1 88 88 VAL C C 13 174.494 0.007 . 1 . . . . . 88 VAL C . 53479 1
701 . 1 . 1 88 88 VAL CA C 13 61.387 0.034 . 1 . . . . . 88 VAL CA . 53479 1
702 . 1 . 1 88 88 VAL CB C 13 34.130 0.025 . 1 . . . . . 88 VAL CB . 53479 1
703 . 1 . 1 88 88 VAL CG1 C 13 21.417 0.010 . 2 . . . . . 88 VAL CG1 . 53479 1
704 . 1 . 1 88 88 VAL CG2 C 13 20.983 0.013 . 2 . . . . . 88 VAL CG2 . 53479 1
705 . 1 . 1 88 88 VAL N N 15 124.677 0.094 . 1 . . . . . 88 VAL N . 53479 1
706 . 1 . 1 89 89 TYR H H 1 8.485 0.006 . 1 . . . . . 89 TYR H . 53479 1
707 . 1 . 1 89 89 TYR HA H 1 5.021 0.007 . 1 . . . . . 89 TYR HA . 53479 1
708 . 1 . 1 89 89 TYR C C 13 174.310 0.000 . 1 . . . . . 89 TYR C . 53479 1
709 . 1 . 1 89 89 TYR CA C 13 57.302 0.053 . 1 . . . . . 89 TYR CA . 53479 1
710 . 1 . 1 89 89 TYR CB C 13 40.425 0.095 . 1 . . . . . 89 TYR CB . 53479 1
711 . 1 . 1 89 89 TYR N N 15 124.782 0.035 . 1 . . . . . 89 TYR N . 53479 1
712 . 1 . 1 90 90 GLY H H 1 8.710 0.005 . 1 . . . . . 90 GLY H . 53479 1
713 . 1 . 1 90 90 GLY HA2 H 1 2.410 0.019 . 2 . . . . . 90 GLY HA2 . 53479 1
714 . 1 . 1 90 90 GLY HA3 H 1 2.369 0.019 . 2 . . . . . 90 GLY HA3 . 53479 1
715 . 1 . 1 90 90 GLY C C 13 170.971 0.000 . 1 . . . . . 90 GLY C . 53479 1
716 . 1 . 1 90 90 GLY CA C 13 44.207 0.042 . 1 . . . . . 90 GLY CA . 53479 1
717 . 1 . 1 90 90 GLY N N 15 108.673 0.039 . 1 . . . . . 90 GLY N . 53479 1
718 . 1 . 1 91 91 LEU H H 1 8.302 0.005 . 1 . . . . . 91 LEU H . 53479 1
719 . 1 . 1 91 91 LEU HA H 1 5.049 0.005 . 1 . . . . . 91 LEU HA . 53479 1
720 . 1 . 1 91 91 LEU HB2 H 1 1.221 0.012 . 2 . . . . . 91 LEU HB2 . 53479 1
721 . 1 . 1 91 91 LEU HB3 H 1 0.227 0.004 . 2 . . . . . 91 LEU HB3 . 53479 1
722 . 1 . 1 91 91 LEU C C 13 173.599 0.009 . 1 . . . . . 91 LEU C . 53479 1
723 . 1 . 1 91 91 LEU CA C 13 52.476 0.017 . 1 . . . . . 91 LEU CA . 53479 1
724 . 1 . 1 91 91 LEU CB C 13 45.821 0.037 . 1 . . . . . 91 LEU CB . 53479 1
725 . 1 . 1 91 91 LEU N N 15 122.748 0.028 . 1 . . . . . 91 LEU N . 53479 1
726 . 1 . 1 92 92 GLY H H 1 9.066 0.006 . 1 . . . . . 92 GLY H . 53479 1
727 . 1 . 1 92 92 GLY HA2 H 1 4.910 0.005 . 2 . . . . . 92 GLY HA2 . 53479 1
728 . 1 . 1 92 92 GLY HA3 H 1 4.910 0.005 . 2 . . . . . 92 GLY HA3 . 53479 1
729 . 1 . 1 92 92 GLY C C 13 174.160 0.006 . 1 . . . . . 92 GLY C . 53479 1
730 . 1 . 1 92 92 GLY CA C 13 44.811 0.060 . 1 . . . . . 92 GLY CA . 53479 1
731 . 1 . 1 92 92 GLY N N 15 106.527 0.042 . 1 . . . . . 92 GLY N . 53479 1
732 . 1 . 1 93 93 PHE H H 1 9.188 0.005 . 1 . . . . . 93 PHE H . 53479 1
733 . 1 . 1 93 93 PHE HA H 1 4.739 0.010 . 1 . . . . . 93 PHE HA . 53479 1
734 . 1 . 1 93 93 PHE HB2 H 1 2.845 0.010 . 2 . . . . . 93 PHE HB2 . 53479 1
735 . 1 . 1 93 93 PHE HB3 H 1 2.777 0.007 . 2 . . . . . 93 PHE HB3 . 53479 1
736 . 1 . 1 93 93 PHE C C 13 176.132 0.000 . 1 . . . . . 93 PHE C . 53479 1
737 . 1 . 1 93 93 PHE CA C 13 57.892 0.078 . 1 . . . . . 93 PHE CA . 53479 1
738 . 1 . 1 93 93 PHE CB C 13 42.470 0.052 . 1 . . . . . 93 PHE CB . 53479 1
739 . 1 . 1 93 93 PHE N N 15 124.292 0.032 . 1 . . . . . 93 PHE N . 53479 1
740 . 1 . 1 94 94 SER CA C 13 60.133 0.035 . 1 . . . . . 94 SER CA . 53479 1
741 . 1 . 1 94 94 SER CB C 13 63.409 0.000 . 1 . . . . . 94 SER CB . 53479 1
742 . 1 . 1 95 95 SER H H 1 7.483 0.005 . 1 . . . . . 95 SER H . 53479 1
743 . 1 . 1 95 95 SER HA H 1 4.659 0.004 . 1 . . . . . 95 SER HA . 53479 1
744 . 1 . 1 95 95 SER HB2 H 1 4.057 0.003 . 2 . . . . . 95 SER HB2 . 53479 1
745 . 1 . 1 95 95 SER HB3 H 1 3.778 0.000 . 2 . . . . . 95 SER HB3 . 53479 1
746 . 1 . 1 95 95 SER C C 13 173.936 0.000 . 1 . . . . . 95 SER C . 53479 1
747 . 1 . 1 95 95 SER CA C 13 56.721 0.034 . 1 . . . . . 95 SER CA . 53479 1
748 . 1 . 1 95 95 SER CB C 13 66.332 0.037 . 1 . . . . . 95 SER CB . 53479 1
749 . 1 . 1 95 95 SER N N 15 112.274 0.000 . 1 . . . . . 95 SER N . 53479 1
750 . 1 . 1 97 97 HIS C C 13 177.700 0.004 . 1 . . . . . 97 HIS C . 53479 1
751 . 1 . 1 97 97 HIS CA C 13 59.223 0.020 . 1 . . . . . 97 HIS CA . 53479 1
752 . 1 . 1 97 97 HIS CB C 13 30.078 0.034 . 1 . . . . . 97 HIS CB . 53479 1
753 . 1 . 1 98 98 HIS H H 1 7.573 0.004 . 1 . . . . . 98 HIS H . 53479 1
754 . 1 . 1 98 98 HIS HA H 1 4.307 0.006 . 1 . . . . . 98 HIS HA . 53479 1
755 . 1 . 1 98 98 HIS HB2 H 1 3.403 0.003 . 2 . . . . . 98 HIS HB2 . 53479 1
756 . 1 . 1 98 98 HIS HB3 H 1 3.218 0.000 . 2 . . . . . 98 HIS HB3 . 53479 1
757 . 1 . 1 98 98 HIS C C 13 178.594 0.010 . 1 . . . . . 98 HIS C . 53479 1
758 . 1 . 1 98 98 HIS CA C 13 59.563 0.034 . 1 . . . . . 98 HIS CA . 53479 1
759 . 1 . 1 98 98 HIS CB C 13 31.906 0.017 . 1 . . . . . 98 HIS CB . 53479 1
760 . 1 . 1 98 98 HIS N N 15 118.043 0.013 . 1 . . . . . 98 HIS N . 53479 1
761 . 1 . 1 99 99 LEU H H 1 7.069 0.004 . 1 . . . . . 99 LEU H . 53479 1
762 . 1 . 1 99 99 LEU HA H 1 2.523 0.001 . 1 . . . . . 99 LEU HA . 53479 1
763 . 1 . 1 99 99 LEU HB2 H 1 1.926 0.009 . 2 . . . . . 99 LEU HB2 . 53479 1
764 . 1 . 1 99 99 LEU HB3 H 1 1.094 0.003 . 2 . . . . . 99 LEU HB3 . 53479 1
765 . 1 . 1 99 99 LEU C C 13 177.850 0.011 . 1 . . . . . 99 LEU C . 53479 1
766 . 1 . 1 99 99 LEU CA C 13 58.331 0.044 . 1 . . . . . 99 LEU CA . 53479 1
767 . 1 . 1 99 99 LEU CB C 13 40.461 0.019 . 1 . . . . . 99 LEU CB . 53479 1
768 . 1 . 1 99 99 LEU N N 15 122.047 0.092 . 1 . . . . . 99 LEU N . 53479 1
769 . 1 . 1 100 100 SER H H 1 8.422 0.002 . 1 . . . . . 100 SER H . 53479 1
770 . 1 . 1 100 100 SER HA H 1 3.893 0.014 . 1 . . . . . 100 SER HA . 53479 1
771 . 1 . 1 100 100 SER C C 13 177.042 0.000 . 1 . . . . . 100 SER C . 53479 1
772 . 1 . 1 100 100 SER CA C 13 62.157 0.051 . 1 . . . . . 100 SER CA . 53479 1
773 . 1 . 1 100 100 SER N N 15 114.902 0.024 . 1 . . . . . 100 SER N . 53479 1
774 . 1 . 1 101 101 LYS H H 1 7.988 0.004 . 1 . . . . . 101 LYS H . 53479 1
775 . 1 . 1 101 101 LYS HA H 1 3.911 0.005 . 1 . . . . . 101 LYS HA . 53479 1
776 . 1 . 1 101 101 LYS HB2 H 1 1.803 0.014 . 2 . . . . . 101 LYS HB2 . 53479 1
777 . 1 . 1 101 101 LYS HB3 H 1 1.761 0.001 . 2 . . . . . 101 LYS HB3 . 53479 1
778 . 1 . 1 101 101 LYS C C 13 178.198 0.003 . 1 . . . . . 101 LYS C . 53479 1
779 . 1 . 1 101 101 LYS CA C 13 57.772 0.073 . 1 . . . . . 101 LYS CA . 53479 1
780 . 1 . 1 101 101 LYS CB C 13 31.279 0.062 . 1 . . . . . 101 LYS CB . 53479 1
781 . 1 . 1 101 101 LYS N N 15 120.855 0.053 . 1 . . . . . 101 LYS N . 53479 1
782 . 1 . 1 102 102 PHE H H 1 7.764 0.003 . 1 . . . . . 102 PHE H . 53479 1
783 . 1 . 1 102 102 PHE HA H 1 3.713 0.005 . 1 . . . . . 102 PHE HA . 53479 1
784 . 1 . 1 102 102 PHE HB2 H 1 3.099 0.003 . 2 . . . . . 102 PHE HB2 . 53479 1
785 . 1 . 1 102 102 PHE HB3 H 1 2.885 0.001 . 2 . . . . . 102 PHE HB3 . 53479 1
786 . 1 . 1 102 102 PHE C C 13 177.720 0.009 . 1 . . . . . 102 PHE C . 53479 1
787 . 1 . 1 102 102 PHE CA C 13 62.886 0.074 . 1 . . . . . 102 PHE CA . 53479 1
788 . 1 . 1 102 102 PHE CB C 13 40.018 0.062 . 1 . . . . . 102 PHE CB . 53479 1
789 . 1 . 1 102 102 PHE N N 15 119.886 0.024 . 1 . . . . . 102 PHE N . 53479 1
790 . 1 . 1 103 103 ALA H H 1 8.556 0.005 . 1 . . . . . 103 ALA H . 53479 1
791 . 1 . 1 103 103 ALA HA H 1 3.433 0.002 . 1 . . . . . 103 ALA HA . 53479 1
792 . 1 . 1 103 103 ALA HB1 H 1 1.461 0.008 . 1 . . . . . 103 ALA HB# . 53479 1
793 . 1 . 1 103 103 ALA HB2 H 1 1.461 0.008 . 1 . . . . . 103 ALA HB# . 53479 1
794 . 1 . 1 103 103 ALA HB3 H 1 1.461 0.008 . 1 . . . . . 103 ALA HB# . 53479 1
795 . 1 . 1 103 103 ALA C C 13 179.414 0.028 . 1 . . . . . 103 ALA C . 53479 1
796 . 1 . 1 103 103 ALA CA C 13 54.542 0.054 . 1 . . . . . 103 ALA CA . 53479 1
797 . 1 . 1 103 103 ALA CB C 13 18.438 0.045 . 1 . . . . . 103 ALA CB . 53479 1
798 . 1 . 1 103 103 ALA N N 15 121.812 0.076 . 1 . . . . . 103 ALA N . 53479 1
799 . 1 . 1 104 104 GLU H H 1 8.025 0.003 . 1 . . . . . 104 GLU H . 53479 1
800 . 1 . 1 104 104 GLU HA H 1 3.784 0.002 . 1 . . . . . 104 GLU HA . 53479 1
801 . 1 . 1 104 104 GLU HB2 H 1 2.003 0.002 . 2 . . . . . 104 GLU HB2 . 53479 1
802 . 1 . 1 104 104 GLU HB3 H 1 1.839 0.010 . 2 . . . . . 104 GLU HB3 . 53479 1
803 . 1 . 1 104 104 GLU C C 13 179.486 0.005 . 1 . . . . . 104 GLU C . 53479 1
804 . 1 . 1 104 104 GLU CA C 13 59.004 0.028 . 1 . . . . . 104 GLU CA . 53479 1
805 . 1 . 1 104 104 GLU CB C 13 29.709 0.052 . 1 . . . . . 104 GLU CB . 53479 1
806 . 1 . 1 104 104 GLU N N 15 119.923 0.083 . 1 . . . . . 104 GLU N . 53479 1
807 . 1 . 1 105 105 LYS H H 1 7.123 0.003 . 1 . . . . . 105 LYS H . 53479 1
808 . 1 . 1 105 105 LYS HA H 1 3.086 0.003 . 1 . . . . . 105 LYS HA . 53479 1
809 . 1 . 1 105 105 LYS HB2 H 1 1.449 0.031 . 2 . . . . . 105 LYS HB2 . 53479 1
810 . 1 . 1 105 105 LYS HB3 H 1 1.306 0.011 . 2 . . . . . 105 LYS HB3 . 53479 1
811 . 1 . 1 105 105 LYS C C 13 175.537 0.012 . 1 . . . . . 105 LYS C . 53479 1
812 . 1 . 1 105 105 LYS CA C 13 56.236 0.031 . 1 . . . . . 105 LYS CA . 53479 1
813 . 1 . 1 105 105 LYS CB C 13 32.066 0.005 . 1 . . . . . 105 LYS CB . 53479 1
814 . 1 . 1 105 105 LYS N N 15 119.030 0.056 . 1 . . . . . 105 LYS N . 53479 1
815 . 1 . 1 106 106 PHE H H 1 7.441 0.004 . 1 . . . . . 106 PHE H . 53479 1
816 . 1 . 1 106 106 PHE HA H 1 3.296 0.002 . 1 . . . . . 106 PHE HA . 53479 1
817 . 1 . 1 106 106 PHE HB2 H 1 2.865 0.000 . 2 . . . . . 106 PHE HB2 . 53479 1
818 . 1 . 1 106 106 PHE HB3 H 1 2.470 0.000 . 2 . . . . . 106 PHE HB3 . 53479 1
819 . 1 . 1 106 106 PHE C C 13 177.512 0.019 . 1 . . . . . 106 PHE C . 53479 1
820 . 1 . 1 106 106 PHE CA C 13 61.605 0.027 . 1 . . . . . 106 PHE CA . 53479 1
821 . 1 . 1 106 106 PHE CB C 13 38.571 0.037 . 1 . . . . . 106 PHE CB . 53479 1
822 . 1 . 1 106 106 PHE N N 15 120.443 0.047 . 1 . . . . . 106 PHE N . 53479 1
823 . 1 . 1 107 107 GLN H H 1 7.500 0.004 . 1 . . . . . 107 GLN H . 53479 1
824 . 1 . 1 107 107 GLN HA H 1 3.856 0.002 . 1 . . . . . 107 GLN HA . 53479 1
825 . 1 . 1 107 107 GLN HB2 H 1 2.127 0.008 . 2 . . . . . 107 GLN HB2 . 53479 1
826 . 1 . 1 107 107 GLN HB3 H 1 1.960 0.004 . 2 . . . . . 107 GLN HB3 . 53479 1
827 . 1 . 1 107 107 GLN C C 13 177.988 0.011 . 1 . . . . . 107 GLN C . 53479 1
828 . 1 . 1 107 107 GLN CA C 13 58.195 0.057 . 1 . . . . . 107 GLN CA . 53479 1
829 . 1 . 1 107 107 GLN CB C 13 27.943 0.062 . 1 . . . . . 107 GLN CB . 53479 1
830 . 1 . 1 107 107 GLN N N 15 115.092 0.026 . 1 . . . . . 107 GLN N . 53479 1
831 . 1 . 1 108 108 GLU H H 1 7.475 0.002 . 1 . . . . . 108 GLU H . 53479 1
832 . 1 . 1 108 108 GLU HA H 1 3.627 0.001 . 1 . . . . . 108 GLU HA . 53479 1
833 . 1 . 1 108 108 GLU HB2 H 1 1.667 0.000 . 2 . . . . . 108 GLU HB2 . 53479 1
834 . 1 . 1 108 108 GLU HB3 H 1 1.535 0.002 . 2 . . . . . 108 GLU HB3 . 53479 1
835 . 1 . 1 108 108 GLU C C 13 179.793 0.003 . 1 . . . . . 108 GLU C . 53479 1
836 . 1 . 1 108 108 GLU CA C 13 58.979 0.019 . 1 . . . . . 108 GLU CA . 53479 1
837 . 1 . 1 108 108 GLU CB C 13 28.995 0.038 . 1 . . . . . 108 GLU CB . 53479 1
838 . 1 . 1 108 108 GLU N N 15 120.745 0.089 . 1 . . . . . 108 GLU N . 53479 1
839 . 1 . 1 109 109 PHE H H 1 7.848 0.005 . 1 . . . . . 109 PHE H . 53479 1
840 . 1 . 1 109 109 PHE HA H 1 4.029 0.004 . 1 . . . . . 109 PHE HA . 53479 1
841 . 1 . 1 109 109 PHE HB2 H 1 2.320 0.002 . 2 . . . . . 109 PHE HB2 . 53479 1
842 . 1 . 1 109 109 PHE HB3 H 1 2.222 0.003 . 2 . . . . . 109 PHE HB3 . 53479 1
843 . 1 . 1 109 109 PHE C C 13 177.486 0.023 . 1 . . . . . 109 PHE C . 53479 1
844 . 1 . 1 109 109 PHE CA C 13 57.800 0.066 . 1 . . . . . 109 PHE CA . 53479 1
845 . 1 . 1 109 109 PHE CB C 13 36.410 0.089 . 1 . . . . . 109 PHE CB . 53479 1
846 . 1 . 1 109 109 PHE N N 15 119.750 0.096 . 1 . . . . . 109 PHE N . 53479 1
847 . 1 . 1 110 110 LYS H H 1 8.352 0.004 . 1 . . . . . 110 LYS H . 53479 1
848 . 1 . 1 110 110 LYS HA H 1 3.576 0.003 . 1 . . . . . 110 LYS HA . 53479 1
849 . 1 . 1 110 110 LYS HB2 H 1 1.993 0.001 . 2 . . . . . 110 LYS HB2 . 53479 1
850 . 1 . 1 110 110 LYS HB3 H 1 1.710 0.001 . 2 . . . . . 110 LYS HB3 . 53479 1
851 . 1 . 1 110 110 LYS C C 13 178.747 0.019 . 1 . . . . . 110 LYS C . 53479 1
852 . 1 . 1 110 110 LYS CA C 13 60.137 0.042 . 1 . . . . . 110 LYS CA . 53479 1
853 . 1 . 1 110 110 LYS CB C 13 32.382 0.020 . 1 . . . . . 110 LYS CB . 53479 1
854 . 1 . 1 110 110 LYS N N 15 123.168 0.073 . 1 . . . . . 110 LYS N . 53479 1
855 . 1 . 1 111 111 GLU H H 1 7.778 0.003 . 1 . . . . . 111 GLU H . 53479 1
856 . 1 . 1 111 111 GLU HA H 1 4.220 0.002 . 1 . . . . . 111 GLU HA . 53479 1
857 . 1 . 1 111 111 GLU HB2 H 1 1.984 0.019 . 2 . . . . . 111 GLU HB2 . 53479 1
858 . 1 . 1 111 111 GLU HB3 H 1 1.901 0.004 . 2 . . . . . 111 GLU HB3 . 53479 1
859 . 1 . 1 111 111 GLU C C 13 178.700 0.014 . 1 . . . . . 111 GLU C . 53479 1
860 . 1 . 1 111 111 GLU CA C 13 58.199 0.030 . 1 . . . . . 111 GLU CA . 53479 1
861 . 1 . 1 111 111 GLU CB C 13 28.720 0.058 . 1 . . . . . 111 GLU CB . 53479 1
862 . 1 . 1 111 111 GLU N N 15 118.779 0.056 . 1 . . . . . 111 GLU N . 53479 1
863 . 1 . 1 112 112 ALA H H 1 7.824 0.003 . 1 . . . . . 112 ALA H . 53479 1
864 . 1 . 1 112 112 ALA HA H 1 4.057 0.007 . 1 . . . . . 112 ALA HA . 53479 1
865 . 1 . 1 112 112 ALA HB1 H 1 1.449 0.002 . 1 . . . . . 112 ALA HB# . 53479 1
866 . 1 . 1 112 112 ALA HB2 H 1 1.449 0.002 . 1 . . . . . 112 ALA HB# . 53479 1
867 . 1 . 1 112 112 ALA HB3 H 1 1.449 0.002 . 1 . . . . . 112 ALA HB# . 53479 1
868 . 1 . 1 112 112 ALA C C 13 180.773 0.002 . 1 . . . . . 112 ALA C . 53479 1
869 . 1 . 1 112 112 ALA CA C 13 55.028 0.076 . 1 . . . . . 112 ALA CA . 53479 1
870 . 1 . 1 112 112 ALA CB C 13 17.663 0.050 . 1 . . . . . 112 ALA CB . 53479 1
871 . 1 . 1 112 112 ALA N N 15 122.321 0.059 . 1 . . . . . 112 ALA N . 53479 1
872 . 1 . 1 113 113 ALA H H 1 8.250 0.004 . 1 . . . . . 113 ALA H . 53479 1
873 . 1 . 1 113 113 ALA HA H 1 4.292 0.003 . 1 . . . . . 113 ALA HA . 53479 1
874 . 1 . 1 113 113 ALA HB1 H 1 1.501 0.006 . 1 . . . . . 113 ALA HB# . 53479 1
875 . 1 . 1 113 113 ALA HB2 H 1 1.501 0.006 . 1 . . . . . 113 ALA HB# . 53479 1
876 . 1 . 1 113 113 ALA HB3 H 1 1.501 0.006 . 1 . . . . . 113 ALA HB# . 53479 1
877 . 1 . 1 113 113 ALA C C 13 180.032 0.001 . 1 . . . . . 113 ALA C . 53479 1
878 . 1 . 1 113 113 ALA CA C 13 54.467 0.042 . 1 . . . . . 113 ALA CA . 53479 1
879 . 1 . 1 113 113 ALA CB C 13 18.103 0.036 . 1 . . . . . 113 ALA CB . 53479 1
880 . 1 . 1 113 113 ALA N N 15 121.416 0.087 . 1 . . . . . 113 ALA N . 53479 1
881 . 1 . 1 114 114 ARG H H 1 8.039 0.001 . 1 . . . . . 114 ARG H . 53479 1
882 . 1 . 1 114 114 ARG HA H 1 3.917 0.003 . 1 . . . . . 114 ARG HA . 53479 1
883 . 1 . 1 114 114 ARG C C 13 178.338 0.009 . 1 . . . . . 114 ARG C . 53479 1
884 . 1 . 1 114 114 ARG CA C 13 59.288 0.030 . 1 . . . . . 114 ARG CA . 53479 1
885 . 1 . 1 114 114 ARG CB C 13 30.191 0.038 . 1 . . . . . 114 ARG CB . 53479 1
886 . 1 . 1 114 114 ARG N N 15 120.540 0.059 . 1 . . . . . 114 ARG N . 53479 1
887 . 1 . 1 115 115 LEU H H 1 8.141 0.003 . 1 . . . . . 115 LEU H . 53479 1
888 . 1 . 1 115 115 LEU HA H 1 4.048 0.004 . 1 . . . . . 115 LEU HA . 53479 1
889 . 1 . 1 115 115 LEU HB2 H 1 1.723 0.005 . 2 . . . . . 115 LEU HB2 . 53479 1
890 . 1 . 1 115 115 LEU HB3 H 1 1.527 0.012 . 2 . . . . . 115 LEU HB3 . 53479 1
891 . 1 . 1 115 115 LEU C C 13 178.658 0.012 . 1 . . . . . 115 LEU C . 53479 1
892 . 1 . 1 115 115 LEU CA C 13 56.810 0.037 . 1 . . . . . 115 LEU CA . 53479 1
893 . 1 . 1 115 115 LEU CB C 13 41.936 0.060 . 1 . . . . . 115 LEU CB . 53479 1
894 . 1 . 1 115 115 LEU N N 15 119.984 0.076 . 1 . . . . . 115 LEU N . 53479 1
895 . 1 . 1 116 116 ALA H H 1 7.867 0.003 . 1 . . . . . 116 ALA H . 53479 1
896 . 1 . 1 116 116 ALA HA H 1 4.160 0.002 . 1 . . . . . 116 ALA HA . 53479 1
897 . 1 . 1 116 116 ALA HB1 H 1 1.496 0.003 . 1 . . . . . 116 ALA HB# . 53479 1
898 . 1 . 1 116 116 ALA HB2 H 1 1.496 0.003 . 1 . . . . . 116 ALA HB# . 53479 1
899 . 1 . 1 116 116 ALA HB3 H 1 1.496 0.003 . 1 . . . . . 116 ALA HB# . 53479 1
900 . 1 . 1 116 116 ALA C C 13 179.011 0.006 . 1 . . . . . 116 ALA C . 53479 1
901 . 1 . 1 116 116 ALA CA C 13 53.886 0.031 . 1 . . . . . 116 ALA CA . 53479 1
902 . 1 . 1 116 116 ALA CB C 13 18.491 0.030 . 1 . . . . . 116 ALA CB . 53479 1
903 . 1 . 1 116 116 ALA N N 15 121.428 0.026 . 1 . . . . . 116 ALA N . 53479 1
904 . 1 . 1 117 117 LYS H H 1 7.741 0.003 . 1 . . . . . 117 LYS H . 53479 1
905 . 1 . 1 117 117 LYS HA H 1 4.215 0.001 . 1 . . . . . 117 LYS HA . 53479 1
906 . 1 . 1 117 117 LYS HB2 H 1 1.928 0.004 . 2 . . . . . 117 LYS HB2 . 53479 1
907 . 1 . 1 117 117 LYS HB3 H 1 1.842 0.003 . 2 . . . . . 117 LYS HB3 . 53479 1
908 . 1 . 1 117 117 LYS HG2 H 1 1.463 0.004 . 2 . . . . . 117 LYS HG2 . 53479 1
909 . 1 . 1 117 117 LYS HG3 H 1 1.463 0.004 . 2 . . . . . 117 LYS HG3 . 53479 1
910 . 1 . 1 117 117 LYS HD2 H 1 1.657 0.001 . 2 . . . . . 117 LYS HD2 . 53479 1
911 . 1 . 1 117 117 LYS HD3 H 1 1.657 0.001 . 2 . . . . . 117 LYS HD3 . 53479 1
912 . 1 . 1 117 117 LYS HE2 H 1 2.977 0.003 . 2 . . . . . 117 LYS HE2 . 53479 1
913 . 1 . 1 117 117 LYS HE3 H 1 2.977 0.003 . 2 . . . . . 117 LYS HE3 . 53479 1
914 . 1 . 1 117 117 LYS C C 13 177.648 0.004 . 1 . . . . . 117 LYS C . 53479 1
915 . 1 . 1 117 117 LYS CA C 13 57.021 0.097 . 1 . . . . . 117 LYS CA . 53479 1
916 . 1 . 1 117 117 LYS CB C 13 32.680 0.030 . 1 . . . . . 117 LYS CB . 53479 1
917 . 1 . 1 117 117 LYS CG C 13 24.602 0.019 . 1 . . . . . 117 LYS CG . 53479 1
918 . 1 . 1 117 117 LYS CD C 13 27.343 0.005 . 1 . . . . . 117 LYS CD . 53479 1
919 . 1 . 1 117 117 LYS CE C 13 43.727 0.021 . 1 . . . . . 117 LYS CE . 53479 1
920 . 1 . 1 117 117 LYS N N 15 118.504 0.014 . 1 . . . . . 117 LYS N . 53479 1
921 . 1 . 1 118 118 GLU H H 1 8.059 0.005 . 1 . . . . . 118 GLU H . 53479 1
922 . 1 . 1 118 118 GLU HB2 H 1 2.040 0.003 . 2 . . . . . 118 GLU HB2 . 53479 1
923 . 1 . 1 118 118 GLU HB3 H 1 1.973 0.006 . 2 . . . . . 118 GLU HB3 . 53479 1
924 . 1 . 1 118 118 GLU C C 13 177.027 0.003 . 1 . . . . . 118 GLU C . 53479 1
925 . 1 . 1 118 118 GLU CA C 13 57.411 0.036 . 1 . . . . . 118 GLU CA . 53479 1
926 . 1 . 1 118 118 GLU CB C 13 30.057 0.057 . 1 . . . . . 118 GLU CB . 53479 1
927 . 1 . 1 118 118 GLU N N 15 120.275 0.096 . 1 . . . . . 118 GLU N . 53479 1
928 . 1 . 1 119 119 LYS H H 1 7.971 0.003 . 1 . . . . . 119 LYS H . 53479 1
929 . 1 . 1 119 119 LYS HA H 1 4.289 0.002 . 1 . . . . . 119 LYS HA . 53479 1
930 . 1 . 1 119 119 LYS HB2 H 1 1.848 0.007 . 2 . . . . . 119 LYS HB2 . 53479 1
931 . 1 . 1 119 119 LYS HB3 H 1 1.766 0.001 . 2 . . . . . 119 LYS HB3 . 53479 1
932 . 1 . 1 119 119 LYS HG2 H 1 1.433 0.002 . 2 . . . . . 119 LYS HG2 . 53479 1
933 . 1 . 1 119 119 LYS HG3 H 1 1.433 0.002 . 2 . . . . . 119 LYS HG3 . 53479 1
934 . 1 . 1 119 119 LYS HD2 H 1 1.623 0.010 . 2 . . . . . 119 LYS HD2 . 53479 1
935 . 1 . 1 119 119 LYS HD3 H 1 1.623 0.010 . 2 . . . . . 119 LYS HD3 . 53479 1
936 . 1 . 1 119 119 LYS HE2 H 1 2.924 0.007 . 2 . . . . . 119 LYS HE2 . 53479 1
937 . 1 . 1 119 119 LYS HE3 H 1 2.924 0.007 . 2 . . . . . 119 LYS HE3 . 53479 1
938 . 1 . 1 119 119 LYS C C 13 176.523 0.003 . 1 . . . . . 119 LYS C . 53479 1
939 . 1 . 1 119 119 LYS CA C 13 56.458 0.042 . 1 . . . . . 119 LYS CA . 53479 1
940 . 1 . 1 119 119 LYS CB C 13 32.824 0.059 . 1 . . . . . 119 LYS CB . 53479 1
941 . 1 . 1 119 119 LYS CG C 13 24.746 0.032 . 1 . . . . . 119 LYS CG . 53479 1
942 . 1 . 1 119 119 LYS CD C 13 29.169 0.060 . 1 . . . . . 119 LYS CD . 53479 1
943 . 1 . 1 119 119 LYS CE C 13 42.234 0.022 . 1 . . . . . 119 LYS CE . 53479 1
944 . 1 . 1 119 119 LYS N N 15 120.147 0.047 . 1 . . . . . 119 LYS N . 53479 1
945 . 1 . 1 120 120 SER H H 1 8.080 0.006 . 1 . . . . . 120 SER H . 53479 1
946 . 1 . 1 120 120 SER HB2 H 1 3.855 0.002 . 2 . . . . . 120 SER HB2 . 53479 1
947 . 1 . 1 120 120 SER HB3 H 1 3.700 0.004 . 2 . . . . . 120 SER HB3 . 53479 1
948 . 1 . 1 120 120 SER C C 13 173.586 0.001 . 1 . . . . . 120 SER C . 53479 1
949 . 1 . 1 120 120 SER CA C 13 58.415 0.072 . 1 . . . . . 120 SER CA . 53479 1
950 . 1 . 1 120 120 SER CB C 13 63.899 0.011 . 1 . . . . . 120 SER CB . 53479 1
951 . 1 . 1 120 120 SER N N 15 116.823 0.045 . 1 . . . . . 120 SER N . 53479 1
952 . 1 . 1 121 121 GLN H H 1 7.876 0.006 . 1 . . . . . 121 GLN H . 53479 1
953 . 1 . 1 121 121 GLN HA H 1 4.121 0.010 . 1 . . . . . 121 GLN HA . 53479 1
954 . 1 . 1 121 121 GLN HB2 H 1 2.063 0.002 . 2 . . . . . 121 GLN HB2 . 53479 1
955 . 1 . 1 121 121 GLN HB3 H 1 1.888 0.003 . 2 . . . . . 121 GLN HB3 . 53479 1
956 . 1 . 1 121 121 GLN HG2 H 1 2.255 0.002 . 2 . . . . . 121 GLN HG2 . 53479 1
957 . 1 . 1 121 121 GLN HG3 H 1 2.255 0.002 . 2 . . . . . 121 GLN HG3 . 53479 1
958 . 1 . 1 121 121 GLN C C 13 180.467 0.000 . 1 . . . . . 121 GLN C . 53479 1
959 . 1 . 1 121 121 GLN CA C 13 57.407 0.031 . 1 . . . . . 121 GLN CA . 53479 1
960 . 1 . 1 121 121 GLN CB C 13 30.314 0.077 . 1 . . . . . 121 GLN CB . 53479 1
961 . 1 . 1 121 121 GLN CG C 13 34.241 0.005 . 1 . . . . . 121 GLN CG . 53479 1
962 . 1 . 1 121 121 GLN N N 15 126.664 0.068 . 1 . . . . . 121 GLN N . 53479 1
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