Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 27545
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 27545 1
2 '3D HNCACB' . . . 27545 1
3 '3D CBCA(CO)NH' . . . 27545 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 $CcpNmr . . 27545 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.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 2 2 PRO CA C 13 62.9691 0.0462 . 1 . . . . . 2 PRO CA . 27545 1
2 . 1 1 2 2 PRO CB C 13 32.0394 0.0294 . 1 . . . . . 2 PRO CB . 27545 1
3 . 1 1 3 3 ARG H H 1 8.5751 0.0009 . 1 . . . . . 3 ARG H . 27545 1
4 . 1 1 3 3 ARG CA C 13 58.1183 0.0069 . 1 . . . . . 3 ARG CA . 27545 1
5 . 1 1 3 3 ARG CB C 13 30.2469 0.0529 . 1 . . . . . 3 ARG CB . 27545 1
6 . 1 1 3 3 ARG N N 15 123.2664 0.0397 . 1 . . . . . 3 ARG N . 27545 1
7 . 1 1 4 4 GLN H H 1 8.9452 0.0008 . 1 . . . . . 4 GLN H . 27545 1
8 . 1 1 4 4 GLN CA C 13 56.6241 0.0589 . 1 . . . . . 4 GLN CA . 27545 1
9 . 1 1 4 4 GLN CB C 13 28.0180 0.0028 . 1 . . . . . 4 GLN CB . 27545 1
10 . 1 1 4 4 GLN N N 15 117.5379 0.0396 . 1 . . . . . 4 GLN N . 27545 1
11 . 1 1 5 5 PHE H H 1 7.3968 0.0032 . 1 . . . . . 5 PHE H . 27545 1
12 . 1 1 5 5 PHE CA C 13 55.7410 0.0215 . 1 . . . . . 5 PHE CA . 27545 1
13 . 1 1 5 5 PHE CB C 13 42.3209 0.0430 . 1 . . . . . 5 PHE CB . 27545 1
14 . 1 1 5 5 PHE N N 15 119.3921 0.0354 . 1 . . . . . 5 PHE N . 27545 1
15 . 1 1 6 6 THR H H 1 8.8946 0.0015 . 1 . . . . . 6 THR H . 27545 1
16 . 1 1 6 6 THR CA C 13 60.8880 0.0380 . 1 . . . . . 6 THR CA . 27545 1
17 . 1 1 6 6 THR CB C 13 69.3564 0.0547 . 1 . . . . . 6 THR CB . 27545 1
18 . 1 1 6 6 THR N N 15 113.0694 0.0697 . 1 . . . . . 6 THR N . 27545 1
19 . 1 1 7 7 ARG H H 1 8.9776 0.0014 . 1 . . . . . 7 ARG H . 27545 1
20 . 1 1 7 7 ARG CA C 13 61.4173 0.0899 . 1 . . . . . 7 ARG CA . 27545 1
21 . 1 1 7 7 ARG CB C 13 30.8076 0.0141 . 1 . . . . . 7 ARG CB . 27545 1
22 . 1 1 7 7 ARG N N 15 120.5454 0.0375 . 1 . . . . . 7 ARG N . 27545 1
23 . 1 1 8 8 ALA H H 1 10.3332 0.0011 . 1 . . . . . 8 ALA H . 27545 1
24 . 1 1 8 8 ALA CA C 13 55.1786 0.0662 . 1 . . . . . 8 ALA CA . 27545 1
25 . 1 1 8 8 ALA CB C 13 19.0951 0.0367 . 1 . . . . . 8 ALA CB . 27545 1
26 . 1 1 8 8 ALA N N 15 126.1237 0.0190 . 1 . . . . . 8 ALA N . 27545 1
27 . 1 1 9 9 GLN H H 1 8.3526 0.0027 . 1 . . . . . 9 GLN H . 27545 1
28 . 1 1 9 9 GLN CA C 13 58.4775 0.0281 . 1 . . . . . 9 GLN CA . 27545 1
29 . 1 1 9 9 GLN CB C 13 28.6551 0.0497 . 1 . . . . . 9 GLN CB . 27545 1
30 . 1 1 9 9 GLN N N 15 118.4452 0.0498 . 1 . . . . . 9 GLN N . 27545 1
31 . 1 1 10 10 TRP H H 1 8.8204 0.0011 . 1 . . . . . 10 TRP H . 27545 1
32 . 1 1 10 10 TRP HE1 H 1 10.0837 . . 1 . . . . . 10 TRP HE1 . 27545 1
33 . 1 1 10 10 TRP CA C 13 58.1059 0.0438 . 1 . . . . . 10 TRP CA . 27545 1
34 . 1 1 10 10 TRP CB C 13 31.4211 0.0519 . 1 . . . . . 10 TRP CB . 27545 1
35 . 1 1 10 10 TRP N N 15 120.4515 0.0663 . 1 . . . . . 10 TRP N . 27545 1
36 . 1 1 10 10 TRP NE1 N 15 129.8968 . . 1 . . . . . 10 TRP NE1 . 27545 1
37 . 1 1 11 11 PHE H H 1 8.7934 0.0012 . 1 . . . . . 11 PHE H . 27545 1
38 . 1 1 11 11 PHE CA C 13 61.9846 0.0388 . 1 . . . . . 11 PHE CA . 27545 1
39 . 1 1 11 11 PHE CB C 13 38.9389 0.0823 . 1 . . . . . 11 PHE CB . 27545 1
40 . 1 1 11 11 PHE N N 15 121.7836 0.0176 . 1 . . . . . 11 PHE N . 27545 1
41 . 1 1 12 12 ALA H H 1 8.2965 0.0046 . 1 . . . . . 12 ALA H . 27545 1
42 . 1 1 12 12 ALA CA C 13 55.5062 0.0186 . 1 . . . . . 12 ALA CA . 27545 1
43 . 1 1 12 12 ALA CB C 13 18.0091 0.0470 . 1 . . . . . 12 ALA CB . 27545 1
44 . 1 1 12 12 ALA N N 15 122.1261 0.0703 . 1 . . . . . 12 ALA N . 27545 1
45 . 1 1 13 13 ILE H H 1 7.7394 0.0015 . 1 . . . . . 13 ILE H . 27545 1
46 . 1 1 13 13 ILE CA C 13 64.5885 0.0109 . 1 . . . . . 13 ILE CA . 27545 1
47 . 1 1 13 13 ILE CB C 13 38.5176 0.0364 . 1 . . . . . 13 ILE CB . 27545 1
48 . 1 1 13 13 ILE N N 15 117.8196 0.0560 . 1 . . . . . 13 ILE N . 27545 1
49 . 1 1 14 14 GLN H H 1 7.3887 0.0043 . 1 . . . . . 14 GLN H . 27545 1
50 . 1 1 14 14 GLN CA C 13 58.0688 0.0182 . 1 . . . . . 14 GLN CA . 27545 1
51 . 1 1 14 14 GLN CB C 13 30.6774 0.0391 . 1 . . . . . 14 GLN CB . 27545 1
52 . 1 1 14 14 GLN N N 15 112.7823 0.0544 . 1 . . . . . 14 GLN N . 27545 1
53 . 1 1 15 15 HIS H H 1 7.7101 0.0016 . 1 . . . . . 15 HIS H . 27545 1
54 . 1 1 15 15 HIS CA C 13 54.8452 0.0201 . 1 . . . . . 15 HIS CA . 27545 1
55 . 1 1 15 15 HIS CB C 13 30.8830 0.0259 . 1 . . . . . 15 HIS CB . 27545 1
56 . 1 1 15 15 HIS N N 15 106.0019 0.0668 . 1 . . . . . 15 HIS N . 27545 1
57 . 1 1 16 16 VAL H H 1 8.2708 0.0021 . 1 . . . . . 16 VAL H . 27545 1
58 . 1 1 16 16 VAL CA C 13 62.4553 0.0529 . 1 . . . . . 16 VAL CA . 27545 1
59 . 1 1 16 16 VAL CB C 13 32.6145 0.0132 . 1 . . . . . 16 VAL CB . 27545 1
60 . 1 1 16 16 VAL N N 15 120.9009 0.0337 . 1 . . . . . 16 VAL N . 27545 1
61 . 1 1 17 17 SER H H 1 8.3587 0.0016 . 1 . . . . . 17 SER H . 27545 1
62 . 1 1 17 17 SER CA C 13 57.4082 0.0066 . 1 . . . . . 17 SER CA . 27545 1
63 . 1 1 17 17 SER CB C 13 64.3262 0.0139 . 1 . . . . . 17 SER CB . 27545 1
64 . 1 1 17 17 SER N N 15 121.2607 0.0473 . 1 . . . . . 17 SER N . 27545 1
65 . 1 1 18 18 LEU H H 1 8.5837 0.0012 . 1 . . . . . 18 LEU H . 27545 1
66 . 1 1 18 18 LEU CA C 13 57.7855 0.0970 . 1 . . . . . 18 LEU CA . 27545 1
67 . 1 1 18 18 LEU CB C 13 42.7122 0.0208 . 1 . . . . . 18 LEU CB . 27545 1
68 . 1 1 18 18 LEU N N 15 128.1360 0.0137 . 1 . . . . . 18 LEU N . 27545 1
69 . 1 1 19 19 ASN H H 1 8.1836 0.0017 . 1 . . . . . 19 ASN H . 27545 1
70 . 1 1 19 19 ASN HD21 H 1 6.9163 0.0052 . 1 . . . . . 19 ASN HD21 . 27545 1
71 . 1 1 19 19 ASN HD22 H 1 7.6196 0.0016 . 1 . . . . . 19 ASN HD22 . 27545 1
72 . 1 1 19 19 ASN CA C 13 51.0117 0.0823 . 1 . . . . . 19 ASN CA . 27545 1
73 . 1 1 19 19 ASN CB C 13 39.0687 0.0409 . 1 . . . . . 19 ASN CB . 27545 1
74 . 1 1 19 19 ASN N N 15 115.6625 0.0443 . 1 . . . . . 19 ASN N . 27545 1
75 . 1 1 19 19 ASN ND2 N 15 113.6699 0.1965 . 1 . . . . . 19 ASN ND2 . 27545 1
76 . 1 1 21 21 PRO CA C 13 62.0317 0.0249 . 1 . . . . . 21 PRO CA . 27545 1
77 . 1 1 21 21 PRO CB C 13 31.8491 0.0087 . 1 . . . . . 21 PRO CB . 27545 1
78 . 1 1 22 22 GLN H H 1 8.0721 0.0007 . 1 . . . . . 22 GLN H . 27545 1
79 . 1 1 22 22 GLN CA C 13 55.4699 0.0280 . 1 . . . . . 22 GLN CA . 27545 1
80 . 1 1 22 22 GLN CB C 13 29.3128 0.0576 . 1 . . . . . 22 GLN CB . 27545 1
81 . 1 1 22 22 GLN N N 15 116.0703 0.0465 . 1 . . . . . 22 GLN N . 27545 1
82 . 1 1 23 23 CYS H H 1 9.4396 0.0010 . 1 . . . . . 23 CYS H . 27545 1
83 . 1 1 23 23 CYS CA C 13 61.5492 0.0516 . 1 . . . . . 23 CYS CA . 27545 1
84 . 1 1 23 23 CYS CB C 13 41.1870 0.0957 . 1 . . . . . 23 CYS CB . 27545 1
85 . 1 1 23 23 CYS N N 15 120.7877 0.0291 . 1 . . . . . 23 CYS N . 27545 1
86 . 1 1 24 24 ALA H H 1 9.1995 0.0020 . 1 . . . . . 24 ALA H . 27545 1
87 . 1 1 24 24 ALA CA C 13 56.3844 0.0174 . 1 . . . . . 24 ALA CA . 27545 1
88 . 1 1 24 24 ALA CB C 13 18.3788 0.0475 . 1 . . . . . 24 ALA CB . 27545 1
89 . 1 1 24 24 ALA N N 15 119.2317 0.0291 . 1 . . . . . 24 ALA N . 27545 1
90 . 1 1 25 25 THR H H 1 7.2203 0.0022 . 1 . . . . . 25 THR H . 27545 1
91 . 1 1 25 25 THR CA C 13 64.8752 0.0265 . 1 . . . . . 25 THR CA . 27545 1
92 . 1 1 25 25 THR CB C 13 68.8910 0.0525 . 1 . . . . . 25 THR CB . 27545 1
93 . 1 1 25 25 THR N N 15 110.3506 0.0516 . 1 . . . . . 25 THR N . 27545 1
94 . 1 1 26 26 ALA H H 1 8.4372 0.0030 . 1 . . . . . 26 ALA H . 27545 1
95 . 1 1 26 26 ALA CA C 13 54.9061 0.0330 . 1 . . . . . 26 ALA CA . 27545 1
96 . 1 1 26 26 ALA CB C 13 19.3467 0.0490 . 1 . . . . . 26 ALA CB . 27545 1
97 . 1 1 26 26 ALA N N 15 125.3277 0.0799 . 1 . . . . . 26 ALA N . 27545 1
98 . 1 1 27 27 MET H H 1 8.5504 0.0015 . 1 . . . . . 27 MET H . 27545 1
99 . 1 1 27 27 MET CA C 13 54.3053 0.0707 . 1 . . . . . 27 MET CA . 27545 1
100 . 1 1 27 27 MET CB C 13 29.1931 0.0140 . 1 . . . . . 27 MET CB . 27545 1
101 . 1 1 27 27 MET N N 15 111.0956 0.0800 . 1 . . . . . 27 MET N . 27545 1
102 . 1 1 28 28 ARG H H 1 7.2100 0.0017 . 1 . . . . . 28 ARG H . 27545 1
103 . 1 1 28 28 ARG CA C 13 59.7951 0.0349 . 1 . . . . . 28 ARG CA . 27545 1
104 . 1 1 28 28 ARG CB C 13 29.9726 0.0864 . 1 . . . . . 28 ARG CB . 27545 1
105 . 1 1 28 28 ARG N N 15 119.6112 0.0249 . 1 . . . . . 28 ARG N . 27545 1
106 . 1 1 29 29 VAL H H 1 7.1575 0.0022 . 1 . . . . . 29 VAL H . 27545 1
107 . 1 1 29 29 VAL CA C 13 65.9026 0.0343 . 1 . . . . . 29 VAL CA . 27545 1
108 . 1 1 29 29 VAL CB C 13 32.3141 0.0351 . 1 . . . . . 29 VAL CB . 27545 1
109 . 1 1 29 29 VAL N N 15 116.0188 0.0382 . 1 . . . . . 29 VAL N . 27545 1
110 . 1 1 30 30 ILE H H 1 6.7674 0.0012 . 1 . . . . . 30 ILE H . 27545 1
111 . 1 1 30 30 ILE CA C 13 65.2995 0.0524 . 1 . . . . . 30 ILE CA . 27545 1
112 . 1 1 30 30 ILE CB C 13 39.8077 0.0291 . 1 . . . . . 30 ILE CB . 27545 1
113 . 1 1 30 30 ILE N N 15 118.3732 0.0645 . 1 . . . . . 30 ILE N . 27545 1
114 . 1 1 31 31 ASN H H 1 8.9628 0.0050 . 1 . . . . . 31 ASN H . 27545 1
115 . 1 1 31 31 ASN CA C 13 55.0454 0.0909 . 1 . . . . . 31 ASN CA . 27545 1
116 . 1 1 31 31 ASN CB C 13 37.8746 0.0538 . 1 . . . . . 31 ASN CB . 27545 1
117 . 1 1 31 31 ASN N N 15 119.3901 0.0548 . 1 . . . . . 31 ASN N . 27545 1
118 . 1 1 32 32 ASN H H 1 8.3491 0.0011 . 1 . . . . . 32 ASN H . 27545 1
119 . 1 1 32 32 ASN CA C 13 55.8998 0.0141 . 1 . . . . . 32 ASN CA . 27545 1
120 . 1 1 32 32 ASN CB C 13 38.4419 0.0195 . 1 . . . . . 32 ASN CB . 27545 1
121 . 1 1 32 32 ASN N N 15 118.3535 0.0879 . 1 . . . . . 32 ASN N . 27545 1
122 . 1 1 33 33 TYR H H 1 7.6722 0.0016 . 1 . . . . . 33 TYR H . 27545 1
123 . 1 1 33 33 TYR CA C 13 60.7735 0.0070 . 1 . . . . . 33 TYR CA . 27545 1
124 . 1 1 33 33 TYR CB C 13 39.1169 0.0459 . 1 . . . . . 33 TYR CB . 27545 1
125 . 1 1 33 33 TYR N N 15 116.6713 0.0411 . 1 . . . . . 33 TYR N . 27545 1
126 . 1 1 34 34 GLN H H 1 8.0520 0.0011 . 1 . . . . . 34 GLN H . 27545 1
127 . 1 1 34 34 GLN CA C 13 55.8848 0.0010 . 1 . . . . . 34 GLN CA . 27545 1
128 . 1 1 34 34 GLN CB C 13 30.2954 0.0491 . 1 . . . . . 34 GLN CB . 27545 1
129 . 1 1 34 34 GLN N N 15 114.8855 0.0316 . 1 . . . . . 34 GLN N . 27545 1
130 . 1 1 35 35 ARG H H 1 8.3608 0.0006 . 1 . . . . . 35 ARG H . 27545 1
131 . 1 1 35 35 ARG CA C 13 57.3125 0.0342 . 1 . . . . . 35 ARG CA . 27545 1
132 . 1 1 35 35 ARG CB C 13 27.6005 0.1316 . 1 . . . . . 35 ARG CB . 27545 1
133 . 1 1 35 35 ARG N N 15 115.6307 0.0286 . 1 . . . . . 35 ARG N . 27545 1
134 . 1 1 36 36 ARG H H 1 7.8401 0.0037 . 1 . . . . . 36 ARG H . 27545 1
135 . 1 1 36 36 ARG CA C 13 55.0721 0.0138 . 1 . . . . . 36 ARG CA . 27545 1
136 . 1 1 36 36 ARG CB C 13 32.7537 0.0480 . 1 . . . . . 36 ARG CB . 27545 1
137 . 1 1 36 36 ARG N N 15 115.5412 0.0549 . 1 . . . . . 36 ARG N . 27545 1
138 . 1 1 37 37 CYS H H 1 9.0399 0.0026 . 1 . . . . . 37 CYS H . 27545 1
139 . 1 1 37 37 CYS CA C 13 54.8055 0.1242 . 1 . . . . . 37 CYS CA . 27545 1
140 . 1 1 37 37 CYS CB C 13 40.7854 0.0303 . 1 . . . . . 37 CYS CB . 27545 1
141 . 1 1 37 37 CYS N N 15 118.9840 0.0862 . 1 . . . . . 37 CYS N . 27545 1
142 . 1 1 38 38 LYS H H 1 8.9182 0.0061 . 1 . . . . . 38 LYS H . 27545 1
143 . 1 1 38 38 LYS CA C 13 57.2200 0.0282 . 1 . . . . . 38 LYS CA . 27545 1
144 . 1 1 38 38 LYS CB C 13 32.9973 0.0272 . 1 . . . . . 38 LYS CB . 27545 1
145 . 1 1 38 38 LYS N N 15 126.6287 0.0222 . 1 . . . . . 38 LYS N . 27545 1
146 . 1 1 39 39 ASP H H 1 8.9406 0.0037 . 1 . . . . . 39 ASP H . 27545 1
147 . 1 1 39 39 ASP CA C 13 57.3104 0.0445 . 1 . . . . . 39 ASP CA . 27545 1
148 . 1 1 39 39 ASP CB C 13 40.4062 0.0468 . 1 . . . . . 39 ASP CB . 27545 1
149 . 1 1 39 39 ASP N N 15 126.6006 0.0161 . 1 . . . . . 39 ASP N . 27545 1
150 . 1 1 40 40 GLN H H 1 7.8204 0.0032 . 1 . . . . . 40 GLN H . 27545 1
151 . 1 1 40 40 GLN CA C 13 54.3921 0.0072 . 1 . . . . . 40 GLN CA . 27545 1
152 . 1 1 40 40 GLN CB C 13 31.4553 0.0788 . 1 . . . . . 40 GLN CB . 27545 1
153 . 1 1 40 40 GLN N N 15 114.6126 0.1003 . 1 . . . . . 40 GLN N . 27545 1
154 . 1 1 41 41 ASN H H 1 8.3402 0.0029 . 1 . . . . . 41 ASN H . 27545 1
155 . 1 1 41 41 ASN CA C 13 54.7618 0.0549 . 1 . . . . . 41 ASN CA . 27545 1
156 . 1 1 41 41 ASN CB C 13 44.1476 0.0236 . 1 . . . . . 41 ASN CB . 27545 1
157 . 1 1 41 41 ASN N N 15 116.2154 0.0437 . 1 . . . . . 41 ASN N . 27545 1
158 . 1 1 42 42 THR H H 1 7.5661 0.0037 . 1 . . . . . 42 THR H . 27545 1
159 . 1 1 42 42 THR CA C 13 62.0799 0.0596 . 1 . . . . . 42 THR CA . 27545 1
160 . 1 1 42 42 THR CB C 13 70.0185 0.0282 . 1 . . . . . 42 THR CB . 27545 1
161 . 1 1 42 42 THR N N 15 120.9494 0.0467 . 1 . . . . . 42 THR N . 27545 1
162 . 1 1 43 43 PHE H H 1 9.7800 0.0042 . 1 . . . . . 43 PHE H . 27545 1
163 . 1 1 43 43 PHE CA C 13 57.3680 0.0381 . 1 . . . . . 43 PHE CA . 27545 1
164 . 1 1 43 43 PHE CB C 13 41.1457 0.0381 . 1 . . . . . 43 PHE CB . 27545 1
165 . 1 1 43 43 PHE N N 15 125.3861 0.0363 . 1 . . . . . 43 PHE N . 27545 1
166 . 1 1 44 44 LEU H H 1 9.2054 0.0013 . 1 . . . . . 44 LEU H . 27545 1
167 . 1 1 44 44 LEU CA C 13 53.6192 0.0259 . 1 . . . . . 44 LEU CA . 27545 1
168 . 1 1 44 44 LEU CB C 13 43.6131 0.0410 . 1 . . . . . 44 LEU CB . 27545 1
169 . 1 1 44 44 LEU N N 15 122.5041 0.0286 . 1 . . . . . 44 LEU N . 27545 1
170 . 1 1 45 45 ARG H H 1 8.7068 0.0023 . 1 . . . . . 45 ARG H . 27545 1
171 . 1 1 45 45 ARG CA C 13 54.2135 0.0677 . 1 . . . . . 45 ARG CA . 27545 1
172 . 1 1 45 45 ARG CB C 13 27.5736 0.0411 . 1 . . . . . 45 ARG CB . 27545 1
173 . 1 1 45 45 ARG N N 15 125.2980 0.0338 . 1 . . . . . 45 ARG N . 27545 1
174 . 1 1 46 46 THR H H 1 7.5210 0.0009 . 1 . . . . . 46 THR H . 27545 1
175 . 1 1 46 46 THR CA C 13 59.0903 0.0139 . 1 . . . . . 46 THR CA . 27545 1
176 . 1 1 46 46 THR CB C 13 68.6467 0.0617 . 1 . . . . . 46 THR CB . 27545 1
177 . 1 1 46 46 THR N N 15 118.7955 0.0475 . 1 . . . . . 46 THR N . 27545 1
178 . 1 1 47 47 THR H H 1 8.0657 0.0017 . 1 . . . . . 47 THR H . 27545 1
179 . 1 1 47 47 THR CA C 13 59.1065 0.0182 . 1 . . . . . 47 THR CA . 27545 1
180 . 1 1 47 47 THR CB C 13 71.5973 0.0148 . 1 . . . . . 47 THR CB . 27545 1
181 . 1 1 47 47 THR N N 15 108.3394 0.0620 . 1 . . . . . 47 THR N . 27545 1
182 . 1 1 48 48 PHE H H 1 9.5318 0.0016 . 1 . . . . . 48 PHE H . 27545 1
183 . 1 1 48 48 PHE CA C 13 62.9919 0.0220 . 1 . . . . . 48 PHE CA . 27545 1
184 . 1 1 48 48 PHE CB C 13 39.3055 0.0083 . 1 . . . . . 48 PHE CB . 27545 1
185 . 1 1 48 48 PHE N N 15 123.9118 0.0206 . 1 . . . . . 48 PHE N . 27545 1
186 . 1 1 49 49 ALA H H 1 8.7456 0.0016 . 1 . . . . . 49 ALA H . 27545 1
187 . 1 1 49 49 ALA CA C 13 55.3405 0.0763 . 1 . . . . . 49 ALA CA . 27545 1
188 . 1 1 49 49 ALA CB C 13 18.4380 0.0967 . 1 . . . . . 49 ALA CB . 27545 1
189 . 1 1 49 49 ALA N N 15 118.8144 0.0525 . 1 . . . . . 49 ALA N . 27545 1
190 . 1 1 50 50 ASN H H 1 7.7490 0.0021 . 1 . . . . . 50 ASN H . 27545 1
191 . 1 1 50 50 ASN CA C 13 56.2578 0.0352 . 1 . . . . . 50 ASN CA . 27545 1
192 . 1 1 50 50 ASN CB C 13 37.9886 0.0412 . 1 . . . . . 50 ASN CB . 27545 1
193 . 1 1 50 50 ASN N N 15 116.9154 0.1492 . 1 . . . . . 50 ASN N . 27545 1
194 . 1 1 51 51 VAL H H 1 7.6346 0.0016 . 1 . . . . . 51 VAL H . 27545 1
195 . 1 1 51 51 VAL CA C 13 65.2886 0.0187 . 1 . . . . . 51 VAL CA . 27545 1
196 . 1 1 51 51 VAL CB C 13 31.1720 0.0238 . 1 . . . . . 51 VAL CB . 27545 1
197 . 1 1 51 51 VAL N N 15 121.8266 0.0117 . 1 . . . . . 51 VAL N . 27545 1
198 . 1 1 52 52 VAL H H 1 8.0536 0.0015 . 1 . . . . . 52 VAL H . 27545 1
199 . 1 1 52 52 VAL CA C 13 67.3450 0.0232 . 1 . . . . . 52 VAL CA . 27545 1
200 . 1 1 52 52 VAL CB C 13 30.7575 0.0876 . 1 . . . . . 52 VAL CB . 27545 1
201 . 1 1 52 52 VAL N N 15 119.3287 0.0354 . 1 . . . . . 52 VAL N . 27545 1
202 . 1 1 53 53 ASN H H 1 7.5406 0.0018 . 1 . . . . . 53 ASN H . 27545 1
203 . 1 1 53 53 ASN CA C 13 56.5372 0.0119 . 1 . . . . . 53 ASN CA . 27545 1
204 . 1 1 53 53 ASN CB C 13 38.1165 0.0188 . 1 . . . . . 53 ASN CB . 27545 1
205 . 1 1 53 53 ASN N N 15 117.5893 0.0700 . 1 . . . . . 53 ASN N . 27545 1
206 . 1 1 54 54 VAL H H 1 7.5187 0.0015 . 1 . . . . . 54 VAL H . 27545 1
207 . 1 1 54 54 VAL CA C 13 66.1751 0.0060 . 1 . . . . . 54 VAL CA . 27545 1
208 . 1 1 54 54 VAL CB C 13 30.7314 0.0175 . 1 . . . . . 54 VAL CB . 27545 1
209 . 1 1 54 54 VAL N N 15 123.7489 0.0496 . 1 . . . . . 54 VAL N . 27545 1
210 . 1 1 55 55 CYS H H 1 7.5908 0.0016 . 1 . . . . . 55 CYS H . 27545 1
211 . 1 1 55 55 CYS CA C 13 55.5376 0.0094 . 1 . . . . . 55 CYS CA . 27545 1
212 . 1 1 55 55 CYS CB C 13 38.4975 0.0361 . 1 . . . . . 55 CYS CB . 27545 1
213 . 1 1 55 55 CYS N N 15 116.2245 0.0484 . 1 . . . . . 55 CYS N . 27545 1
214 . 1 1 56 56 GLY H H 1 7.4417 0.0022 . 1 . . . . . 56 GLY H . 27545 1
215 . 1 1 56 56 GLY CA C 13 44.9460 0.0104 . 1 . . . . . 56 GLY CA . 27545 1
216 . 1 1 56 56 GLY N N 15 104.3472 0.0916 . 1 . . . . . 56 GLY N . 27545 1
217 . 1 1 57 57 ASN H H 1 7.8762 0.0013 . 1 . . . . . 57 ASN H . 27545 1
218 . 1 1 57 57 ASN CA C 13 52.0601 . . 1 . . . . . 57 ASN CA . 27545 1
219 . 1 1 57 57 ASN CB C 13 35.5655 . . 1 . . . . . 57 ASN CB . 27545 1
220 . 1 1 57 57 ASN N N 15 121.9171 0.0257 . 1 . . . . . 57 ASN N . 27545 1
221 . 1 1 58 58 PRO CA C 13 64.7298 0.0147 . 1 . . . . . 58 PRO CA . 27545 1
222 . 1 1 58 58 PRO CB C 13 32.2050 0.0384 . 1 . . . . . 58 PRO CB . 27545 1
223 . 1 1 59 59 ASN H H 1 8.4386 0.0023 . 1 . . . . . 59 ASN H . 27545 1
224 . 1 1 59 59 ASN CA C 13 54.1767 0.0299 . 1 . . . . . 59 ASN CA . 27545 1
225 . 1 1 59 59 ASN CB C 13 37.9189 0.0491 . 1 . . . . . 59 ASN CB . 27545 1
226 . 1 1 59 59 ASN N N 15 120.7801 0.0357 . 1 . . . . . 59 ASN N . 27545 1
227 . 1 1 60 60 ILE H H 1 8.4997 0.0014 . 1 . . . . . 60 ILE H . 27545 1
228 . 1 1 60 60 ILE CA C 13 59.0731 0.0125 . 1 . . . . . 60 ILE CA . 27545 1
229 . 1 1 60 60 ILE CB C 13 43.3077 0.0689 . 1 . . . . . 60 ILE CB . 27545 1
230 . 1 1 60 60 ILE N N 15 117.8058 0.0604 . 1 . . . . . 60 ILE N . 27545 1
231 . 1 1 61 61 THR H H 1 8.1327 0.0014 . 1 . . . . . 61 THR H . 27545 1
232 . 1 1 61 61 THR CA C 13 63.6093 0.0258 . 1 . . . . . 61 THR CA . 27545 1
233 . 1 1 61 61 THR CB C 13 69.8005 0.0083 . 1 . . . . . 61 THR CB . 27545 1
234 . 1 1 61 61 THR N N 15 116.3067 0.0473 . 1 . . . . . 61 THR N . 27545 1
235 . 1 1 62 62 CYS H H 1 8.5480 0.0029 . 1 . . . . . 62 CYS H . 27545 1
236 . 1 1 62 62 CYS CA C 13 52.3193 . . 1 . . . . . 62 CYS CA . 27545 1
237 . 1 1 62 62 CYS CB C 13 41.2486 . . 1 . . . . . 62 CYS CB . 27545 1
238 . 1 1 62 62 CYS N N 15 127.2555 0.0450 . 1 . . . . . 62 CYS N . 27545 1
239 . 1 1 63 63 PRO CA C 13 65.3946 0.0210 . 1 . . . . . 63 PRO CA . 27545 1
240 . 1 1 63 63 PRO CB C 13 31.6940 0.0414 . 1 . . . . . 63 PRO CB . 27545 1
241 . 1 1 64 64 SER H H 1 9.3998 0.0036 . 1 . . . . . 64 SER H . 27545 1
242 . 1 1 64 64 SER CA C 13 59.7471 0.0101 . 1 . . . . . 64 SER CA . 27545 1
243 . 1 1 64 64 SER CB C 13 63.2218 0.0756 . 1 . . . . . 64 SER CB . 27545 1
244 . 1 1 64 64 SER N N 15 111.4467 0.0494 . 1 . . . . . 64 SER N . 27545 1
245 . 1 1 65 65 ASN H H 1 7.3647 0.0017 . 1 . . . . . 65 ASN H . 27545 1
246 . 1 1 65 65 ASN CA C 13 53.0254 0.0292 . 1 . . . . . 65 ASN CA . 27545 1
247 . 1 1 65 65 ASN CB C 13 38.0350 0.0297 . 1 . . . . . 65 ASN CB . 27545 1
248 . 1 1 65 65 ASN N N 15 119.0487 0.0511 . 1 . . . . . 65 ASN N . 27545 1
249 . 1 1 66 66 ARG H H 1 8.6839 0.0011 . 1 . . . . . 66 ARG H . 27545 1
250 . 1 1 66 66 ARG CA C 13 58.2756 0.1225 . 1 . . . . . 66 ARG CA . 27545 1
251 . 1 1 66 66 ARG CB C 13 29.2451 0.0516 . 1 . . . . . 66 ARG CB . 27545 1
252 . 1 1 66 66 ARG N N 15 120.7819 0.0344 . 1 . . . . . 66 ARG N . 27545 1
253 . 1 1 67 67 SER H H 1 7.9704 0.0025 . 1 . . . . . 67 SER H . 27545 1
254 . 1 1 67 67 SER CA C 13 59.5246 0.0119 . 1 . . . . . 67 SER CA . 27545 1
255 . 1 1 67 67 SER CB C 13 63.4688 0.0491 . 1 . . . . . 67 SER CB . 27545 1
256 . 1 1 67 67 SER N N 15 113.6120 0.0590 . 1 . . . . . 67 SER N . 27545 1
257 . 1 1 68 68 ARG H H 1 8.3244 0.0012 . 1 . . . . . 68 ARG H . 27545 1
258 . 1 1 68 68 ARG CA C 13 54.4063 0.0162 . 1 . . . . . 68 ARG CA . 27545 1
259 . 1 1 68 68 ARG CB C 13 32.6826 0.0353 . 1 . . . . . 68 ARG CB . 27545 1
260 . 1 1 68 68 ARG N N 15 121.9051 0.0342 . 1 . . . . . 68 ARG N . 27545 1
261 . 1 1 69 69 ASN H H 1 8.4992 0.0026 . 1 . . . . . 69 ASN H . 27545 1
262 . 1 1 69 69 ASN CA C 13 51.8379 0.0328 . 1 . . . . . 69 ASN CA . 27545 1
263 . 1 1 69 69 ASN CB C 13 38.0161 0.0514 . 1 . . . . . 69 ASN CB . 27545 1
264 . 1 1 69 69 ASN N N 15 119.5320 0.0552 . 1 . . . . . 69 ASN N . 27545 1
265 . 1 1 70 70 ASN H H 1 8.3747 0.0015 . 1 . . . . . 70 ASN H . 27545 1
266 . 1 1 70 70 ASN CA C 13 52.2250 0.0454 . 1 . . . . . 70 ASN CA . 27545 1
267 . 1 1 70 70 ASN CB C 13 36.7382 0.0236 . 1 . . . . . 70 ASN CB . 27545 1
268 . 1 1 70 70 ASN N N 15 116.6680 0.0341 . 1 . . . . . 70 ASN N . 27545 1
269 . 1 1 71 71 CYS H H 1 7.1682 0.0009 . 1 . . . . . 71 CYS H . 27545 1
270 . 1 1 71 71 CYS CA C 13 60.1578 0.0197 . 1 . . . . . 71 CYS CA . 27545 1
271 . 1 1 71 71 CYS CB C 13 46.8197 0.0249 . 1 . . . . . 71 CYS CB . 27545 1
272 . 1 1 71 71 CYS N N 15 114.9090 0.0576 . 1 . . . . . 71 CYS N . 27545 1
273 . 1 1 72 72 HIS H H 1 8.3818 0.0019 . 1 . . . . . 72 HIS H . 27545 1
274 . 1 1 72 72 HIS CA C 13 55.3799 0.0459 . 1 . . . . . 72 HIS CA . 27545 1
275 . 1 1 72 72 HIS CB C 13 33.4401 0.0223 . 1 . . . . . 72 HIS CB . 27545 1
276 . 1 1 72 72 HIS N N 15 115.6563 0.0312 . 1 . . . . . 72 HIS N . 27545 1
277 . 1 1 73 73 HIS H H 1 10.1257 0.0083 . 1 . . . . . 73 HIS H . 27545 1
278 . 1 1 73 73 HIS N N 15 127.7007 0.0210 . 1 . . . . . 73 HIS N . 27545 1
279 . 1 1 79 79 PRO CA C 13 61.8891 0.0170 . 1 . . . . . 79 PRO CA . 27545 1
280 . 1 1 79 79 PRO CB C 13 31.6966 0.1146 . 1 . . . . . 79 PRO CB . 27545 1
281 . 1 1 80 80 PHE H H 1 8.5063 0.0050 . 1 . . . . . 80 PHE H . 27545 1
282 . 1 1 80 80 PHE CA C 13 55.5396 0.0213 . 1 . . . . . 80 PHE CA . 27545 1
283 . 1 1 80 80 PHE CB C 13 43.3423 0.0458 . 1 . . . . . 80 PHE CB . 27545 1
284 . 1 1 80 80 PHE N N 15 118.7179 0.0756 . 1 . . . . . 80 PHE N . 27545 1
285 . 1 1 81 81 ILE H H 1 9.1259 0.0018 . 1 . . . . . 81 ILE H . 27545 1
286 . 1 1 81 81 ILE CA C 13 60.8985 0.0199 . 1 . . . . . 81 ILE CA . 27545 1
287 . 1 1 81 81 ILE CB C 13 42.0782 0.0688 . 1 . . . . . 81 ILE CB . 27545 1
288 . 1 1 81 81 ILE N N 15 120.2538 0.0399 . 1 . . . . . 81 ILE N . 27545 1
289 . 1 1 82 82 TYR H H 1 9.7567 0.0024 . 1 . . . . . 82 TYR H . 27545 1
290 . 1 1 82 82 TYR CA C 13 55.6281 0.0101 . 1 . . . . . 82 TYR CA . 27545 1
291 . 1 1 82 82 TYR CB C 13 40.8131 0.0001 . 1 . . . . . 82 TYR CB . 27545 1
292 . 1 1 82 82 TYR N N 15 129.3280 0.0473 . 1 . . . . . 82 TYR N . 27545 1
293 . 1 1 83 83 CYS H H 1 8.6188 0.0005 . 1 . . . . . 83 CYS H . 27545 1
294 . 1 1 83 83 CYS CA C 13 52.2010 0.0269 . 1 . . . . . 83 CYS CA . 27545 1
295 . 1 1 83 83 CYS CB C 13 40.5365 0.0668 . 1 . . . . . 83 CYS CB . 27545 1
296 . 1 1 83 83 CYS N N 15 123.4919 0.0214 . 1 . . . . . 83 CYS N . 27545 1
297 . 1 1 84 84 ASN H H 1 8.8211 0.0044 . 1 . . . . . 84 ASN H . 27545 1
298 . 1 1 84 84 ASN CA C 13 52.0049 0.0498 . 1 . . . . . 84 ASN CA . 27545 1
299 . 1 1 84 84 ASN CB C 13 41.9271 0.0730 . 1 . . . . . 84 ASN CB . 27545 1
300 . 1 1 84 84 ASN N N 15 121.3047 0.0599 . 1 . . . . . 84 ASN N . 27545 1
301 . 1 1 85 85 LEU H H 1 9.0241 0.0009 . 1 . . . . . 85 LEU H . 27545 1
302 . 1 1 85 85 LEU CA C 13 56.1975 0.0100 . 1 . . . . . 85 LEU CA . 27545 1
303 . 1 1 85 85 LEU CB C 13 43.3296 0.0895 . 1 . . . . . 85 LEU CB . 27545 1
304 . 1 1 85 85 LEU N N 15 129.7424 0.0217 . 1 . . . . . 85 LEU N . 27545 1
305 . 1 1 86 86 THR H H 1 8.8211 0.0023 . 1 . . . . . 86 THR H . 27545 1
306 . 1 1 86 86 THR CA C 13 61.7745 0.0223 . 1 . . . . . 86 THR CA . 27545 1
307 . 1 1 86 86 THR CB C 13 69.3010 0.0488 . 1 . . . . . 86 THR CB . 27545 1
308 . 1 1 86 86 THR N N 15 118.3511 0.0732 . 1 . . . . . 86 THR N . 27545 1
309 . 1 1 87 87 THR H H 1 6.9890 0.0019 . 1 . . . . . 87 THR H . 27545 1
310 . 1 1 87 87 THR CA C 13 59.6334 . . 1 . . . . . 87 THR CA . 27545 1
311 . 1 1 87 87 THR CB C 13 71.0409 . . 1 . . . . . 87 THR CB . 27545 1
312 . 1 1 87 87 THR N N 15 117.2226 0.0571 . 1 . . . . . 87 THR N . 27545 1
313 . 1 1 88 88 PRO CA C 13 63.0412 . . 1 . . . . . 88 PRO CA . 27545 1
314 . 1 1 88 88 PRO CB C 13 32.5173 0.0329 . 1 . . . . . 88 PRO CB . 27545 1
315 . 1 1 89 89 SER H H 1 8.2662 0.0025 . 1 . . . . . 89 SER H . 27545 1
316 . 1 1 89 89 SER CA C 13 55.7220 . . 1 . . . . . 89 SER CA . 27545 1
317 . 1 1 89 89 SER CB C 13 62.8687 . . 1 . . . . . 89 SER CB . 27545 1
318 . 1 1 89 89 SER N N 15 113.6271 0.0670 . 1 . . . . . 89 SER N . 27545 1
319 . 1 1 90 90 PRO CA C 13 63.7082 0.0087 . 1 . . . . . 90 PRO CA . 27545 1
320 . 1 1 90 90 PRO CB C 13 32.3525 0.0102 . 1 . . . . . 90 PRO CB . 27545 1
321 . 1 1 91 91 GLN H H 1 8.6768 0.0007 . 1 . . . . . 91 GLN H . 27545 1
322 . 1 1 91 91 GLN CA C 13 56.7284 0.0226 . 1 . . . . . 91 GLN CA . 27545 1
323 . 1 1 91 91 GLN CB C 13 29.3009 0.0449 . 1 . . . . . 91 GLN CB . 27545 1
324 . 1 1 91 91 GLN N N 15 117.9891 0.0692 . 1 . . . . . 91 GLN N . 27545 1
325 . 1 1 92 92 ASN H H 1 7.7762 0.0007 . 1 . . . . . 92 ASN H . 27545 1
326 . 1 1 92 92 ASN CA C 13 52.5226 0.0517 . 1 . . . . . 92 ASN CA . 27545 1
327 . 1 1 92 92 ASN CB C 13 38.7697 0.0183 . 1 . . . . . 92 ASN CB . 27545 1
328 . 1 1 92 92 ASN N N 15 116.1754 0.0438 . 1 . . . . . 92 ASN N . 27545 1
329 . 1 1 93 93 ILE H H 1 8.5782 0.0017 . 1 . . . . . 93 ILE H . 27545 1
330 . 1 1 93 93 ILE CA C 13 63.5786 0.0250 . 1 . . . . . 93 ILE CA . 27545 1
331 . 1 1 93 93 ILE CB C 13 38.5729 0.1278 . 1 . . . . . 93 ILE CB . 27545 1
332 . 1 1 93 93 ILE N N 15 121.0331 0.0563 . 1 . . . . . 93 ILE N . 27545 1
333 . 1 1 94 94 SER H H 1 8.3469 0.0011 . 1 . . . . . 94 SER H . 27545 1
334 . 1 1 94 94 SER CA C 13 60.6670 0.0354 . 1 . . . . . 94 SER CA . 27545 1
335 . 1 1 94 94 SER CB C 13 63.0869 0.0920 . 1 . . . . . 94 SER CB . 27545 1
336 . 1 1 94 94 SER N N 15 116.4319 0.0319 . 1 . . . . . 94 SER N . 27545 1
337 . 1 1 95 95 ASN H H 1 7.8808 0.0036 . 1 . . . . . 95 ASN H . 27545 1
338 . 1 1 95 95 ASN HD21 H 1 6.8875 0.0037 . 1 . . . . . 95 ASN HD21 . 27545 1
339 . 1 1 95 95 ASN HD22 H 1 7.5690 0.0027 . 1 . . . . . 95 ASN HD22 . 27545 1
340 . 1 1 95 95 ASN CA C 13 52.4394 0.0613 . 1 . . . . . 95 ASN CA . 27545 1
341 . 1 1 95 95 ASN CB C 13 39.1531 0.0708 . 1 . . . . . 95 ASN CB . 27545 1
342 . 1 1 95 95 ASN N N 15 117.4874 0.1181 . 1 . . . . . 95 ASN N . 27545 1
343 . 1 1 95 95 ASN ND2 N 15 110.8883 0.2050 . 1 . . . . . 95 ASN ND2 . 27545 1
344 . 1 1 96 96 CYS H H 1 7.5497 0.0014 . 1 . . . . . 96 CYS H . 27545 1
345 . 1 1 96 96 CYS CA C 13 55.8945 0.0649 . 1 . . . . . 96 CYS CA . 27545 1
346 . 1 1 96 96 CYS CB C 13 43.1447 0.0274 . 1 . . . . . 96 CYS CB . 27545 1
347 . 1 1 96 96 CYS N N 15 118.9373 0.0476 . 1 . . . . . 96 CYS N . 27545 1
348 . 1 1 97 97 SER H H 1 8.2106 0.0005 . 1 . . . . . 97 SER H . 27545 1
349 . 1 1 97 97 SER CA C 13 57.6790 0.0205 . 1 . . . . . 97 SER CA . 27545 1
350 . 1 1 97 97 SER CB C 13 64.6252 0.0357 . 1 . . . . . 97 SER CB . 27545 1
351 . 1 1 97 97 SER N N 15 120.1143 0.0484 . 1 . . . . . 97 SER N . 27545 1
352 . 1 1 98 98 TYR H H 1 8.7098 0.0009 . 1 . . . . . 98 TYR H . 27545 1
353 . 1 1 98 98 TYR CA C 13 57.7217 0.1057 . 1 . . . . . 98 TYR CA . 27545 1
354 . 1 1 98 98 TYR CB C 13 44.0172 0.0341 . 1 . . . . . 98 TYR CB . 27545 1
355 . 1 1 98 98 TYR N N 15 120.8019 0.0198 . 1 . . . . . 98 TYR N . 27545 1
356 . 1 1 99 99 ALA H H 1 9.2658 0.0028 . 1 . . . . . 99 ALA H . 27545 1
357 . 1 1 99 99 ALA CA C 13 51.2075 0.0899 . 1 . . . . . 99 ALA CA . 27545 1
358 . 1 1 99 99 ALA CB C 13 20.6418 0.0512 . 1 . . . . . 99 ALA CB . 27545 1
359 . 1 1 99 99 ALA N N 15 126.8074 0.0308 . 1 . . . . . 99 ALA N . 27545 1
360 . 1 1 100 100 ASN H H 1 8.6320 0.0014 . 1 . . . . . 100 ASN H . 27545 1
361 . 1 1 100 100 ASN CA C 13 52.7908 0.0236 . 1 . . . . . 100 ASN CA . 27545 1
362 . 1 1 100 100 ASN CB C 13 43.8170 0.0381 . 1 . . . . . 100 ASN CB . 27545 1
363 . 1 1 100 100 ASN N N 15 116.8386 0.0595 . 1 . . . . . 100 ASN N . 27545 1
364 . 1 1 101 101 ILE H H 1 9.0252 0.0008 . 1 . . . . . 101 ILE H . 27545 1
365 . 1 1 101 101 ILE CA C 13 61.0530 0.0296 . 1 . . . . . 101 ILE CA . 27545 1
366 . 1 1 101 101 ILE CB C 13 41.7666 0.0506 . 1 . . . . . 101 ILE CB . 27545 1
367 . 1 1 101 101 ILE N N 15 123.9552 0.0251 . 1 . . . . . 101 ILE N . 27545 1
368 . 1 1 102 102 THR H H 1 8.4394 0.0023 . 1 . . . . . 102 THR H . 27545 1
369 . 1 1 102 102 THR CA C 13 59.5641 0.0342 . 1 . . . . . 102 THR CA . 27545 1
370 . 1 1 102 102 THR CB C 13 71.7672 0.0261 . 1 . . . . . 102 THR CB . 27545 1
371 . 1 1 102 102 THR N N 15 116.6585 0.0431 . 1 . . . . . 102 THR N . 27545 1
372 . 1 1 103 103 GLY H H 1 6.8050 0.0016 . 1 . . . . . 103 GLY H . 27545 1
373 . 1 1 103 103 GLY CA C 13 45.6790 0.0227 . 1 . . . . . 103 GLY CA . 27545 1
374 . 1 1 103 103 GLY N N 15 107.2572 0.0679 . 1 . . . . . 103 GLY N . 27545 1
375 . 1 1 104 104 ARG H H 1 8.6393 0.0011 . 1 . . . . . 104 ARG H . 27545 1
376 . 1 1 104 104 ARG CA C 13 56.1291 0.0878 . 1 . . . . . 104 ARG CA . 27545 1
377 . 1 1 104 104 ARG CB C 13 32.5719 0.0253 . 1 . . . . . 104 ARG CB . 27545 1
378 . 1 1 104 104 ARG N N 15 122.8254 0.0257 . 1 . . . . . 104 ARG N . 27545 1
379 . 1 1 105 105 ARG H H 1 8.5040 0.0066 . 1 . . . . . 105 ARG H . 27545 1
380 . 1 1 105 105 ARG CA C 13 55.1001 0.1021 . 1 . . . . . 105 ARG CA . 27545 1
381 . 1 1 105 105 ARG CB C 13 36.8737 0.0946 . 1 . . . . . 105 ARG CB . 27545 1
382 . 1 1 105 105 ARG N N 15 122.0636 0.1092 . 1 . . . . . 105 ARG N . 27545 1
383 . 1 1 106 106 PHE H H 1 8.6791 0.0029 . 1 . . . . . 106 PHE H . 27545 1
384 . 1 1 106 106 PHE CA C 13 58.1822 0.0051 . 1 . . . . . 106 PHE CA . 27545 1
385 . 1 1 106 106 PHE CB C 13 40.2147 0.0272 . 1 . . . . . 106 PHE CB . 27545 1
386 . 1 1 106 106 PHE N N 15 118.7784 0.1164 . 1 . . . . . 106 PHE N . 27545 1
387 . 1 1 107 107 TYR H H 1 8.2931 0.0018 . 1 . . . . . 107 TYR H . 27545 1
388 . 1 1 107 107 TYR CA C 13 55.6205 0.0538 . 1 . . . . . 107 TYR CA . 27545 1
389 . 1 1 107 107 TYR CB C 13 42.3897 0.0212 . 1 . . . . . 107 TYR CB . 27545 1
390 . 1 1 107 107 TYR N N 15 113.1827 0.0907 . 1 . . . . . 107 TYR N . 27545 1
391 . 1 1 108 108 ILE H H 1 8.6543 0.0052 . 1 . . . . . 108 ILE H . 27545 1
392 . 1 1 108 108 ILE CA C 13 59.5649 0.0664 . 1 . . . . . 108 ILE CA . 27545 1
393 . 1 1 108 108 ILE CB C 13 40.6792 0.0822 . 1 . . . . . 108 ILE CB . 27545 1
394 . 1 1 108 108 ILE N N 15 118.5966 0.0462 . 1 . . . . . 108 ILE N . 27545 1
395 . 1 1 109 109 VAL H H 1 8.6862 0.0025 . 1 . . . . . 109 VAL H . 27545 1
396 . 1 1 109 109 VAL CA C 13 57.9970 0.0025 . 1 . . . . . 109 VAL CA . 27545 1
397 . 1 1 109 109 VAL CB C 13 35.7809 0.0341 . 1 . . . . . 109 VAL CB . 27545 1
398 . 1 1 109 109 VAL N N 15 121.0131 0.0847 . 1 . . . . . 109 VAL N . 27545 1
399 . 1 1 110 110 ALA H H 1 9.0383 0.0013 . 1 . . . . . 110 ALA H . 27545 1
400 . 1 1 110 110 ALA CA C 13 50.8787 0.0297 . 1 . . . . . 110 ALA CA . 27545 1
401 . 1 1 110 110 ALA CB C 13 20.9120 0.0445 . 1 . . . . . 110 ALA CB . 27545 1
402 . 1 1 110 110 ALA N N 15 126.6274 0.0223 . 1 . . . . . 110 ALA N . 27545 1
403 . 1 1 111 111 CYS H H 1 8.5396 0.0013 . 1 . . . . . 111 CYS H . 27545 1
404 . 1 1 111 111 CYS CA C 13 54.9446 0.0350 . 1 . . . . . 111 CYS CA . 27545 1
405 . 1 1 111 111 CYS CB C 13 48.6266 0.0476 . 1 . . . . . 111 CYS CB . 27545 1
406 . 1 1 111 111 CYS N N 15 117.5821 0.0503 . 1 . . . . . 111 CYS N . 27545 1
407 . 1 1 112 112 ASP H H 1 9.1928 0.0017 . 1 . . . . . 112 ASP H . 27545 1
408 . 1 1 112 112 ASP CA C 13 52.3572 0.0883 . 1 . . . . . 112 ASP CA . 27545 1
409 . 1 1 112 112 ASP CB C 13 46.0198 0.0263 . 1 . . . . . 112 ASP CB . 27545 1
410 . 1 1 112 112 ASP N N 15 121.9334 0.0370 . 1 . . . . . 112 ASP N . 27545 1
411 . 1 1 113 113 ASN H H 1 8.9949 0.0012 . 1 . . . . . 113 ASN H . 27545 1
412 . 1 1 113 113 ASN CA C 13 54.1391 0.0503 . 1 . . . . . 113 ASN CA . 27545 1
413 . 1 1 113 113 ASN CB C 13 38.8118 0.0296 . 1 . . . . . 113 ASN CB . 27545 1
414 . 1 1 113 113 ASN N N 15 118.6124 0.0357 . 1 . . . . . 113 ASN N . 27545 1
415 . 1 1 114 114 ARG H H 1 8.2429 0.0010 . 1 . . . . . 114 ARG H . 27545 1
416 . 1 1 114 114 ARG CA C 13 56.0746 0.0431 . 1 . . . . . 114 ARG CA . 27545 1
417 . 1 1 114 114 ARG CB C 13 29.4425 0.0798 . 1 . . . . . 114 ARG CB . 27545 1
418 . 1 1 114 114 ARG N N 15 118.9743 0.0564 . 1 . . . . . 114 ARG N . 27545 1
419 . 1 1 115 115 ASP H H 1 9.5900 0.0050 . 1 . . . . . 115 ASP H . 27545 1
420 . 1 1 115 115 ASP CA C 13 52.3194 . . 1 . . . . . 115 ASP CA . 27545 1
421 . 1 1 115 115 ASP CB C 13 43.9796 . . 1 . . . . . 115 ASP CB . 27545 1
422 . 1 1 115 115 ASP N N 15 125.6520 0.0264 . 1 . . . . . 115 ASP N . 27545 1
423 . 1 1 116 116 PRO CA C 13 65.6435 0.0447 . 1 . . . . . 116 PRO CA . 27545 1
424 . 1 1 116 116 PRO CB C 13 32.1291 0.0486 . 1 . . . . . 116 PRO CB . 27545 1
425 . 1 1 117 117 ARG H H 1 9.3886 0.0029 . 1 . . . . . 117 ARG H . 27545 1
426 . 1 1 117 117 ARG CA C 13 56.6159 0.0381 . 1 . . . . . 117 ARG CA . 27545 1
427 . 1 1 117 117 ARG CB C 13 30.5613 0.0535 . 1 . . . . . 117 ARG CB . 27545 1
428 . 1 1 117 117 ARG N N 15 114.0642 0.0372 . 1 . . . . . 117 ARG N . 27545 1
429 . 1 1 118 118 ASP H H 1 8.2086 0.0006 . 1 . . . . . 118 ASP H . 27545 1
430 . 1 1 118 118 ASP CA C 13 55.5668 0.0555 . 1 . . . . . 118 ASP CA . 27545 1
431 . 1 1 118 118 ASP CB C 13 43.1637 0.0362 . 1 . . . . . 118 ASP CB . 27545 1
432 . 1 1 118 118 ASP N N 15 119.7264 0.0266 . 1 . . . . . 118 ASP N . 27545 1
433 . 1 1 119 119 SER H H 1 8.4372 0.0017 . 1 . . . . . 119 SER H . 27545 1
434 . 1 1 119 119 SER CA C 13 56.3060 . . 1 . . . . . 119 SER CA . 27545 1
435 . 1 1 119 119 SER CB C 13 63.8265 . . 1 . . . . . 119 SER CB . 27545 1
436 . 1 1 119 119 SER N N 15 114.2898 0.0658 . 1 . . . . . 119 SER N . 27545 1
437 . 1 1 120 120 PRO CA C 13 63.6987 0.0236 . 1 . . . . . 120 PRO CA . 27545 1
438 . 1 1 120 120 PRO CB C 13 31.8869 0.0166 . 1 . . . . . 120 PRO CB . 27545 1
439 . 1 1 121 121 GLN H H 1 7.9300 0.0007 . 1 . . . . . 121 GLN H . 27545 1
440 . 1 1 121 121 GLN CA C 13 58.3928 0.0312 . 1 . . . . . 121 GLN CA . 27545 1
441 . 1 1 121 121 GLN CB C 13 28.8339 0.0360 . 1 . . . . . 121 GLN CB . 27545 1
442 . 1 1 121 121 GLN N N 15 116.9043 0.0805 . 1 . . . . . 121 GLN N . 27545 1
443 . 1 1 122 122 TYR H H 1 6.6938 0.0014 . 1 . . . . . 122 TYR H . 27545 1
444 . 1 1 122 122 TYR CA C 13 52.2353 . . 1 . . . . . 122 TYR CA . 27545 1
445 . 1 1 122 122 TYR CB C 13 39.0975 . . 1 . . . . . 122 TYR CB . 27545 1
446 . 1 1 122 122 TYR N N 15 114.1406 0.0681 . 1 . . . . . 122 TYR N . 27545 1
447 . 1 1 123 123 PRO CA C 13 65.0021 0.0206 . 1 . . . . . 123 PRO CA . 27545 1
448 . 1 1 123 123 PRO CB C 13 32.6847 0.0150 . 1 . . . . . 123 PRO CB . 27545 1
449 . 1 1 124 124 VAL H H 1 7.8990 0.0017 . 1 . . . . . 124 VAL H . 27545 1
450 . 1 1 124 124 VAL CA C 13 61.5904 0.0405 . 1 . . . . . 124 VAL CA . 27545 1
451 . 1 1 124 124 VAL CB C 13 34.3048 0.0134 . 1 . . . . . 124 VAL CB . 27545 1
452 . 1 1 124 124 VAL N N 15 118.6098 0.0316 . 1 . . . . . 124 VAL N . 27545 1
453 . 1 1 125 125 VAL H H 1 8.8486 0.0018 . 1 . . . . . 125 VAL H . 27545 1
454 . 1 1 125 125 VAL CA C 13 56.6468 . . 1 . . . . . 125 VAL CA . 27545 1
455 . 1 1 125 125 VAL CB C 13 34.5599 . . 1 . . . . . 125 VAL CB . 27545 1
456 . 1 1 125 125 VAL N N 15 114.5534 0.0436 . 1 . . . . . 125 VAL N . 27545 1
457 . 1 1 126 126 PRO CA C 13 61.4509 0.0017 . 1 . . . . . 126 PRO CA . 27545 1
458 . 1 1 126 126 PRO CB C 13 31.6141 0.0368 . 1 . . . . . 126 PRO CB . 27545 1
459 . 1 1 127 127 VAL H H 1 8.4111 0.0032 . 1 . . . . . 127 VAL H . 27545 1
460 . 1 1 127 127 VAL CA C 13 60.3086 0.0465 . 1 . . . . . 127 VAL CA . 27545 1
461 . 1 1 127 127 VAL CB C 13 34.9913 0.0121 . 1 . . . . . 127 VAL CB . 27545 1
462 . 1 1 127 127 VAL N N 15 105.1945 0.0791 . 1 . . . . . 127 VAL N . 27545 1
463 . 1 1 128 128 HIS H H 1 7.4507 0.0021 . 1 . . . . . 128 HIS H . 27545 1
464 . 1 1 128 128 HIS CA C 13 56.5053 0.0501 . 1 . . . . . 128 HIS CA . 27545 1
465 . 1 1 128 128 HIS CB C 13 33.3254 0.0540 . 1 . . . . . 128 HIS CB . 27545 1
466 . 1 1 128 128 HIS N N 15 118.7628 0.0369 . 1 . . . . . 128 HIS N . 27545 1
467 . 1 1 129 129 LEU H H 1 8.8235 0.0060 . 1 . . . . . 129 LEU H . 27545 1
468 . 1 1 129 129 LEU CA C 13 54.3400 0.0555 . 1 . . . . . 129 LEU CA . 27545 1
469 . 1 1 129 129 LEU CB C 13 40.9574 0.0566 . 1 . . . . . 129 LEU CB . 27545 1
470 . 1 1 129 129 LEU N N 15 130.7698 0.0509 . 1 . . . . . 129 LEU N . 27545 1
471 . 1 1 130 130 ASP H H 1 8.5620 0.0031 . 1 . . . . . 130 ASP H . 27545 1
472 . 1 1 130 130 ASP CA C 13 58.2107 0.0236 . 1 . . . . . 130 ASP CA . 27545 1
473 . 1 1 130 130 ASP CB C 13 46.1382 0.0402 . 1 . . . . . 130 ASP CB . 27545 1
474 . 1 1 130 130 ASP N N 15 129.4088 0.0291 . 1 . . . . . 130 ASP N . 27545 1
475 . 1 1 131 131 THR H H 1 7.5380 0.0013 . 1 . . . . . 131 THR H . 27545 1
476 . 1 1 131 131 THR CA C 13 62.1472 0.0139 . 1 . . . . . 131 THR CA . 27545 1
477 . 1 1 131 131 THR CB C 13 72.6289 0.0580 . 1 . . . . . 131 THR CB . 27545 1
478 . 1 1 131 131 THR N N 15 108.8313 0.0555 . 1 . . . . . 131 THR N . 27545 1
479 . 1 1 132 132 ILE H H 1 8.1465 0.0013 . 1 . . . . . 132 ILE H . 27545 1
480 . 1 1 132 132 ILE CA C 13 59.8998 0.0183 . 1 . . . . . 132 ILE CA . 27545 1
481 . 1 1 132 132 ILE CB C 13 38.8966 0.0242 . 1 . . . . . 132 ILE CB . 27545 1
482 . 1 1 132 132 ILE N N 15 123.0358 0.0447 . 1 . . . . . 132 ILE N . 27545 1
483 . 1 1 133 133 ILE H H 1 8.2696 0.0017 . 1 . . . . . 133 ILE H . 27545 1
484 . 1 1 133 133 ILE CA C 13 63.3957 . . 1 . . . . . 133 ILE CA . 27545 1
485 . 1 1 133 133 ILE CB C 13 41.2607 . . 1 . . . . . 133 ILE CB . 27545 1
486 . 1 1 133 133 ILE N N 15 130.3051 0.0254 . 1 . . . . . 133 ILE N . 27545 1
stop_
save_