Content for NMR-STAR saveframe, "assigned_chem_shift_list"
save_assigned_chem_shift_list
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list
_Assigned_chem_shift_list.Entry_ID 18225
_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-13C HSQC/HMQC' . . isotropic 18225 1
2 '2D 1H-15N HSQC/HMQC' . . isotropic 18225 1
2 '2D 1H-15N HSQC/HMQC' . . isotropic 18225 1
3 '3D HNCA' . . isotropic 18225 1
4 '3D HNCACB' . . isotropic 18225 1
5 '3D HNCO' . . isotropic 18225 1
6 '3D HN(CO)CA' . . isotropic 18225 1
7 '3D 1H-15N NOESY' . . isotropic 18225 1
7 '3D 1H-15N NOESY' . . isotropic 18225 1
8 '3D HCCH-TOCSY' . . isotropic 18225 1
11 '13Cfilt_NOESY (H[{N|C}]_H.NOESY)' . . isotropic 18225 1
15 '3D 1H-13C NOESY' . . isotropic 18225 1
16 '13CHSQC_arom*800 (H[C[caro]])' . . isotropic 18225 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 1 1 MET HA H 1 4.150 0.02 . 1 . . 338 . A 1 MET HA . 18225 1
2 . 1 1 1 1 MET HB2 H 1 2.178 0.02 . 1 . . 337 . A 1 MET HB2 . 18225 1
3 . 1 1 1 1 MET HG3 H 1 2.599 0.02 . 1 . . 340 . A 1 MET HG3 . 18225 1
4 . 1 1 1 1 MET HE1 H 1 2.004 0.02 . 1 . . 614 . A 1 MET HE1 . 18225 1
5 . 1 1 1 1 MET HE2 H 1 2.004 0.02 . 1 . . 614 . A 1 MET HE2 . 18225 1
6 . 1 1 1 1 MET HE3 H 1 2.004 0.02 . 1 . . 614 . A 1 MET HE3 . 18225 1
7 . 1 1 1 1 MET C C 13 172.134 0.2 . 1 . . 189 . A 1 MET C . 18225 1
8 . 1 1 1 1 MET CA C 13 55.221 0.2 . 1 . . 224 . A 1 MET CA . 18225 1
9 . 1 1 1 1 MET CB C 13 33.034 0.2 . 1 . . 255 . A 1 MET CB . 18225 1
10 . 1 1 1 1 MET CG C 13 30.981 0.2 . 1 . . 339 . A 1 MET CG . 18225 1
11 . 1 1 1 1 MET CE C 13 17.203 0.2 . 1 . . 615 . A 1 MET CE . 18225 1
12 . 1 1 2 2 GLU H H 1 8.824 0.02 . 1 . . 84 . A 2 GLU H . 18225 1
13 . 1 1 2 2 GLU HA H 1 4.409 0.02 . 1 . . 345 . A 2 GLU HA . 18225 1
14 . 1 1 2 2 GLU HB2 H 1 2.127 0.02 . 2 . . 344 . A 2 GLU HB2 . 18225 1
15 . 1 1 2 2 GLU HB3 H 1 1.976 0.02 . 2 . . 342 . A 2 GLU HB3 . 18225 1
16 . 1 1 2 2 GLU HG3 H 1 2.381 0.02 . 1 . . 341 . A 2 GLU HG3 . 18225 1
17 . 1 1 2 2 GLU C C 13 175.510 0.2 . 1 . . 196 . A 2 GLU C . 18225 1
18 . 1 1 2 2 GLU CA C 13 56.216 0.2 . 1 . . 347 . A 2 GLU CA . 18225 1
19 . 1 1 2 2 GLU CB C 13 29.538 0.2 . 1 . . 343 . A 2 GLU CB . 18225 1
20 . 1 1 2 2 GLU CG C 13 34.001 0.2 . 1 . . 346 . A 2 GLU CG . 18225 1
21 . 1 1 2 2 GLU N N 15 123.432 0.3 . 1 . . 85 . A 2 GLU N . 18225 1
22 . 1 1 3 3 GLU H H 1 8.546 0.02 . 1 . . 104 . A 3 GLU H . 18225 1
23 . 1 1 3 3 GLU HA H 1 4.378 0.02 . 1 . . 422 . A 3 GLU HA . 18225 1
24 . 1 1 3 3 GLU HB2 H 1 2.107 0.02 . 2 . . 424 . A 3 GLU HB2 . 18225 1
25 . 1 1 3 3 GLU HB3 H 1 1.975 0.02 . 2 . . 423 . A 3 GLU HB3 . 18225 1
26 . 1 1 3 3 GLU HG3 H 1 2.379 0.02 . 1 . . 425 . A 3 GLU HG3 . 18225 1
27 . 1 1 3 3 GLU C C 13 176.299 0.2 . 1 . . 174 . A 3 GLU C . 18225 1
28 . 1 1 3 3 GLU CA C 13 56.292 0.2 . 1 . . 217 . A 3 GLU CA . 18225 1
29 . 1 1 3 3 GLU CB C 13 29.452 0.2 . 1 . . 268 . A 3 GLU CB . 18225 1
30 . 1 1 3 3 GLU CG C 13 33.916 0.2 . 1 . . 426 . A 3 GLU CG . 18225 1
31 . 1 1 3 3 GLU N N 15 121.813 0.3 . 1 . . 105 . A 3 GLU N . 18225 1
32 . 1 1 4 4 GLY H H 1 8.463 0.02 . 1 . . 50 . A 4 GLY H . 18225 1
33 . 1 1 4 4 GLY HA2 H 1 3.948 0.02 . 2 . . 657 . A 4 GLY HA2 . 18225 1
34 . 1 1 4 4 GLY HA3 H 1 3.991 0.02 . 2 . . 427 . A 4 GLY HA3 . 18225 1
35 . 1 1 4 4 GLY C C 13 174.449 0.2 . 1 . . 159 . A 4 GLY C . 18225 1
36 . 1 1 4 4 GLY CA C 13 45.530 0.2 . 1 . . 207 . A 4 GLY CA . 18225 1
37 . 1 1 4 4 GLY N N 15 109.619 0.3 . 1 . . 51 . A 4 GLY N . 18225 1
38 . 1 1 5 5 GLY H H 1 8.220 0.02 . 1 . . 7 . A 5 GLY H . 18225 1
39 . 1 1 5 5 GLY HA2 H 1 3.937 0.02 . 1 . . 267 . A 5 GLY HA2 . 18225 1
40 . 1 1 5 5 GLY C C 13 173.965 0.2 . 1 . . 200 . A 5 GLY C . 18225 1
41 . 1 1 5 5 GLY CA C 13 45.452 0.2 . 1 . . 231 . A 5 GLY CA . 18225 1
42 . 1 1 5 5 GLY N N 15 108.241 0.3 . 1 . . 8 . A 5 GLY N . 18225 1
43 . 1 1 6 6 ASP H H 1 8.329 0.02 . 1 . . 114 . A 6 ASP H . 18225 1
44 . 1 1 6 6 ASP HA H 1 4.598 0.02 . 1 . . 270 . A 6 ASP HA . 18225 1
45 . 1 1 6 6 ASP HB3 H 1 2.668 0.02 . 1 . . 269 . A 6 ASP HB3 . 18225 1
46 . 1 1 6 6 ASP C C 13 175.801 0.2 . 1 . . 183 . A 6 ASP C . 18225 1
47 . 1 1 6 6 ASP CA C 13 53.912 0.2 . 1 . . 271 . A 6 ASP CA . 18225 1
48 . 1 1 6 6 ASP CB C 13 39.335 0.2 . 1 . . 263 . A 6 ASP CB . 18225 1
49 . 1 1 6 6 ASP N N 15 119.184 0.3 . 1 . . 115 . A 6 ASP N . 18225 1
50 . 1 1 7 7 PHE H H 1 8.342 0.02 . 1 . . 72 . A 7 PHE H . 18225 1
51 . 1 1 7 7 PHE HA H 1 4.480 0.02 . 1 . . 431 . A 7 PHE HA . 18225 1
52 . 1 1 7 7 PHE HB2 H 1 3.061 0.02 . 2 . . 429 . A 7 PHE HB2 . 18225 1
53 . 1 1 7 7 PHE HB3 H 1 3.190 0.02 . 2 . . 430 . A 7 PHE HB3 . 18225 1
54 . 1 1 7 7 PHE HD1 H 1 7.221 0.02 . 3 . . 428 . A 7 PHE HD1 . 18225 1
55 . 1 1 7 7 PHE HD2 H 1 7.221 0.02 . 3 . . 428 . A 7 PHE HD2 . 18225 1
56 . 1 1 7 7 PHE C C 13 175.881 0.2 . 1 . . 242 . A 7 PHE C . 18225 1
57 . 1 1 7 7 PHE CA C 13 58.821 0.2 . 1 . . 244 . A 7 PHE CA . 18225 1
58 . 1 1 7 7 PHE CB C 13 39.082 0.2 . 1 . . 285 . A 7 PHE CB . 18225 1
59 . 1 1 7 7 PHE CD1 C 13 131.680 0.2 . 3 . . 658 . A 7 PHE CD1 . 18225 1
60 . 1 1 7 7 PHE CD2 C 13 131.680 0.2 . 3 . . 658 . A 7 PHE CD2 . 18225 1
61 . 1 1 7 7 PHE N N 15 119.589 0.3 . 1 . . 73 . A 7 PHE N . 18225 1
62 . 1 1 8 8 ASP H H 1 8.223 0.02 . 1 . . 240 . A 8 ASP H . 18225 1
63 . 1 1 8 8 ASP HA H 1 4.456 0.02 . 1 . . 492 . A 8 ASP HA . 18225 1
64 . 1 1 8 8 ASP HB3 H 1 2.744 0.02 . 1 . . 284 . A 8 ASP HB3 . 18225 1
65 . 1 1 8 8 ASP C C 13 175.642 0.2 . 1 . . 281 . A 8 ASP C . 18225 1
66 . 1 1 8 8 ASP CA C 13 54.603 0.2 . 1 . . 154 . A 8 ASP CA . 18225 1
67 . 1 1 8 8 ASP CB C 13 38.584 0.2 . 1 . . 283 . A 8 ASP CB . 18225 1
68 . 1 1 8 8 ASP N N 15 118.430 0.3 . 1 . . 241 . A 8 ASP N . 18225 1
69 . 1 1 9 9 ASN H H 1 8.069 0.02 . 1 . . 122 . A 9 ASN H . 18225 1
70 . 1 1 9 9 ASN HA H 1 4.559 0.02 . 1 . . 432 . A 9 ASN HA . 18225 1
71 . 1 1 9 9 ASN HB2 H 1 2.625 0.02 . 2 . . 433 . A 9 ASN HB2 . 18225 1
72 . 1 1 9 9 ASN HB3 H 1 2.656 0.02 . 2 . . 282 . A 9 ASN HB3 . 18225 1
73 . 1 1 9 9 ASN HD21 H 1 6.786 0.02 . 1 . . 435 . A 9 ASN HD21 . 18225 1
74 . 1 1 9 9 ASN HD22 H 1 7.450 0.02 . 1 . . 434 . A 9 ASN HD22 . 18225 1
75 . 1 1 9 9 ASN C C 13 175.264 0.2 . 1 . . 157 . A 9 ASN C . 18225 1
76 . 1 1 9 9 ASN CA C 13 53.844 0.2 . 1 . . 230 . A 9 ASN CA . 18225 1
77 . 1 1 9 9 ASN CB C 13 38.715 0.2 . 1 . . 251 . A 9 ASN CB . 18225 1
78 . 1 1 9 9 ASN N N 15 117.097 0.3 . 1 . . 123 . A 9 ASN N . 18225 1
79 . 1 1 9 9 ASN ND2 N 15 112.014 0.3 . 1 . . 648 . A 9 ASN ND2 . 18225 1
80 . 1 1 10 10 TYR H H 1 7.901 0.02 . 1 . . 3 . A 10 TYR H . 18225 1
81 . 1 1 10 10 TYR HA H 1 4.349 0.02 . 1 . . 279 . A 10 TYR HA . 18225 1
82 . 1 1 10 10 TYR HB2 H 1 2.897 0.02 . 1 . . 280 . A 10 TYR HB2 . 18225 1
83 . 1 1 10 10 TYR HD1 H 1 6.931 0.02 . 3 . . 278 . A 10 TYR HD1 . 18225 1
84 . 1 1 10 10 TYR HD2 H 1 6.931 0.02 . 3 . . 278 . A 10 TYR HD2 . 18225 1
85 . 1 1 10 10 TYR HE1 H 1 6.764 0.02 . 3 . . 634 . A 10 TYR HE1 . 18225 1
86 . 1 1 10 10 TYR HE2 H 1 6.764 0.02 . 3 . . 634 . A 10 TYR HE2 . 18225 1
87 . 1 1 10 10 TYR C C 13 175.387 0.2 . 1 . . 194 . A 10 TYR C . 18225 1
88 . 1 1 10 10 TYR CA C 13 59.194 0.2 . 1 . . 226 . A 10 TYR CA . 18225 1
89 . 1 1 10 10 TYR CB C 13 38.828 0.2 . 1 . . 249 . A 10 TYR CB . 18225 1
90 . 1 1 10 10 TYR CD1 C 13 133.065 0.2 . 3 . . 633 . A 10 TYR CD1 . 18225 1
91 . 1 1 10 10 TYR CD2 C 13 133.065 0.2 . 3 . . 633 . A 10 TYR CD2 . 18225 1
92 . 1 1 10 10 TYR CE1 C 13 118.131 0.2 . 3 . . 635 . A 10 TYR CE1 . 18225 1
93 . 1 1 10 10 TYR CE2 C 13 118.131 0.2 . 3 . . 635 . A 10 TYR CE2 . 18225 1
94 . 1 1 10 10 TYR N N 15 119.007 0.3 . 1 . . 4 . A 10 TYR N . 18225 1
95 . 1 1 11 11 TYR H H 1 7.885 0.02 . 1 . . 96 . A 11 TYR H . 18225 1
96 . 1 1 11 11 TYR HA H 1 4.443 0.02 . 1 . . 275 . A 11 TYR HA . 18225 1
97 . 1 1 11 11 TYR HB2 H 1 3.031 0.02 . 2 . . 534 . A 11 TYR HB2 . 18225 1
98 . 1 1 11 11 TYR HB3 H 1 2.855 0.02 . 2 . . 276 . A 11 TYR HB3 . 18225 1
99 . 1 1 11 11 TYR HD1 H 1 7.033 0.02 . 3 . . 277 . A 11 TYR HD1 . 18225 1
100 . 1 1 11 11 TYR HD2 H 1 7.033 0.02 . 3 . . 277 . A 11 TYR HD2 . 18225 1
101 . 1 1 11 11 TYR HE1 H 1 6.787 0.02 . 3 . . 637 . A 11 TYR HE1 . 18225 1
102 . 1 1 11 11 TYR HE2 H 1 6.787 0.02 . 3 . . 637 . A 11 TYR HE2 . 18225 1
103 . 1 1 11 11 TYR C C 13 175.765 0.2 . 1 . . 188 . A 11 TYR C . 18225 1
104 . 1 1 11 11 TYR CA C 13 58.372 0.2 . 1 . . 147 . A 11 TYR CA . 18225 1
105 . 1 1 11 11 TYR CB C 13 38.794 0.2 . 1 . . 250 . A 11 TYR CB . 18225 1
106 . 1 1 11 11 TYR CD1 C 13 133.112 0.2 . 3 . . 636 . A 11 TYR CD1 . 18225 1
107 . 1 1 11 11 TYR CD2 C 13 133.112 0.2 . 3 . . 636 . A 11 TYR CD2 . 18225 1
108 . 1 1 11 11 TYR CE1 C 13 118.095 0.2 . 3 . . 638 . A 11 TYR CE1 . 18225 1
109 . 1 1 11 11 TYR CE2 C 13 118.095 0.2 . 3 . . 638 . A 11 TYR CE2 . 18225 1
110 . 1 1 11 11 TYR N N 15 117.992 0.3 . 1 . . 97 . A 11 TYR N . 18225 1
111 . 1 1 12 12 GLY H H 1 7.861 0.02 . 1 . . 82 . A 12 GLY H . 18225 1
112 . 1 1 12 12 GLY HA2 H 1 3.898 0.02 . 2 . . 659 . A 12 GLY HA2 . 18225 1
113 . 1 1 12 12 GLY HA3 H 1 3.860 0.02 . 2 . . 272 . A 12 GLY HA3 . 18225 1
114 . 1 1 12 12 GLY C C 13 173.934 0.2 . 1 . . 163 . A 12 GLY C . 18225 1
115 . 1 1 12 12 GLY CA C 13 45.489 0.2 . 1 . . 211 . A 12 GLY CA . 18225 1
116 . 1 1 12 12 GLY N N 15 108.601 0.3 . 1 . . 83 . A 12 GLY N . 18225 1
117 . 1 1 13 13 ALA H H 1 7.985 0.02 . 1 . . 21 . A 13 ALA H . 18225 1
118 . 1 1 13 13 ALA HA H 1 4.279 0.02 . 1 . . 273 . A 13 ALA HA . 18225 1
119 . 1 1 13 13 ALA HB1 H 1 1.368 0.02 . 1 . . 274 . A 13 ALA HB1 . 18225 1
120 . 1 1 13 13 ALA HB2 H 1 1.368 0.02 . 1 . . 274 . A 13 ALA HB2 . 18225 1
121 . 1 1 13 13 ALA HB3 H 1 1.368 0.02 . 1 . . 274 . A 13 ALA HB3 . 18225 1
122 . 1 1 13 13 ALA C C 13 177.457 0.2 . 1 . . 199 . A 13 ALA C . 18225 1
123 . 1 1 13 13 ALA CA C 13 52.782 0.2 . 1 . . 228 . A 13 ALA CA . 18225 1
124 . 1 1 13 13 ALA CB C 13 19.447 0.2 . 1 . . 260 . A 13 ALA CB . 18225 1
125 . 1 1 13 13 ALA N N 15 122.926 0.3 . 1 . . 22 . A 13 ALA N . 18225 1
126 . 1 1 14 14 ASP H H 1 8.330 0.02 . 1 . . 112 . A 14 ASP H . 18225 1
127 . 1 1 14 14 ASP HA H 1 4.640 0.02 . 1 . . 539 . A 14 ASP HA . 18225 1
128 . 1 1 14 14 ASP HB2 H 1 2.820 0.02 . 2 . . 537 . A 14 ASP HB2 . 18225 1
129 . 1 1 14 14 ASP HB3 H 1 2.713 0.02 . 2 . . 538 . A 14 ASP HB3 . 18225 1
130 . 1 1 14 14 ASP C C 13 175.428 0.2 . 1 . . 182 . A 14 ASP C . 18225 1
131 . 1 1 14 14 ASP CA C 13 53.672 0.2 . 1 . . 151 . A 14 ASP CA . 18225 1
132 . 1 1 14 14 ASP CB C 13 39.365 0.2 . 1 . . 254 . A 14 ASP CB . 18225 1
133 . 1 1 14 14 ASP N N 15 117.380 0.3 . 1 . . 113 . A 14 ASP N . 18225 1
134 . 1 1 15 15 ASN H H 1 8.207 0.02 . 1 . . 70 . A 15 ASN H . 18225 1
135 . 1 1 15 15 ASN HA H 1 4.639 0.02 . 1 . . 438 . A 15 ASN HA . 18225 1
136 . 1 1 15 15 ASN HB2 H 1 2.766 0.02 . 2 . . 437 . A 15 ASN HB2 . 18225 1
137 . 1 1 15 15 ASN HB3 H 1 2.816 0.02 . 2 . . 436 . A 15 ASN HB3 . 18225 1
138 . 1 1 15 15 ASN HD21 H 1 6.820 0.02 . 1 . . 58 . A 15 ASN HD21 . 18225 1
139 . 1 1 15 15 ASN HD22 H 1 7.515 0.02 . 1 . . 11 . A 15 ASN HD22 . 18225 1
140 . 1 1 15 15 ASN C C 13 175.467 0.2 . 1 . . 176 . A 15 ASN C . 18225 1
141 . 1 1 15 15 ASN CA C 13 53.657 0.2 . 1 . . 141 . A 15 ASN CA . 18225 1
142 . 1 1 15 15 ASN CB C 13 38.968 0.2 . 1 . . 252 . A 15 ASN CB . 18225 1
143 . 1 1 15 15 ASN N N 15 118.465 0.3 . 1 . . 71 . A 15 ASN N . 18225 1
144 . 1 1 15 15 ASN ND2 N 15 112.353 0.3 . 1 . . 12 . A 15 ASN ND2 . 18225 1
145 . 1 1 16 16 GLN H H 1 8.292 0.02 . 1 . . 54 . A 16 GLN H . 18225 1
146 . 1 1 16 16 GLN HA H 1 4.315 0.02 . 1 . . 448 . A 16 GLN HA . 18225 1
147 . 1 1 16 16 GLN HB2 H 1 2.010 0.02 . 2 . . 447 . A 16 GLN HB2 . 18225 1
148 . 1 1 16 16 GLN HB3 H 1 2.154 0.02 . 2 . . 445 . A 16 GLN HB3 . 18225 1
149 . 1 1 16 16 GLN HG3 H 1 2.348 0.02 . 1 . . 449 . A 16 GLN HG3 . 18225 1
150 . 1 1 16 16 GLN HE21 H 1 6.778 0.02 . 1 . . 451 . A 16 GLN HE21 . 18225 1
151 . 1 1 16 16 GLN HE22 H 1 7.460 0.02 . 1 . . 452 . A 16 GLN HE22 . 18225 1
152 . 1 1 16 16 GLN C C 13 176.350 0.2 . 1 . . 286 . A 16 GLN C . 18225 1
153 . 1 1 16 16 GLN CA C 13 56.640 0.2 . 1 . . 209 . A 16 GLN CA . 18225 1
154 . 1 1 16 16 GLN CB C 13 29.096 0.2 . 1 . . 446 . A 16 GLN CB . 18225 1
155 . 1 1 16 16 GLN CG C 13 33.872 0.2 . 1 . . 450 . A 16 GLN CG . 18225 1
156 . 1 1 16 16 GLN N N 15 119.741 0.3 . 1 . . 55 . A 16 GLN N . 18225 1
157 . 1 1 16 16 GLN NE2 N 15 111.576 0.3 . 1 . . 37 . A 16 GLN NE2 . 18225 1
158 . 1 1 17 17 SER H H 1 8.224 0.02 . 1 . . 15 . A 17 SER H . 18225 1
159 . 1 1 17 17 SER HA H 1 4.390 0.02 . 1 . . 498 . A 17 SER HA . 18225 1
160 . 1 1 17 17 SER HB3 H 1 3.873 0.02 . 1 . . 287 . A 17 SER HB3 . 18225 1
161 . 1 1 17 17 SER C C 13 174.799 0.2 . 1 . . 202 . A 17 SER C . 18225 1
162 . 1 1 17 17 SER CA C 13 59.165 0.2 . 1 . . 229 . A 17 SER CA . 18225 1
163 . 1 1 17 17 SER CB C 13 63.651 0.2 . 1 . . 248 . A 17 SER CB . 18225 1
164 . 1 1 17 17 SER N N 15 115.772 0.3 . 1 . . 16 . A 17 SER N . 18225 1
165 . 1 1 18 18 GLU H H 1 8.285 0.02 . 1 . . 118 . A 18 GLU H . 18225 1
166 . 1 1 18 18 GLU HA H 1 4.318 0.02 . 1 . . 493 . A 18 GLU HA . 18225 1
167 . 1 1 18 18 GLU HB2 H 1 2.018 0.02 . 2 . . 496 . A 18 GLU HB2 . 18225 1
168 . 1 1 18 18 GLU HB3 H 1 2.131 0.02 . 2 . . 495 . A 18 GLU HB3 . 18225 1
169 . 1 1 18 18 GLU HG3 H 1 2.417 0.02 . 1 . . 494 . A 18 GLU HG3 . 18225 1
170 . 1 1 18 18 GLU C C 13 176.201 0.2 . 1 . . 243 . A 18 GLU C . 18225 1
171 . 1 1 18 18 GLU CA C 13 56.725 0.2 . 1 . . 153 . A 18 GLU CA . 18225 1
172 . 1 1 18 18 GLU CB C 13 28.965 0.2 . 1 . . 262 . A 18 GLU CB . 18225 1
173 . 1 1 18 18 GLU CG C 13 33.603 0.2 . 1 . . 497 . A 18 GLU CG . 18225 1
174 . 1 1 18 18 GLU N N 15 121.211 0.3 . 1 . . 119 . A 18 GLU N . 18225 1
175 . 1 1 19 19 CYS H H 1 8.202 0.02 . 1 . . 288 . A 19 CYS H . 18225 1
176 . 1 1 19 19 CYS HA H 1 4.423 0.02 . 1 . . 491 . A 19 CYS HA . 18225 1
177 . 1 1 19 19 CYS HB2 H 1 2.890 0.02 . 1 . . 290 . A 19 CYS HB2 . 18225 1
178 . 1 1 19 19 CYS C C 13 174.698 0.2 . 1 . . 201 . A 19 CYS C . 18225 1
179 . 1 1 19 19 CYS CA C 13 59.075 0.2 . 1 . . 140 . A 19 CYS CA . 18225 1
180 . 1 1 19 19 CYS CB C 13 27.850 0.2 . 1 . . 256 . A 19 CYS CB . 18225 1
181 . 1 1 19 19 CYS N N 15 118.653 0.3 . 1 . . 289 . A 19 CYS N . 18225 1
182 . 1 1 20 20 GLU H H 1 8.349 0.02 . 1 . . 116 . A 20 GLU H . 18225 1
183 . 1 1 20 20 GLU HA H 1 4.265 0.02 . 1 . . 500 . A 20 GLU HA . 18225 1
184 . 1 1 20 20 GLU HB2 H 1 1.945 0.02 . 1 . . 499 . A 20 GLU HB2 . 18225 1
185 . 1 1 20 20 GLU HG3 H 1 2.299 0.02 . 1 . . 501 . A 20 GLU HG3 . 18225 1
186 . 1 1 20 20 GLU C C 13 176.100 0.2 . 1 . . 175 . A 20 GLU C . 18225 1
187 . 1 1 20 20 GLU CA C 13 56.822 0.2 . 1 . . 152 . A 20 GLU CA . 18225 1
188 . 1 1 20 20 GLU CB C 13 28.976 0.2 . 1 . . 291 . A 20 GLU CB . 18225 1
189 . 1 1 20 20 GLU CG C 13 33.396 0.2 . 1 . . 502 . A 20 GLU CG . 18225 1
190 . 1 1 20 20 GLU N N 15 121.851 0.3 . 1 . . 117 . A 20 GLU N . 18225 1
191 . 1 1 21 21 TYR H H 1 7.974 0.02 . 1 . . 52 . A 21 TYR H . 18225 1
192 . 1 1 21 21 TYR HA H 1 4.418 0.02 . 1 . . 505 . A 21 TYR HA . 18225 1
193 . 1 1 21 21 TYR HB2 H 1 2.871 0.02 . 2 . . 506 . A 21 TYR HB2 . 18225 1
194 . 1 1 21 21 TYR HB3 H 1 3.034 0.02 . 2 . . 504 . A 21 TYR HB3 . 18225 1
195 . 1 1 21 21 TYR HD1 H 1 7.002 0.02 . 3 . . 503 . A 21 TYR HD1 . 18225 1
196 . 1 1 21 21 TYR HD2 H 1 7.002 0.02 . 3 . . 503 . A 21 TYR HD2 . 18225 1
197 . 1 1 21 21 TYR HE1 H 1 6.761 0.02 . 3 . . 507 . A 21 TYR HE1 . 18225 1
198 . 1 1 21 21 TYR HE2 H 1 6.761 0.02 . 3 . . 507 . A 21 TYR HE2 . 18225 1
199 . 1 1 21 21 TYR C C 13 175.881 0.2 . 1 . . 169 . A 21 TYR C . 18225 1
200 . 1 1 21 21 TYR CA C 13 58.731 0.2 . 1 . . 292 . A 21 TYR CA . 18225 1
201 . 1 1 21 21 TYR CB C 13 38.626 0.2 . 1 . . 293 . A 21 TYR CB . 18225 1
202 . 1 1 21 21 TYR CD1 C 13 133.328 0.2 . 3 . . 660 . A 21 TYR CD1 . 18225 1
203 . 1 1 21 21 TYR CD2 C 13 133.328 0.2 . 3 . . 660 . A 21 TYR CD2 . 18225 1
204 . 1 1 21 21 TYR CE1 C 13 118.126 0.2 . 3 . . 661 . A 21 TYR CE1 . 18225 1
205 . 1 1 21 21 TYR CE2 C 13 118.126 0.2 . 3 . . 661 . A 21 TYR CE2 . 18225 1
206 . 1 1 21 21 TYR N N 15 118.491 0.3 . 1 . . 53 . A 21 TYR N . 18225 1
207 . 1 1 22 22 THR H H 1 7.747 0.02 . 1 . . 33 . A 22 THR H . 18225 1
208 . 1 1 22 22 THR HA H 1 4.105 0.02 . 1 . . 662 . A 22 THR HA . 18225 1
209 . 1 1 22 22 THR HB H 1 4.158 0.02 . 1 . . 470 . A 22 THR HB . 18225 1
210 . 1 1 22 22 THR HG21 H 1 1.094 0.02 . 1 . . 471 . A 22 THR HG21 . 18225 1
211 . 1 1 22 22 THR HG22 H 1 1.094 0.02 . 1 . . 471 . A 22 THR HG22 . 18225 1
212 . 1 1 22 22 THR HG23 H 1 1.094 0.02 . 1 . . 471 . A 22 THR HG23 . 18225 1
213 . 1 1 22 22 THR C C 13 174.666 0.2 . 1 . . 168 . A 22 THR C . 18225 1
214 . 1 1 22 22 THR CA C 13 63.190 0.2 . 1 . . 134 . A 22 THR CA . 18225 1
215 . 1 1 22 22 THR CB C 13 69.306 0.2 . 1 . . 245 . A 22 THR CB . 18225 1
216 . 1 1 22 22 THR CG2 C 13 21.824 0.2 . 1 . . 472 . A 22 THR CG2 . 18225 1
217 . 1 1 22 22 THR N N 15 112.161 0.3 . 1 . . 34 . A 22 THR N . 18225 1
218 . 1 1 23 23 ASP H H 1 8.114 0.02 . 1 . . 31 . A 23 ASP H . 18225 1
219 . 1 1 23 23 ASP HA H 1 4.654 0.02 . 1 . . 508 . A 23 ASP HA . 18225 1
220 . 1 1 23 23 ASP HB3 H 1 2.800 0.02 . 1 . . 509 . A 23 ASP HB3 . 18225 1
221 . 1 1 23 23 ASP C C 13 176.119 0.2 . 1 . . 204 . A 23 ASP C . 18225 1
222 . 1 1 23 23 ASP CA C 13 53.903 0.2 . 1 . . 133 . A 23 ASP CA . 18225 1
223 . 1 1 23 23 ASP CB C 13 39.138 0.2 . 1 . . 253 . A 23 ASP CB . 18225 1
224 . 1 1 23 23 ASP N N 15 120.529 0.3 . 1 . . 32 . A 23 ASP N . 18225 1
225 . 1 1 24 24 TRP H H 1 8.034 0.02 . 1 . . 124 . A 24 TRP H . 18225 1
226 . 1 1 24 24 TRP HA H 1 4.476 0.02 . 1 . . 454 . A 24 TRP HA . 18225 1
227 . 1 1 24 24 TRP HB3 H 1 3.302 0.02 . 1 . . 294 . A 24 TRP HB3 . 18225 1
228 . 1 1 24 24 TRP HD1 H 1 7.324 0.02 . 1 . . 453 . A 24 TRP HD1 . 18225 1
229 . 1 1 24 24 TRP HE1 H 1 10.375 0.02 . 1 . . 61 . A 24 TRP HE1 . 18225 1
230 . 1 1 24 24 TRP HE3 H 1 7.494 0.02 . 1 . . 455 . A 24 TRP HE3 . 18225 1
231 . 1 1 24 24 TRP HZ2 H 1 7.428 0.02 . 1 . . 643 . A 24 TRP HZ2 . 18225 1
232 . 1 1 24 24 TRP HZ3 H 1 6.937 0.02 . 1 . . 639 . A 24 TRP HZ3 . 18225 1
233 . 1 1 24 24 TRP HH2 H 1 7.041 0.02 . 1 . . 641 . A 24 TRP HH2 . 18225 1
234 . 1 1 24 24 TRP C C 13 176.578 0.2 . 1 . . 172 . A 24 TRP C . 18225 1
235 . 1 1 24 24 TRP CA C 13 58.311 0.2 . 1 . . 155 . A 24 TRP CA . 18225 1
236 . 1 1 24 24 TRP CB C 13 29.186 0.2 . 1 . . 295 . A 24 TRP CB . 18225 1
237 . 1 1 24 24 TRP CD1 C 13 126.822 0.2 . 1 . . 655 . A 24 TRP CD1 . 18225 1
238 . 1 1 24 24 TRP CE3 C 13 121.043 0.2 . 1 . . 649 . A 24 TRP CE3 . 18225 1
239 . 1 1 24 24 TRP CZ2 C 13 114.391 0.2 . 1 . . 644 . A 24 TRP CZ2 . 18225 1
240 . 1 1 24 24 TRP CZ3 C 13 121.096 0.2 . 1 . . 640 . A 24 TRP CZ3 . 18225 1
241 . 1 1 24 24 TRP CH2 C 13 123.773 0.2 . 1 . . 642 . A 24 TRP CH2 . 18225 1
242 . 1 1 24 24 TRP N N 15 121.466 0.3 . 1 . . 125 . A 24 TRP N . 18225 1
243 . 1 1 24 24 TRP NE1 N 15 129.692 0.3 . 1 . . 62 . A 24 TRP NE1 . 18225 1
244 . 1 1 25 25 LYS H H 1 7.880 0.02 . 1 . . 42 . A 25 LYS H . 18225 1
245 . 1 1 25 25 LYS HA H 1 4.045 0.02 . 1 . . 514 . A 25 LYS HA . 18225 1
246 . 1 1 25 25 LYS HB2 H 1 1.634 0.02 . 2 . . 512 . A 25 LYS HB2 . 18225 1
247 . 1 1 25 25 LYS HB3 H 1 1.681 0.02 . 2 . . 510 . A 25 LYS HB3 . 18225 1
248 . 1 1 25 25 LYS HG3 H 1 1.092 0.02 . 1 . . 511 . A 25 LYS HG3 . 18225 1
249 . 1 1 25 25 LYS HD3 H 1 1.587 0.02 . 1 . . 517 . A 25 LYS HD3 . 18225 1
250 . 1 1 25 25 LYS HE3 H 1 2.900 0.02 . 1 . . 513 . A 25 LYS HE3 . 18225 1
251 . 1 1 25 25 LYS C C 13 176.798 0.2 . 1 . . 158 . A 25 LYS C . 18225 1
252 . 1 1 25 25 LYS CA C 13 57.761 0.2 . 1 . . 135 . A 25 LYS CA . 18225 1
253 . 1 1 25 25 LYS CB C 13 32.409 0.2 . 1 . . 296 . A 25 LYS CB . 18225 1
254 . 1 1 25 25 LYS CG C 13 24.936 0.2 . 1 . . 515 . A 25 LYS CG . 18225 1
255 . 1 1 25 25 LYS CD C 13 29.334 0.2 . 1 . . 516 . A 25 LYS CD . 18225 1
256 . 1 1 25 25 LYS CE C 13 42.010 0.2 . 1 . . 518 . A 25 LYS CE . 18225 1
257 . 1 1 25 25 LYS N N 15 119.430 0.3 . 1 . . 43 . A 25 LYS N . 18225 1
258 . 1 1 26 26 SER H H 1 7.893 0.02 . 1 . . 5 . A 26 SER H . 18225 1
259 . 1 1 26 26 SER HA H 1 4.461 0.02 . 1 . . 520 . A 26 SER HA . 18225 1
260 . 1 1 26 26 SER HB2 H 1 3.887 0.02 . 2 . . 663 . A 26 SER HB2 . 18225 1
261 . 1 1 26 26 SER HB3 H 1 3.920 0.02 . 2 . . 519 . A 26 SER HB3 . 18225 1
262 . 1 1 26 26 SER C C 13 174.957 0.2 . 1 . . 170 . A 26 SER C . 18225 1
263 . 1 1 26 26 SER CA C 13 58.760 0.2 . 1 . . 215 . A 26 SER CA . 18225 1
264 . 1 1 26 26 SER CB C 13 63.889 0.2 . 1 . . 246 . A 26 SER CB . 18225 1
265 . 1 1 26 26 SER N N 15 113.780 0.3 . 1 . . 6 . A 26 SER N . 18225 1
266 . 1 1 27 27 SER H H 1 8.137 0.02 . 1 . . 38 . A 27 SER H . 18225 1
267 . 1 1 27 27 SER HA H 1 4.328 0.02 . 1 . . 522 . A 27 SER HA . 18225 1
268 . 1 1 27 27 SER HB2 H 1 3.985 0.02 . 2 . . 664 . A 27 SER HB2 . 18225 1
269 . 1 1 27 27 SER HB3 H 1 3.941 0.02 . 2 . . 521 . A 27 SER HB3 . 18225 1
270 . 1 1 27 27 SER C C 13 175.563 0.2 . 1 . . 193 . A 27 SER C . 18225 1
271 . 1 1 27 27 SER CA C 13 59.856 0.2 . 1 . . 225 . A 27 SER CA . 18225 1
272 . 1 1 27 27 SER CB C 13 63.819 0.2 . 1 . . 247 . A 27 SER CB . 18225 1
273 . 1 1 27 27 SER N N 15 116.730 0.3 . 1 . . 39 . A 27 SER N . 18225 1
274 . 1 1 28 28 GLY H H 1 8.477 0.02 . 1 . . 94 . A 28 GLY H . 18225 1
275 . 1 1 28 28 GLY HA2 H 1 3.964 0.02 . 1 . . 523 . A 28 GLY HA2 . 18225 1
276 . 1 1 28 28 GLY C C 13 174.314 0.2 . 1 . . 195 . A 28 GLY C . 18225 1
277 . 1 1 28 28 GLY CA C 13 46.125 0.2 . 1 . . 227 . A 28 GLY CA . 18225 1
278 . 1 1 28 28 GLY N N 15 110.734 0.3 . 1 . . 95 . A 28 GLY N . 18225 1
279 . 1 1 29 29 ALA H H 1 8.189 0.02 . 1 . . 102 . A 29 ALA H . 18225 1
280 . 1 1 29 29 ALA HA H 1 4.289 0.02 . 1 . . 421 . A 29 ALA HA . 18225 1
281 . 1 1 29 29 ALA HB1 H 1 1.444 0.02 . 1 . . 297 . A 29 ALA HB1 . 18225 1
282 . 1 1 29 29 ALA HB2 H 1 1.444 0.02 . 1 . . 297 . A 29 ALA HB2 . 18225 1
283 . 1 1 29 29 ALA HB3 H 1 1.444 0.02 . 1 . . 297 . A 29 ALA HB3 . 18225 1
284 . 1 1 29 29 ALA C C 13 177.330 0.2 . 1 . . 190 . A 29 ALA C . 18225 1
285 . 1 1 29 29 ALA CA C 13 53.174 0.2 . 1 . . 149 . A 29 ALA CA . 18225 1
286 . 1 1 29 29 ALA CB C 13 19.884 0.2 . 1 . . 329 . A 29 ALA CB . 18225 1
287 . 1 1 29 29 ALA N N 15 121.690 0.3 . 1 . . 103 . A 29 ALA N . 18225 1
288 . 1 1 30 30 LEU H H 1 7.873 0.02 . 1 . . 86 . A 30 LEU H . 18225 1
289 . 1 1 30 30 LEU HA H 1 4.079 0.02 . 1 . . 403 . A 30 LEU HA . 18225 1
290 . 1 1 30 30 LEU HB2 H 1 1.796 0.02 . 2 . . 405 . A 30 LEU HB2 . 18225 1
291 . 1 1 30 30 LEU HB3 H 1 1.717 0.02 . 2 . . 611 . A 30 LEU HB3 . 18225 1
292 . 1 1 30 30 LEU HG H 1 1.715 0.02 . 1 . . 619 . A 30 LEU HG . 18225 1
293 . 1 1 30 30 LEU HD11 H 1 0.927 0.02 . 2 . . 404 . A 30 LEU HD11 . 18225 1
294 . 1 1 30 30 LEU HD12 H 1 0.927 0.02 . 2 . . 404 . A 30 LEU HD12 . 18225 1
295 . 1 1 30 30 LEU HD13 H 1 0.927 0.02 . 2 . . 404 . A 30 LEU HD13 . 18225 1
296 . 1 1 30 30 LEU HD21 H 1 0.971 0.02 . 2 . . 524 . A 30 LEU HD21 . 18225 1
297 . 1 1 30 30 LEU HD22 H 1 0.971 0.02 . 2 . . 524 . A 30 LEU HD22 . 18225 1
298 . 1 1 30 30 LEU HD23 H 1 0.971 0.02 . 2 . . 524 . A 30 LEU HD23 . 18225 1
299 . 1 1 30 30 LEU C C 13 177.377 0.2 . 1 . . 166 . A 30 LEU C . 18225 1
300 . 1 1 30 30 LEU CA C 13 58.234 0.2 . 1 . . 298 . A 30 LEU CA . 18225 1
301 . 1 1 30 30 LEU CB C 13 42.414 0.2 . 1 . . 610 . A 30 LEU CB . 18225 1
302 . 1 1 30 30 LEU CG C 13 27.287 0.2 . 1 . . 620 . A 30 LEU CG . 18225 1
303 . 1 1 30 30 LEU CD1 C 13 24.804 0.2 . 2 . . 525 . A 30 LEU CD1 . 18225 1
304 . 1 1 30 30 LEU CD2 C 13 24.775 0.2 . 2 . . 526 . A 30 LEU CD2 . 18225 1
305 . 1 1 30 30 LEU N N 15 117.292 0.3 . 1 . . 87 . A 30 LEU N . 18225 1
306 . 1 1 31 31 ILE H H 1 8.262 0.02 . 1 . . 27 . A 31 ILE H . 18225 1
307 . 1 1 31 31 ILE HA H 1 3.883 0.02 . 1 . . 372 . A 31 ILE HA . 18225 1
308 . 1 1 31 31 ILE HB H 1 2.158 0.02 . 1 . . 374 . A 31 ILE HB . 18225 1
309 . 1 1 31 31 ILE HG12 H 1 1.689 0.02 . 2 . . 371 . A 31 ILE HG12 . 18225 1
310 . 1 1 31 31 ILE HG13 H 1 1.223 0.02 . 2 . . 370 . A 31 ILE HG13 . 18225 1
311 . 1 1 31 31 ILE HG21 H 1 0.855 0.02 . 1 . . 375 . A 31 ILE HG21 . 18225 1
312 . 1 1 31 31 ILE HG22 H 1 0.855 0.02 . 1 . . 375 . A 31 ILE HG22 . 18225 1
313 . 1 1 31 31 ILE HG23 H 1 0.855 0.02 . 1 . . 375 . A 31 ILE HG23 . 18225 1
314 . 1 1 31 31 ILE HD11 H 1 0.911 0.02 . 1 . . 376 . A 31 ILE HD11 . 18225 1
315 . 1 1 31 31 ILE HD12 H 1 0.911 0.02 . 1 . . 376 . A 31 ILE HD12 . 18225 1
316 . 1 1 31 31 ILE HD13 H 1 0.911 0.02 . 1 . . 376 . A 31 ILE HD13 . 18225 1
317 . 1 1 31 31 ILE CA C 13 66.266 0.2 . 1 . . 131 . A 31 ILE CA . 18225 1
318 . 1 1 31 31 ILE CB C 13 34.756 0.2 . 1 . . 373 . A 31 ILE CB . 18225 1
319 . 1 1 31 31 ILE CG1 C 13 29.648 0.2 . 1 . . 369 . A 31 ILE CG1 . 18225 1
320 . 1 1 31 31 ILE CG2 C 13 17.735 0.2 . 1 . . 377 . A 31 ILE CG2 . 18225 1
321 . 1 1 31 31 ILE CD1 C 13 12.182 0.2 . 1 . . 378 . A 31 ILE CD1 . 18225 1
322 . 1 1 31 31 ILE N N 15 116.517 0.3 . 1 . . 28 . A 31 ILE N . 18225 1
323 . 1 1 32 32 PRO HA H 1 4.212 0.02 . 1 . . 626 . A 32 PRO HA . 18225 1
324 . 1 1 32 32 PRO HB2 H 1 2.205 0.02 . 2 . . 532 . A 32 PRO HB2 . 18225 1
325 . 1 1 32 32 PRO HB3 H 1 1.799 0.02 . 2 . . 530 . A 32 PRO HB3 . 18225 1
326 . 1 1 32 32 PRO HG2 H 1 2.200 0.02 . 2 . . 528 . A 32 PRO HG2 . 18225 1
327 . 1 1 32 32 PRO HG3 H 1 1.888 0.02 . 2 . . 730 . A 32 PRO HG3 . 18225 1
328 . 1 1 32 32 PRO HD2 H 1 3.527 0.02 . 2 . . 625 . A 32 PRO HD2 . 18225 1
329 . 1 1 32 32 PRO HD3 H 1 3.713 0.02 . 2 . . 527 . A 32 PRO HD3 . 18225 1
330 . 1 1 32 32 PRO CA C 13 65.993 0.2 . 1 . . 627 . A 32 PRO CA . 18225 1
331 . 1 1 32 32 PRO CB C 13 30.992 0.2 . 1 . . 531 . A 32 PRO CB . 18225 1
332 . 1 1 32 32 PRO CG C 13 28.428 0.2 . 1 . . 533 . A 32 PRO CG . 18225 1
333 . 1 1 32 32 PRO CD C 13 49.297 0.2 . 1 . . 529 . A 32 PRO CD . 18225 1
334 . 1 1 33 33 ALA H H 1 7.613 0.02 . 1 . . 98 . A 33 ALA H . 18225 1
335 . 1 1 33 33 ALA HA H 1 4.066 0.02 . 1 . . 356 . A 33 ALA HA . 18225 1
336 . 1 1 33 33 ALA HB1 H 1 1.515 0.02 . 1 . . 357 . A 33 ALA HB1 . 18225 1
337 . 1 1 33 33 ALA HB2 H 1 1.515 0.02 . 1 . . 357 . A 33 ALA HB2 . 18225 1
338 . 1 1 33 33 ALA HB3 H 1 1.515 0.02 . 1 . . 357 . A 33 ALA HB3 . 18225 1
339 . 1 1 33 33 ALA C C 13 178.814 0.2 . 1 . . 185 . A 33 ALA C . 18225 1
340 . 1 1 33 33 ALA CA C 13 55.689 0.2 . 1 . . 148 . A 33 ALA CA . 18225 1
341 . 1 1 33 33 ALA CB C 13 18.379 0.2 . 1 . . 358 . A 33 ALA CB . 18225 1
342 . 1 1 33 33 ALA N N 15 118.208 0.3 . 1 . . 99 . A 33 ALA N . 18225 1
343 . 1 1 34 34 ILE H H 1 8.259 0.02 . 1 . . 310 . A 34 ILE H . 18225 1
344 . 1 1 34 34 ILE HA H 1 3.665 0.02 . 1 . . 359 . A 34 ILE HA . 18225 1
345 . 1 1 34 34 ILE HB H 1 2.076 0.02 . 1 . . 364 . A 34 ILE HB . 18225 1
346 . 1 1 34 34 ILE HG12 H 1 1.117 0.02 . 2 . . 366 . A 34 ILE HG12 . 18225 1
347 . 1 1 34 34 ILE HG13 H 1 1.826 0.02 . 2 . . 368 . A 34 ILE HG13 . 18225 1
348 . 1 1 34 34 ILE HG21 H 1 0.848 0.02 . 1 . . 360 . A 34 ILE HG21 . 18225 1
349 . 1 1 34 34 ILE HG22 H 1 0.848 0.02 . 1 . . 360 . A 34 ILE HG22 . 18225 1
350 . 1 1 34 34 ILE HG23 H 1 0.848 0.02 . 1 . . 360 . A 34 ILE HG23 . 18225 1
351 . 1 1 34 34 ILE HD11 H 1 0.803 0.02 . 1 . . 362 . A 34 ILE HD11 . 18225 1
352 . 1 1 34 34 ILE HD12 H 1 0.803 0.02 . 1 . . 362 . A 34 ILE HD12 . 18225 1
353 . 1 1 34 34 ILE HD13 H 1 0.803 0.02 . 1 . . 362 . A 34 ILE HD13 . 18225 1
354 . 1 1 34 34 ILE C C 13 177.826 0.2 . 1 . . 325 . A 34 ILE C . 18225 1
355 . 1 1 34 34 ILE CA C 13 65.154 0.2 . 1 . . 320 . A 34 ILE CA . 18225 1
356 . 1 1 34 34 ILE CB C 13 37.283 0.2 . 1 . . 365 . A 34 ILE CB . 18225 1
357 . 1 1 34 34 ILE CG1 C 13 29.112 0.2 . 1 . . 367 . A 34 ILE CG1 . 18225 1
358 . 1 1 34 34 ILE CG2 C 13 17.779 0.2 . 1 . . 363 . A 34 ILE CG2 . 18225 1
359 . 1 1 34 34 ILE CD1 C 13 12.996 0.2 . 1 . . 361 . A 34 ILE CD1 . 18225 1
360 . 1 1 34 34 ILE N N 15 117.730 0.3 . 1 . . 311 . A 34 ILE N . 18225 1
361 . 1 1 35 35 TYR H H 1 8.347 0.02 . 1 . . 312 . A 35 TYR H . 18225 1
362 . 1 1 35 35 TYR HA H 1 4.093 0.02 . 1 . . 593 . A 35 TYR HA . 18225 1
363 . 1 1 35 35 TYR HB2 H 1 3.056 0.02 . 2 . . 665 . A 35 TYR HB2 . 18225 1
364 . 1 1 35 35 TYR HB3 H 1 3.084 0.02 . 2 . . 594 . A 35 TYR HB3 . 18225 1
365 . 1 1 35 35 TYR HD1 H 1 6.996 0.02 . 3 . . 592 . A 35 TYR HD1 . 18225 1
366 . 1 1 35 35 TYR HD2 H 1 6.996 0.02 . 3 . . 592 . A 35 TYR HD2 . 18225 1
367 . 1 1 35 35 TYR HE1 H 1 6.675 0.02 . 3 . . 629 . A 35 TYR HE1 . 18225 1
368 . 1 1 35 35 TYR HE2 H 1 6.675 0.02 . 3 . . 629 . A 35 TYR HE2 . 18225 1
369 . 1 1 35 35 TYR C C 13 177.885 0.2 . 1 . . 349 . A 35 TYR C . 18225 1
370 . 1 1 35 35 TYR CA C 13 61.638 0.2 . 1 . . 309 . A 35 TYR CA . 18225 1
371 . 1 1 35 35 TYR CB C 13 37.924 0.2 . 1 . . 595 . A 35 TYR CB . 18225 1
372 . 1 1 35 35 TYR CD1 C 13 132.210 0.2 . 3 . . 628 . A 35 TYR CD1 . 18225 1
373 . 1 1 35 35 TYR CD2 C 13 132.210 0.2 . 3 . . 628 . A 35 TYR CD2 . 18225 1
374 . 1 1 35 35 TYR CE1 C 13 117.943 0.2 . 3 . . 630 . A 35 TYR CE1 . 18225 1
375 . 1 1 35 35 TYR CE2 C 13 117.943 0.2 . 3 . . 630 . A 35 TYR CE2 . 18225 1
376 . 1 1 35 35 TYR N N 15 118.693 0.3 . 1 . . 313 . A 35 TYR N . 18225 1
377 . 1 1 36 36 MET H H 1 8.252 0.02 . 1 . . 76 . A 36 MET H . 18225 1
378 . 1 1 36 36 MET HA H 1 4.220 0.02 . 1 . . 596 . A 36 MET HA . 18225 1
379 . 1 1 36 36 MET HB2 H 1 2.189 0.02 . 2 . . 597 . A 36 MET HB2 . 18225 1
380 . 1 1 36 36 MET HB3 H 1 2.272 0.02 . 2 . . 598 . A 36 MET HB3 . 18225 1
381 . 1 1 36 36 MET HG2 H 1 2.568 0.02 . 2 . . 599 . A 36 MET HG2 . 18225 1
382 . 1 1 36 36 MET HG3 H 1 2.678 0.02 . 2 . . 601 . A 36 MET HG3 . 18225 1
383 . 1 1 36 36 MET HE1 H 1 1.998 0.02 . 1 . . 616 . A 36 MET HE1 . 18225 1
384 . 1 1 36 36 MET HE2 H 1 1.998 0.02 . 1 . . 616 . A 36 MET HE2 . 18225 1
385 . 1 1 36 36 MET HE3 H 1 1.998 0.02 . 1 . . 616 . A 36 MET HE3 . 18225 1
386 . 1 1 36 36 MET C C 13 177.903 0.2 . 1 . . 350 . A 36 MET C . 18225 1
387 . 1 1 36 36 MET CA C 13 58.653 0.2 . 1 . . 216 . A 36 MET CA . 18225 1
388 . 1 1 36 36 MET CB C 13 32.172 0.2 . 1 . . 602 . A 36 MET CB . 18225 1
389 . 1 1 36 36 MET CG C 13 32.797 0.2 . 1 . . 600 . A 36 MET CG . 18225 1
390 . 1 1 36 36 MET CE C 13 17.209 0.2 . 1 . . 617 . A 36 MET CE . 18225 1
391 . 1 1 36 36 MET N N 15 117.356 0.3 . 1 . . 77 . A 36 MET N . 18225 1
392 . 1 1 37 37 LEU H H 1 8.301 0.02 . 1 . . 322 . A 37 LEU H . 18225 1
393 . 1 1 37 37 LEU HA H 1 4.028 0.02 . 1 . . 603 . A 37 LEU HA . 18225 1
394 . 1 1 37 37 LEU HB2 H 1 1.760 0.02 . 2 . . 666 . A 37 LEU HB2 . 18225 1
395 . 1 1 37 37 LEU HB3 H 1 1.859 0.02 . 2 . . 608 . A 37 LEU HB3 . 18225 1
396 . 1 1 37 37 LEU HG H 1 1.771 0.02 . 1 . . 606 . A 37 LEU HG . 18225 1
397 . 1 1 37 37 LEU HD11 H 1 0.828 0.02 . 2 . . 705 . A 37 LEU HD11 . 18225 1
398 . 1 1 37 37 LEU HD12 H 1 0.828 0.02 . 2 . . 705 . A 37 LEU HD12 . 18225 1
399 . 1 1 37 37 LEU HD13 H 1 0.828 0.02 . 2 . . 705 . A 37 LEU HD13 . 18225 1
400 . 1 1 37 37 LEU HD21 H 1 0.839 0.02 . 2 . . 605 . A 37 LEU HD21 . 18225 1
401 . 1 1 37 37 LEU HD22 H 1 0.839 0.02 . 2 . . 605 . A 37 LEU HD22 . 18225 1
402 . 1 1 37 37 LEU HD23 H 1 0.839 0.02 . 2 . . 605 . A 37 LEU HD23 . 18225 1
403 . 1 1 37 37 LEU C C 13 178.393 0.2 . 1 . . 171 . A 37 LEU C . 18225 1
404 . 1 1 37 37 LEU CA C 13 58.642 0.2 . 1 . . 348 . A 37 LEU CA . 18225 1
405 . 1 1 37 37 LEU CB C 13 41.989 0.2 . 1 . . 609 . A 37 LEU CB . 18225 1
406 . 1 1 37 37 LEU CG C 13 27.067 0.2 . 1 . . 607 . A 37 LEU CG . 18225 1
407 . 1 1 37 37 LEU CD1 C 13 24.251 0.2 . 2 . . 706 . A 37 LEU CD1 . 18225 1
408 . 1 1 37 37 LEU CD2 C 13 24.259 0.2 . 2 . . 604 . A 37 LEU CD2 . 18225 1
409 . 1 1 37 37 LEU N N 15 119.978 0.3 . 1 . . 321 . A 37 LEU N . 18225 1
410 . 1 1 38 38 VAL H H 1 8.414 0.02 . 1 . . 40 . A 38 VAL H . 18225 1
411 . 1 1 38 38 VAL HA H 1 3.502 0.02 . 1 . . 394 . A 38 VAL HA . 18225 1
412 . 1 1 38 38 VAL HB H 1 2.182 0.02 . 1 . . 395 . A 38 VAL HB . 18225 1
413 . 1 1 38 38 VAL HG11 H 1 1.002 0.02 . 2 . . 396 . A 38 VAL HG11 . 18225 1
414 . 1 1 38 38 VAL HG12 H 1 1.002 0.02 . 2 . . 396 . A 38 VAL HG12 . 18225 1
415 . 1 1 38 38 VAL HG13 H 1 1.002 0.02 . 2 . . 396 . A 38 VAL HG13 . 18225 1
416 . 1 1 38 38 VAL HG21 H 1 0.861 0.02 . 2 . . 392 . A 38 VAL HG21 . 18225 1
417 . 1 1 38 38 VAL HG22 H 1 0.861 0.02 . 2 . . 392 . A 38 VAL HG22 . 18225 1
418 . 1 1 38 38 VAL HG23 H 1 0.861 0.02 . 2 . . 392 . A 38 VAL HG23 . 18225 1
419 . 1 1 38 38 VAL C C 13 177.962 0.2 . 1 . . 336 . A 38 VAL C . 18225 1
420 . 1 1 38 38 VAL CA C 13 67.155 0.2 . 1 . . 316 . A 38 VAL CA . 18225 1
421 . 1 1 38 38 VAL CB C 13 31.415 0.2 . 1 . . 398 . A 38 VAL CB . 18225 1
422 . 1 1 38 38 VAL CG1 C 13 23.017 0.2 . 2 . . 397 . A 38 VAL CG1 . 18225 1
423 . 1 1 38 38 VAL CG2 C 13 21.716 0.2 . 2 . . 393 . A 38 VAL CG2 . 18225 1
424 . 1 1 38 38 VAL N N 15 117.991 0.3 . 1 . . 41 . A 38 VAL N . 18225 1
425 . 1 1 39 39 PHE H H 1 8.337 0.02 . 1 . . 314 . A 39 PHE H . 18225 1
426 . 1 1 39 39 PHE HA H 1 4.178 0.02 . 1 . . 588 . A 39 PHE HA . 18225 1
427 . 1 1 39 39 PHE HB2 H 1 3.079 0.02 . 2 . . 591 . A 39 PHE HB2 . 18225 1
428 . 1 1 39 39 PHE HB3 H 1 3.266 0.02 . 2 . . 589 . A 39 PHE HB3 . 18225 1
429 . 1 1 39 39 PHE HD1 H 1 7.162 0.02 . 3 . . 590 . A 39 PHE HD1 . 18225 1
430 . 1 1 39 39 PHE HD2 H 1 7.162 0.02 . 3 . . 590 . A 39 PHE HD2 . 18225 1
431 . 1 1 39 39 PHE HE1 H 1 7.216 0.02 . 3 . . 728 . A 39 PHE HE1 . 18225 1
432 . 1 1 39 39 PHE HE2 H 1 7.216 0.02 . 3 . . 728 . A 39 PHE HE2 . 18225 1
433 . 1 1 39 39 PHE HZ H 1 7.216 0.02 . 1 . . 729 . A 39 PHE HZ . 18225 1
434 . 1 1 39 39 PHE C C 13 178.233 0.2 . 1 . . 328 . A 39 PHE C . 18225 1
435 . 1 1 39 39 PHE CA C 13 61.503 0.2 . 1 . . 354 . A 39 PHE CA . 18225 1
436 . 1 1 39 39 PHE CB C 13 39.058 0.2 . 1 . . 631 . A 39 PHE CB . 18225 1
437 . 1 1 39 39 PHE CD1 C 13 131.155 0.2 . 3 . . 667 . A 39 PHE CD1 . 18225 1
438 . 1 1 39 39 PHE CD2 C 13 131.155 0.2 . 3 . . 667 . A 39 PHE CD2 . 18225 1
439 . 1 1 39 39 PHE N N 15 119.830 0.3 . 1 . . 315 . A 39 PHE N . 18225 1
440 . 1 1 40 40 LEU H H 1 8.603 0.02 . 1 . . 326 . A 40 LEU H . 18225 1
441 . 1 1 40 40 LEU HA H 1 3.966 0.02 . 1 . . 399 . A 40 LEU HA . 18225 1
442 . 1 1 40 40 LEU HB2 H 1 1.965 0.02 . 2 . . 400 . A 40 LEU HB2 . 18225 1
443 . 1 1 40 40 LEU HB3 H 1 1.538 0.02 . 2 . . 412 . A 40 LEU HB3 . 18225 1
444 . 1 1 40 40 LEU HG H 1 1.964 0.02 . 1 . . 411 . A 40 LEU HG . 18225 1
445 . 1 1 40 40 LEU HD11 H 1 0.907 0.02 . 2 . . 408 . A 40 LEU HD11 . 18225 1
446 . 1 1 40 40 LEU HD12 H 1 0.907 0.02 . 2 . . 408 . A 40 LEU HD12 . 18225 1
447 . 1 1 40 40 LEU HD13 H 1 0.907 0.02 . 2 . . 408 . A 40 LEU HD13 . 18225 1
448 . 1 1 40 40 LEU HD21 H 1 0.908 0.02 . 2 . . 410 . A 40 LEU HD21 . 18225 1
449 . 1 1 40 40 LEU HD22 H 1 0.908 0.02 . 2 . . 410 . A 40 LEU HD22 . 18225 1
450 . 1 1 40 40 LEU HD23 H 1 0.908 0.02 . 2 . . 410 . A 40 LEU HD23 . 18225 1
451 . 1 1 40 40 LEU C C 13 179.279 0.2 . 1 . . 353 . A 40 LEU C . 18225 1
452 . 1 1 40 40 LEU CA C 13 57.872 0.2 . 1 . . 355 . A 40 LEU CA . 18225 1
453 . 1 1 40 40 LEU CB C 13 42.387 0.2 . 1 . . 401 . A 40 LEU CB . 18225 1
454 . 1 1 40 40 LEU CG C 13 27.133 0.2 . 1 . . 407 . A 40 LEU CG . 18225 1
455 . 1 1 40 40 LEU CD1 C 13 25.438 0.2 . 2 . . 409 . A 40 LEU CD1 . 18225 1
456 . 1 1 40 40 LEU CD2 C 13 23.715 0.2 . 2 . . 402 . A 40 LEU CD2 . 18225 1
457 . 1 1 40 40 LEU N N 15 119.985 0.3 . 1 . . 327 . A 40 LEU N . 18225 1
458 . 1 1 41 41 LEU H H 1 8.486 0.02 . 1 . . 351 . A 41 LEU H . 18225 1
459 . 1 1 41 41 LEU HA H 1 4.044 0.02 . 1 . . 417 . A 41 LEU HA . 18225 1
460 . 1 1 41 41 LEU HB2 H 1 1.395 0.02 . 2 . . 671 . A 41 LEU HB2 . 18225 1
461 . 1 1 41 41 LEU HB3 H 1 1.901 0.02 . 2 . . 419 . A 41 LEU HB3 . 18225 1
462 . 1 1 41 41 LEU HG H 1 1.859 0.02 . 1 . . 414 . A 41 LEU HG . 18225 1
463 . 1 1 41 41 LEU HD11 H 1 0.823 0.02 . 2 . . 420 . A 41 LEU HD11 . 18225 1
464 . 1 1 41 41 LEU HD12 H 1 0.823 0.02 . 2 . . 420 . A 41 LEU HD12 . 18225 1
465 . 1 1 41 41 LEU HD13 H 1 0.823 0.02 . 2 . . 420 . A 41 LEU HD13 . 18225 1
466 . 1 1 41 41 LEU HD21 H 1 0.811 0.02 . 2 . . 415 . A 41 LEU HD21 . 18225 1
467 . 1 1 41 41 LEU HD22 H 1 0.811 0.02 . 2 . . 415 . A 41 LEU HD22 . 18225 1
468 . 1 1 41 41 LEU HD23 H 1 0.811 0.02 . 2 . . 415 . A 41 LEU HD23 . 18225 1
469 . 1 1 41 41 LEU C C 13 178.670 0.2 . 1 . . 335 . A 41 LEU C . 18225 1
470 . 1 1 41 41 LEU CA C 13 57.683 0.2 . 1 . . 330 . A 41 LEU CA . 18225 1
471 . 1 1 41 41 LEU CB C 13 41.931 0.2 . 1 . . 418 . A 41 LEU CB . 18225 1
472 . 1 1 41 41 LEU CG C 13 27.124 0.2 . 1 . . 413 . A 41 LEU CG . 18225 1
473 . 1 1 41 41 LEU CD1 C 13 25.590 0.2 . 2 . . 632 . A 41 LEU CD1 . 18225 1
474 . 1 1 41 41 LEU CD2 C 13 23.420 0.2 . 2 . . 416 . A 41 LEU CD2 . 18225 1
475 . 1 1 41 41 LEU N N 15 118.649 0.3 . 1 . . 352 . A 41 LEU N . 18225 1
476 . 1 1 42 42 GLY H H 1 8.289 0.02 . 1 . . 17 . A 42 GLY H . 18225 1
477 . 1 1 42 42 GLY HA2 H 1 3.749 0.02 . 1 . . 479 . A 42 GLY HA2 . 18225 1
478 . 1 1 42 42 GLY C C 13 174.814 0.2 . 1 . . 160 . A 42 GLY C . 18225 1
479 . 1 1 42 42 GLY CA C 13 46.405 0.2 . 1 . . 208 . A 42 GLY CA . 18225 1
480 . 1 1 42 42 GLY N N 15 105.262 0.3 . 1 . . 18 . A 42 GLY N . 18225 1
481 . 1 1 43 43 THR H H 1 7.891 0.02 . 1 . . 9 . A 43 THR H . 18225 1
482 . 1 1 43 43 THR HA H 1 4.243 0.02 . 1 . . 466 . A 43 THR HA . 18225 1
483 . 1 1 43 43 THR HB H 1 4.127 0.02 . 1 . . 469 . A 43 THR HB . 18225 1
484 . 1 1 43 43 THR HG21 H 1 1.047 0.02 . 1 . . 465 . A 43 THR HG21 . 18225 1
485 . 1 1 43 43 THR HG22 H 1 1.047 0.02 . 1 . . 465 . A 43 THR HG22 . 18225 1
486 . 1 1 43 43 THR HG23 H 1 1.047 0.02 . 1 . . 465 . A 43 THR HG23 . 18225 1
487 . 1 1 43 43 THR C C 13 175.888 0.2 . 1 . . 333 . A 43 THR C . 18225 1
488 . 1 1 43 43 THR CA C 13 63.505 0.2 . 1 . . 239 . A 43 THR CA . 18225 1
489 . 1 1 43 43 THR CB C 13 69.598 0.2 . 1 . . 468 . A 43 THR CB . 18225 1
490 . 1 1 43 43 THR CG2 C 13 21.779 0.2 . 1 . . 467 . A 43 THR CG2 . 18225 1
491 . 1 1 43 43 THR N N 15 111.955 0.3 . 1 . . 10 . A 43 THR N . 18225 1
492 . 1 1 44 44 THR H H 1 7.740 0.02 . 1 . . 331 . A 44 THR H . 18225 1
493 . 1 1 44 44 THR HA H 1 4.320 0.02 . 1 . . 476 . A 44 THR HA . 18225 1
494 . 1 1 44 44 THR HB H 1 4.318 0.02 . 1 . . 474 . A 44 THR HB . 18225 1
495 . 1 1 44 44 THR HG21 H 1 1.265 0.02 . 1 . . 473 . A 44 THR HG21 . 18225 1
496 . 1 1 44 44 THR HG22 H 1 1.265 0.02 . 1 . . 473 . A 44 THR HG22 . 18225 1
497 . 1 1 44 44 THR HG23 H 1 1.265 0.02 . 1 . . 473 . A 44 THR HG23 . 18225 1
498 . 1 1 44 44 THR C C 13 175.543 0.2 . 1 . . 156 . A 44 THR C . 18225 1
499 . 1 1 44 44 THR CA C 13 63.009 0.2 . 1 . . 206 . A 44 THR CA . 18225 1
500 . 1 1 44 44 THR CB C 13 69.881 0.2 . 1 . . 475 . A 44 THR CB . 18225 1
501 . 1 1 44 44 THR CG2 C 13 21.790 0.2 . 1 . . 477 . A 44 THR CG2 . 18225 1
502 . 1 1 44 44 THR N N 15 111.997 0.3 . 1 . . 332 . A 44 THR N . 18225 1
503 . 1 1 45 45 GLY H H 1 8.243 0.02 . 1 . . 1 . A 45 GLY H . 18225 1
504 . 1 1 45 45 GLY HA2 H 1 4.001 0.02 . 2 . . 478 . A 45 GLY HA2 . 18225 1
505 . 1 1 45 45 GLY HA3 H 1 3.943 0.02 . 2 . . 613 . A 45 GLY HA3 . 18225 1
506 . 1 1 45 45 GLY C C 13 174.928 0.2 . 1 . . 186 . A 45 GLY C . 18225 1
507 . 1 1 45 45 GLY CA C 13 46.420 0.2 . 1 . . 300 . A 45 GLY CA . 18225 1
508 . 1 1 45 45 GLY N N 15 109.564 0.3 . 1 . . 2 . A 45 GLY N . 18225 1
509 . 1 1 46 46 ASN H H 1 8.170 0.02 . 1 . . 78 . A 46 ASN H . 18225 1
510 . 1 1 46 46 ASN HA H 1 4.717 0.02 . 1 . . 443 . A 46 ASN HA . 18225 1
511 . 1 1 46 46 ASN HB2 H 1 2.780 0.02 . 2 . . 441 . A 46 ASN HB2 . 18225 1
512 . 1 1 46 46 ASN HB3 H 1 2.694 0.02 . 2 . . 442 . A 46 ASN HB3 . 18225 1
513 . 1 1 46 46 ASN HD21 H 1 7.393 0.02 . 1 . . 439 . A 46 ASN HD21 . 18225 1
514 . 1 1 46 46 ASN HD22 H 1 6.826 0.02 . 1 . . 440 . A 46 ASN HD22 . 18225 1
515 . 1 1 46 46 ASN C C 13 176.127 0.2 . 1 . . 197 . A 46 ASN C . 18225 1
516 . 1 1 46 46 ASN CA C 13 54.614 0.2 . 1 . . 143 . A 46 ASN CA . 18225 1
517 . 1 1 46 46 ASN CB C 13 39.311 0.2 . 1 . . 444 . A 46 ASN CB . 18225 1
518 . 1 1 46 46 ASN N N 15 117.851 0.3 . 1 . . 79 . A 46 ASN N . 18225 1
519 . 1 1 46 46 ASN ND2 N 15 111.527 0.3 . 1 . . 65 . A 46 ASN ND2 . 18225 1
520 . 1 1 47 47 GLY H H 1 8.663 0.02 . 1 . . 106 . A 47 GLY H . 18225 1
521 . 1 1 47 47 GLY HA2 H 1 3.868 0.02 . 2 . . 481 . A 47 GLY HA2 . 18225 1
522 . 1 1 47 47 GLY HA3 H 1 3.748 0.02 . 2 . . 480 . A 47 GLY HA3 . 18225 1
523 . 1 1 47 47 GLY C C 13 174.612 0.2 . 1 . . 305 . A 47 GLY C . 18225 1
524 . 1 1 47 47 GLY CA C 13 47.241 0.2 . 1 . . 150 . A 47 GLY CA . 18225 1
525 . 1 1 47 47 GLY N N 15 108.287 0.3 . 1 . . 107 . A 47 GLY N . 18225 1
526 . 1 1 48 48 LEU H H 1 8.149 0.02 . 1 . . 302 . A 48 LEU H . 18225 1
527 . 1 1 48 48 LEU HA H 1 4.268 0.02 . 1 . . 482 . A 48 LEU HA . 18225 1
528 . 1 1 48 48 LEU HB2 H 1 1.753 0.02 . 2 . . 483 . A 48 LEU HB2 . 18225 1
529 . 1 1 48 48 LEU HB3 H 1 1.812 0.02 . 2 . . 618 . A 48 LEU HB3 . 18225 1
530 . 1 1 48 48 LEU HG H 1 1.739 0.02 . 1 . . 488 . A 48 LEU HG . 18225 1
531 . 1 1 48 48 LEU HD11 H 1 0.913 0.02 . 2 . . 484 . A 48 LEU HD11 . 18225 1
532 . 1 1 48 48 LEU HD12 H 1 0.913 0.02 . 2 . . 484 . A 48 LEU HD12 . 18225 1
533 . 1 1 48 48 LEU HD13 H 1 0.913 0.02 . 2 . . 484 . A 48 LEU HD13 . 18225 1
534 . 1 1 48 48 LEU HD21 H 1 0.977 0.02 . 2 . . 486 . A 48 LEU HD21 . 18225 1
535 . 1 1 48 48 LEU HD22 H 1 0.977 0.02 . 2 . . 486 . A 48 LEU HD22 . 18225 1
536 . 1 1 48 48 LEU HD23 H 1 0.977 0.02 . 2 . . 486 . A 48 LEU HD23 . 18225 1
537 . 1 1 48 48 LEU C C 13 179.407 0.2 . 1 . . 203 . A 48 LEU C . 18225 1
538 . 1 1 48 48 LEU CA C 13 57.592 0.2 . 1 . . 304 . A 48 LEU CA . 18225 1
539 . 1 1 48 48 LEU CB C 13 41.738 0.2 . 1 . . 490 . A 48 LEU CB . 18225 1
540 . 1 1 48 48 LEU CG C 13 27.356 0.2 . 1 . . 489 . A 48 LEU CG . 18225 1
541 . 1 1 48 48 LEU CD1 C 13 24.931 0.2 . 2 . . 487 . A 48 LEU CD1 . 18225 1
542 . 1 1 48 48 LEU CD2 C 13 24.774 0.2 . 2 . . 485 . A 48 LEU CD2 . 18225 1
543 . 1 1 48 48 LEU N N 15 120.479 0.3 . 1 . . 303 . A 48 LEU N . 18225 1
544 . 1 1 49 49 VAL H H 1 7.969 0.02 . 1 . . 120 . A 49 VAL H . 18225 1
545 . 1 1 49 49 VAL HA H 1 3.816 0.02 . 1 . . 381 . A 49 VAL HA . 18225 1
546 . 1 1 49 49 VAL HB H 1 2.235 0.02 . 1 . . 382 . A 49 VAL HB . 18225 1
547 . 1 1 49 49 VAL HG11 H 1 0.947 0.02 . 2 . . 384 . A 49 VAL HG11 . 18225 1
548 . 1 1 49 49 VAL HG12 H 1 0.947 0.02 . 2 . . 384 . A 49 VAL HG12 . 18225 1
549 . 1 1 49 49 VAL HG13 H 1 0.947 0.02 . 2 . . 384 . A 49 VAL HG13 . 18225 1
550 . 1 1 49 49 VAL HG21 H 1 1.084 0.02 . 2 . . 379 . A 49 VAL HG21 . 18225 1
551 . 1 1 49 49 VAL HG22 H 1 1.084 0.02 . 2 . . 379 . A 49 VAL HG22 . 18225 1
552 . 1 1 49 49 VAL HG23 H 1 1.084 0.02 . 2 . . 379 . A 49 VAL HG23 . 18225 1
553 . 1 1 49 49 VAL C C 13 177.444 0.2 . 1 . . 205 . A 49 VAL C . 18225 1
554 . 1 1 49 49 VAL CA C 13 65.943 0.2 . 1 . . 222 . A 49 VAL CA . 18225 1
555 . 1 1 49 49 VAL CB C 13 31.678 0.2 . 1 . . 383 . A 49 VAL CB . 18225 1
556 . 1 1 49 49 VAL CG1 C 13 21.295 0.2 . 2 . . 385 . A 49 VAL CG1 . 18225 1
557 . 1 1 49 49 VAL CG2 C 13 22.366 0.2 . 2 . . 380 . A 49 VAL CG2 . 18225 1
558 . 1 1 49 49 VAL N N 15 119.968 0.3 . 1 . . 121 . A 49 VAL N . 18225 1
559 . 1 1 50 50 LEU H H 1 7.814 0.02 . 1 . . 126 . A 50 LEU H . 18225 1
560 . 1 1 50 50 LEU HA H 1 4.012 0.02 . 1 . . 406 . A 50 LEU HA . 18225 1
561 . 1 1 50 50 LEU HB2 H 1 1.822 0.02 . 2 . . 548 . A 50 LEU HB2 . 18225 1
562 . 1 1 50 50 LEU HB3 H 1 1.528 0.02 . 2 . . 546 . A 50 LEU HB3 . 18225 1
563 . 1 1 50 50 LEU HG H 1 1.715 0.02 . 1 . . 544 . A 50 LEU HG . 18225 1
564 . 1 1 50 50 LEU HD11 H 1 0.898 0.02 . 2 . . 543 . A 50 LEU HD11 . 18225 1
565 . 1 1 50 50 LEU HD12 H 1 0.898 0.02 . 2 . . 543 . A 50 LEU HD12 . 18225 1
566 . 1 1 50 50 LEU HD13 H 1 0.898 0.02 . 2 . . 543 . A 50 LEU HD13 . 18225 1
567 . 1 1 50 50 LEU HD21 H 1 0.825 0.02 . 2 . . 541 . A 50 LEU HD21 . 18225 1
568 . 1 1 50 50 LEU HD22 H 1 0.825 0.02 . 2 . . 541 . A 50 LEU HD22 . 18225 1
569 . 1 1 50 50 LEU HD23 H 1 0.825 0.02 . 2 . . 541 . A 50 LEU HD23 . 18225 1
570 . 1 1 50 50 LEU C C 13 178.085 0.2 . 1 . . 162 . A 50 LEU C . 18225 1
571 . 1 1 50 50 LEU CA C 13 57.917 0.2 . 1 . . 299 . A 50 LEU CA . 18225 1
572 . 1 1 50 50 LEU CB C 13 41.706 0.2 . 1 . . 547 . A 50 LEU CB . 18225 1
573 . 1 1 50 50 LEU CG C 13 27.396 0.2 . 1 . . 545 . A 50 LEU CG . 18225 1
574 . 1 1 50 50 LEU CD1 C 13 25.208 0.2 . 2 . . 542 . A 50 LEU CD1 . 18225 1
575 . 1 1 50 50 LEU CD2 C 13 23.936 0.2 . 2 . . 540 . A 50 LEU CD2 . 18225 1
576 . 1 1 50 50 LEU N N 15 119.329 0.3 . 1 . . 127 . A 50 LEU N . 18225 1
577 . 1 1 51 51 TRP H H 1 8.125 0.02 . 1 . . 19 . A 51 TRP H . 18225 1
578 . 1 1 51 51 TRP HA H 1 4.489 0.02 . 1 . . 549 . A 51 TRP HA . 18225 1
579 . 1 1 51 51 TRP HB2 H 1 3.342 0.02 . 2 . . 457 . A 51 TRP HB2 . 18225 1
580 . 1 1 51 51 TRP HB3 H 1 3.503 0.02 . 2 . . 458 . A 51 TRP HB3 . 18225 1
581 . 1 1 51 51 TRP HD1 H 1 7.206 0.02 . 1 . . 456 . A 51 TRP HD1 . 18225 1
582 . 1 1 51 51 TRP HE1 H 1 10.506 0.02 . 1 . . 35 . A 51 TRP HE1 . 18225 1
583 . 1 1 51 51 TRP HE3 H 1 7.499 0.02 . 1 . . 645 . A 51 TRP HE3 . 18225 1
584 . 1 1 51 51 TRP HZ2 H 1 7.452 0.02 . 1 . . 646 . A 51 TRP HZ2 . 18225 1
585 . 1 1 51 51 TRP HZ3 H 1 6.930 0.02 . 1 . . 652 . A 51 TRP HZ3 . 18225 1
586 . 1 1 51 51 TRP HH2 H 1 7.090 0.02 . 1 . . 647 . A 51 TRP HH2 . 18225 1
587 . 1 1 51 51 TRP C C 13 177.377 0.2 . 1 . . 181 . A 51 TRP C . 18225 1
588 . 1 1 51 51 TRP CA C 13 60.058 0.2 . 1 . . 128 . A 51 TRP CA . 18225 1
589 . 1 1 51 51 TRP CB C 13 29.781 0.2 . 1 . . 459 . A 51 TRP CB . 18225 1
590 . 1 1 51 51 TRP CD1 C 13 127.019 0.2 . 1 . . 656 . A 51 TRP CD1 . 18225 1
591 . 1 1 51 51 TRP CE3 C 13 120.726 0.2 . 1 . . 654 . A 51 TRP CE3 . 18225 1
592 . 1 1 51 51 TRP CZ2 C 13 114.417 0.2 . 1 . . 650 . A 51 TRP CZ2 . 18225 1
593 . 1 1 51 51 TRP CZ3 C 13 120.720 0.2 . 1 . . 653 . A 51 TRP CZ3 . 18225 1
594 . 1 1 51 51 TRP CH2 C 13 123.884 0.2 . 1 . . 651 . A 51 TRP CH2 . 18225 1
595 . 1 1 51 51 TRP N N 15 118.186 0.3 . 1 . . 20 . A 51 TRP N . 18225 1
596 . 1 1 51 51 TRP NE1 N 15 129.659 0.3 . 1 . . 36 . A 51 TRP NE1 . 18225 1
597 . 1 1 52 52 THR H H 1 8.079 0.02 . 1 . . 68 . A 52 THR H . 18225 1
598 . 1 1 52 52 THR HA H 1 3.787 0.02 . 1 . . 461 . A 52 THR HA . 18225 1
599 . 1 1 52 52 THR HB H 1 4.375 0.02 . 1 . . 462 . A 52 THR HB . 18225 1
600 . 1 1 52 52 THR HG21 H 1 1.262 0.02 . 1 . . 460 . A 52 THR HG21 . 18225 1
601 . 1 1 52 52 THR HG22 H 1 1.262 0.02 . 1 . . 460 . A 52 THR HG22 . 18225 1
602 . 1 1 52 52 THR HG23 H 1 1.262 0.02 . 1 . . 460 . A 52 THR HG23 . 18225 1
603 . 1 1 52 52 THR C C 13 176.309 0.2 . 1 . . 198 . A 52 THR C . 18225 1
604 . 1 1 52 52 THR CA C 13 66.473 0.2 . 1 . . 139 . A 52 THR CA . 18225 1
605 . 1 1 52 52 THR CB C 13 68.865 0.2 . 1 . . 463 . A 52 THR CB . 18225 1
606 . 1 1 52 52 THR CG2 C 13 21.819 0.2 . 1 . . 464 . A 52 THR CG2 . 18225 1
607 . 1 1 52 52 THR N N 15 113.180 0.3 . 1 . . 69 . A 52 THR N . 18225 1
608 . 1 1 53 53 VAL H H 1 7.913 0.02 . 1 . . 110 . A 53 VAL H . 18225 1
609 . 1 1 53 53 VAL HA H 1 3.648 0.02 . 1 . . 388 . A 53 VAL HA . 18225 1
610 . 1 1 53 53 VAL HB H 1 2.109 0.02 . 1 . . 389 . A 53 VAL HB . 18225 1
611 . 1 1 53 53 VAL HG11 H 1 0.742 0.02 . 2 . . 387 . A 53 VAL HG11 . 18225 1
612 . 1 1 53 53 VAL HG12 H 1 0.742 0.02 . 2 . . 387 . A 53 VAL HG12 . 18225 1
613 . 1 1 53 53 VAL HG13 H 1 0.742 0.02 . 2 . . 387 . A 53 VAL HG13 . 18225 1
614 . 1 1 53 53 VAL HG21 H 1 0.992 0.02 . 2 . . 390 . A 53 VAL HG21 . 18225 1
615 . 1 1 53 53 VAL HG22 H 1 0.992 0.02 . 2 . . 390 . A 53 VAL HG22 . 18225 1
616 . 1 1 53 53 VAL HG23 H 1 0.992 0.02 . 2 . . 390 . A 53 VAL HG23 . 18225 1
617 . 1 1 53 53 VAL C C 13 177.252 0.2 . 1 . . 319 . A 53 VAL C . 18225 1
618 . 1 1 53 53 VAL CA C 13 66.086 0.2 . 1 . . 306 . A 53 VAL CA . 18225 1
619 . 1 1 53 53 VAL CB C 13 31.704 0.2 . 1 . . 612 . A 53 VAL CB . 18225 1
620 . 1 1 53 53 VAL CG1 C 13 21.341 0.2 . 2 . . 386 . A 53 VAL CG1 . 18225 1
621 . 1 1 53 53 VAL CG2 C 13 22.473 0.2 . 2 . . 391 . A 53 VAL CG2 . 18225 1
622 . 1 1 53 53 VAL N N 15 119.953 0.3 . 1 . . 111 . A 53 VAL N . 18225 1
623 . 1 1 54 54 PHE H H 1 8.030 0.02 . 1 . . 307 . A 54 PHE H . 18225 1
624 . 1 1 54 54 PHE HA H 1 4.247 0.02 . 1 . . 562 . A 54 PHE HA . 18225 1
625 . 1 1 54 54 PHE HB2 H 1 3.058 0.02 . 2 . . 561 . A 54 PHE HB2 . 18225 1
626 . 1 1 54 54 PHE HB3 H 1 3.144 0.02 . 2 . . 560 . A 54 PHE HB3 . 18225 1
627 . 1 1 54 54 PHE HD1 H 1 7.134 0.02 . 3 . . 558 . A 54 PHE HD1 . 18225 1
628 . 1 1 54 54 PHE HD2 H 1 7.134 0.02 . 3 . . 558 . A 54 PHE HD2 . 18225 1
629 . 1 1 54 54 PHE C C 13 177.144 0.2 . 1 . . 318 . A 54 PHE C . 18225 1
630 . 1 1 54 54 PHE CA C 13 60.454 0.2 . 1 . . 317 . A 54 PHE CA . 18225 1
631 . 1 1 54 54 PHE CB C 13 39.116 0.2 . 1 . . 559 . A 54 PHE CB . 18225 1
632 . 1 1 54 54 PHE CD1 C 13 131.429 0.2 . 3 . . 624 . A 54 PHE CD1 . 18225 1
633 . 1 1 54 54 PHE CD2 C 13 131.429 0.2 . 3 . . 624 . A 54 PHE CD2 . 18225 1
634 . 1 1 54 54 PHE N N 15 118.204 0.3 . 1 . . 308 . A 54 PHE N . 18225 1
635 . 1 1 55 55 ARG H H 1 8.034 0.02 . 1 . . 44 . A 55 ARG H . 18225 1
636 . 1 1 55 55 ARG HA H 1 3.884 0.02 . 1 . . 563 . A 55 ARG HA . 18225 1
637 . 1 1 55 55 ARG HB2 H 1 1.595 0.02 . 2 . . 672 . A 55 ARG HB2 . 18225 1
638 . 1 1 55 55 ARG HB3 H 1 1.566 0.02 . 2 . . 564 . A 55 ARG HB3 . 18225 1
639 . 1 1 55 55 ARG HG3 H 1 1.321 0.02 . 1 . . 565 . A 55 ARG HG3 . 18225 1
640 . 1 1 55 55 ARG HD2 H 1 2.869 0.02 . 2 . . 566 . A 55 ARG HD2 . 18225 1
641 . 1 1 55 55 ARG HD3 H 1 2.802 0.02 . 2 . . 570 . A 55 ARG HD3 . 18225 1
642 . 1 1 55 55 ARG HE H 1 7.255 0.02 . 1 . . 92 . A 55 ARG HE . 18225 1
643 . 1 1 55 55 ARG HH21 H 1 6.825 0.02 . 1 . . 100 . A 55 ARG HH21 . 18225 1
644 . 1 1 55 55 ARG C C 13 177.443 0.2 . 1 . . 236 . A 55 ARG C . 18225 1
645 . 1 1 55 55 ARG CA C 13 57.554 0.2 . 1 . . 301 . A 55 ARG CA . 18225 1
646 . 1 1 55 55 ARG CB C 13 29.807 0.2 . 1 . . 567 . A 55 ARG CB . 18225 1
647 . 1 1 55 55 ARG CG C 13 26.841 0.2 . 1 . . 568 . A 55 ARG CG . 18225 1
648 . 1 1 55 55 ARG CD C 13 43.051 0.2 . 1 . . 569 . A 55 ARG CD . 18225 1
649 . 1 1 55 55 ARG N N 15 117.725 0.3 . 1 . . 45 . A 55 ARG N . 18225 1
650 . 1 1 55 55 ARG NE N 15 84.655 0.3 . 1 . . 93 . A 55 ARG NE . 18225 1
651 . 1 1 55 55 ARG NH2 N 15 72.181 0.3 . 1 . . 101 . A 55 ARG NH2 . 18225 1
652 . 1 1 56 56 LYS H H 1 7.804 0.02 . 1 . . 13 . A 56 LYS H . 18225 1
653 . 1 1 56 56 LYS HA H 1 4.164 0.02 . 1 . . 571 . A 56 LYS HA . 18225 1
654 . 1 1 56 56 LYS HB2 H 1 1.833 0.02 . 1 . . 574 . A 56 LYS HB2 . 18225 1
655 . 1 1 56 56 LYS HG2 H 1 1.499 0.02 . 2 . . 621 . A 56 LYS HG2 . 18225 1
656 . 1 1 56 56 LYS HG3 H 1 1.438 0.02 . 2 . . 572 . A 56 LYS HG3 . 18225 1
657 . 1 1 56 56 LYS HD3 H 1 1.654 0.02 . 1 . . 573 . A 56 LYS HD3 . 18225 1
658 . 1 1 56 56 LYS HE3 H 1 2.937 0.02 . 1 . . 577 . A 56 LYS HE3 . 18225 1
659 . 1 1 56 56 LYS C C 13 177.418 0.2 . 1 . . 161 . A 56 LYS C . 18225 1
660 . 1 1 56 56 LYS CA C 13 57.517 0.2 . 1 . . 210 . A 56 LYS CA . 18225 1
661 . 1 1 56 56 LYS CB C 13 32.808 0.2 . 1 . . 575 . A 56 LYS CB . 18225 1
662 . 1 1 56 56 LYS CG C 13 25.095 0.2 . 1 . . 576 . A 56 LYS CG . 18225 1
663 . 1 1 56 56 LYS CD C 13 29.106 0.2 . 1 . . 622 . A 56 LYS CD . 18225 1
664 . 1 1 56 56 LYS CE C 13 42.058 0.2 . 1 . . 578 . A 56 LYS CE . 18225 1
665 . 1 1 56 56 LYS N N 15 118.622 0.3 . 1 . . 14 . A 56 LYS N . 18225 1
666 . 1 1 57 57 LYS H H 1 7.974 0.02 . 1 . . 90 . A 57 LYS H . 18225 1
667 . 1 1 57 57 LYS HA H 1 4.258 0.02 . 1 . . 550 . A 57 LYS HA . 18225 1
668 . 1 1 57 57 LYS HB2 H 1 1.772 0.02 . 2 . . 557 . A 57 LYS HB2 . 18225 1
669 . 1 1 57 57 LYS HB3 H 1 1.825 0.02 . 2 . . 556 . A 57 LYS HB3 . 18225 1
670 . 1 1 57 57 LYS HG3 H 1 1.430 0.02 . 1 . . 551 . A 57 LYS HG3 . 18225 1
671 . 1 1 57 57 LYS HD3 H 1 1.649 0.02 . 1 . . 552 . A 57 LYS HD3 . 18225 1
672 . 1 1 57 57 LYS HE3 H 1 2.936 0.02 . 1 . . 554 . A 57 LYS HE3 . 18225 1
673 . 1 1 57 57 LYS C C 13 177.029 0.2 . 1 . . 164 . A 57 LYS C . 18225 1
674 . 1 1 57 57 LYS CA C 13 56.610 0.2 . 1 . . 212 . A 57 LYS CA . 18225 1
675 . 1 1 57 57 LYS CB C 13 32.878 0.2 . 1 . . 334 . A 57 LYS CB . 18225 1
676 . 1 1 57 57 LYS CG C 13 24.934 0.2 . 1 . . 555 . A 57 LYS CG . 18225 1
677 . 1 1 57 57 LYS CD C 13 28.958 0.2 . 1 . . 553 . A 57 LYS CD . 18225 1
678 . 1 1 57 57 LYS CE C 13 42.032 0.2 . 1 . . 623 . A 57 LYS CE . 18225 1
679 . 1 1 57 57 LYS N N 15 118.937 0.3 . 1 . . 91 . A 57 LYS N . 18225 1
680 . 1 1 58 58 GLY H H 1 8.136 0.02 . 1 . . 23 . A 58 GLY H . 18225 1
681 . 1 1 58 58 GLY HA2 H 1 3.736 0.02 . 2 . . 535 . A 58 GLY HA2 . 18225 1
682 . 1 1 58 58 GLY HA3 H 1 3.844 0.02 . 2 . . 536 . A 58 GLY HA3 . 18225 1
683 . 1 1 58 58 GLY C C 13 173.543 0.2 . 1 . . 184 . A 58 GLY C . 18225 1
684 . 1 1 58 58 GLY CA C 13 45.473 0.2 . 1 . . 221 . A 58 GLY CA . 18225 1
685 . 1 1 58 58 GLY N N 15 107.785 0.3 . 1 . . 24 . A 58 GLY N . 18225 1
686 . 1 1 59 59 HIS H H 1 8.163 0.02 . 1 . . 74 . A 59 HIS H . 18225 1
687 . 1 1 59 59 HIS HA H 1 4.622 0.02 . 1 . . 580 . A 59 HIS HA . 18225 1
688 . 1 1 59 59 HIS HB2 H 1 3.045 0.02 . 2 . . 581 . A 59 HIS HB2 . 18225 1
689 . 1 1 59 59 HIS HB3 H 1 3.177 0.02 . 2 . . 582 . A 59 HIS HB3 . 18225 1
690 . 1 1 59 59 HIS HD2 H 1 7.198 0.02 . 1 . . 579 . A 59 HIS HD2 . 18225 1
691 . 1 1 59 59 HIS HE1 H 1 8.563 0.02 . 1 . . 678 . A 59 HIS HE1 . 18225 1
692 . 1 1 59 59 HIS C C 13 174.183 0.2 . 1 . . 180 . A 59 HIS C . 18225 1
693 . 1 1 59 59 HIS CA C 13 55.281 0.2 . 1 . . 142 . A 59 HIS CA . 18225 1
694 . 1 1 59 59 HIS CB C 13 29.081 0.2 . 1 . . 265 . A 59 HIS CB . 18225 1
695 . 1 1 59 59 HIS CD2 C 13 120.035 0.2 . 1 . . 676 . A 59 HIS CD2 . 18225 1
696 . 1 1 59 59 HIS CE1 C 13 136.560 0.2 . 1 . . 677 . A 59 HIS CE1 . 18225 1
697 . 1 1 59 59 HIS N N 15 117.024 0.3 . 1 . . 75 . A 59 HIS N . 18225 1
698 . 1 1 60 60 HIS H H 1 8.507 0.02 . 1 . . 66 . A 60 HIS H . 18225 1
699 . 1 1 60 60 HIS HA H 1 4.630 0.02 . 1 . . 679 . A 60 HIS HA . 18225 1
700 . 1 1 60 60 HIS HB2 H 1 3.067 0.02 . 2 . . 680 . A 60 HIS HB2 . 18225 1
701 . 1 1 60 60 HIS HB3 H 1 3.183 0.02 . 2 . . 681 . A 60 HIS HB3 . 18225 1
702 . 1 1 60 60 HIS HD2 H 1 7.230 0.02 . 1 . . 682 . A 60 HIS HD2 . 18225 1
703 . 1 1 60 60 HIS HE1 H 1 8.555 0.02 . 1 . . 684 . A 60 HIS HE1 . 18225 1
704 . 1 1 60 60 HIS C C 13 174.157 0.2 . 1 . . 191 . A 60 HIS C . 18225 1
705 . 1 1 60 60 HIS CA C 13 55.340 0.2 . 1 . . 138 . A 60 HIS CA . 18225 1
706 . 1 1 60 60 HIS CB C 13 29.104 0.2 . 1 . . 264 . A 60 HIS CB . 18225 1
707 . 1 1 60 60 HIS CD2 C 13 119.972 0.2 . 1 . . 683 . A 60 HIS CD2 . 18225 1
708 . 1 1 60 60 HIS CE1 C 13 136.445 0.2 . 1 . . 685 . A 60 HIS CE1 . 18225 1
709 . 1 1 60 60 HIS N N 15 118.841 0.3 . 1 . . 67 . A 60 HIS N . 18225 1
710 . 1 1 61 61 HIS H H 1 8.613 0.02 . 1 . . 88 . A 61 HIS H . 18225 1
711 . 1 1 61 61 HIS HA H 1 4.654 0.02 . 1 . . 686 . A 61 HIS HA . 18225 1
712 . 1 1 61 61 HIS HB2 H 1 3.117 0.02 . 2 . . 669 . A 61 HIS HB2 . 18225 1
713 . 1 1 61 61 HIS HB3 H 1 3.175 0.02 . 2 . . 670 . A 61 HIS HB3 . 18225 1
714 . 1 1 61 61 HIS HD2 H 1 7.259 0.02 . 1 . . 668 . A 61 HIS HD2 . 18225 1
715 . 1 1 61 61 HIS HE1 H 1 8.566 0.02 . 1 . . 689 . A 61 HIS HE1 . 18225 1
716 . 1 1 61 61 HIS C C 13 174.095 0.2 . 1 . . 173 . A 61 HIS C . 18225 1
717 . 1 1 61 61 HIS CA C 13 55.329 0.2 . 1 . . 145 . A 61 HIS CA . 18225 1
718 . 1 1 61 61 HIS CB C 13 29.234 0.2 . 1 . . 258 . A 61 HIS CB . 18225 1
719 . 1 1 61 61 HIS CD2 C 13 119.880 0.2 . 1 . . 687 . A 61 HIS CD2 . 18225 1
720 . 1 1 61 61 HIS CE1 C 13 136.486 0.2 . 1 . . 688 . A 61 HIS CE1 . 18225 1
721 . 1 1 61 61 HIS N N 15 119.636 0.3 . 1 . . 89 . A 61 HIS N . 18225 1
722 . 1 1 62 62 HIS H H 1 8.680 0.02 . 1 . . 46 . A 62 HIS H . 18225 1
723 . 1 1 62 62 HIS HA H 1 4.660 0.02 . 1 . . 690 . A 62 HIS HA . 18225 1
724 . 1 1 62 62 HIS HB2 H 1 3.173 0.02 . 2 . . 691 . A 62 HIS HB2 . 18225 1
725 . 1 1 62 62 HIS HB3 H 1 3.108 0.02 . 2 . . 692 . A 62 HIS HB3 . 18225 1
726 . 1 1 62 62 HIS HD2 H 1 7.241 0.02 . 1 . . 693 . A 62 HIS HD2 . 18225 1
727 . 1 1 62 62 HIS HE1 H 1 8.564 0.02 . 1 . . 696 . A 62 HIS HE1 . 18225 1
728 . 1 1 62 62 HIS C C 13 173.928 0.2 . 1 . . 178 . A 62 HIS C . 18225 1
729 . 1 1 62 62 HIS CA C 13 55.356 0.2 . 1 . . 219 . A 62 HIS CA . 18225 1
730 . 1 1 62 62 HIS CB C 13 29.329 0.2 . 1 . . 257 . A 62 HIS CB . 18225 1
731 . 1 1 62 62 HIS CD2 C 13 119.981 0.2 . 1 . . 694 . A 62 HIS CD2 . 18225 1
732 . 1 1 62 62 HIS CE1 C 13 136.468 0.2 . 1 . . 695 . A 62 HIS CE1 . 18225 1
733 . 1 1 62 62 HIS N N 15 120.286 0.3 . 1 . . 47 . A 62 HIS N . 18225 1
734 . 1 1 63 63 HIS H H 1 8.541 0.02 . 1 . . 59 . A 63 HIS H . 18225 1
735 . 1 1 63 63 HIS HA H 1 4.649 0.02 . 1 . . 586 . A 63 HIS HA . 18225 1
736 . 1 1 63 63 HIS HB3 H 1 3.201 0.02 . 1 . . 587 . A 63 HIS HB3 . 18225 1
737 . 1 1 63 63 HIS HD2 H 1 7.251 0.02 . 1 . . 697 . A 63 HIS HD2 . 18225 1
738 . 1 1 63 63 HIS HE1 H 1 8.558 0.02 . 1 . . 700 . A 63 HIS HE1 . 18225 1
739 . 1 1 63 63 HIS C C 13 173.437 0.2 . 1 . . 167 . A 63 HIS C . 18225 1
740 . 1 1 63 63 HIS CA C 13 55.564 0.2 . 1 . . 214 . A 63 HIS CA . 18225 1
741 . 1 1 63 63 HIS CB C 13 29.483 0.2 . 1 . . 259 . A 63 HIS CB . 18225 1
742 . 1 1 63 63 HIS CD2 C 13 119.895 0.2 . 1 . . 698 . A 63 HIS CD2 . 18225 1
743 . 1 1 63 63 HIS CE1 C 13 136.503 0.2 . 1 . . 699 . A 63 HIS CE1 . 18225 1
744 . 1 1 63 63 HIS N N 15 120.408 0.3 . 1 . . 60 . A 63 HIS N . 18225 1
745 . 1 1 64 64 HIS H H 1 8.338 0.02 . 1 . . 29 . A 64 HIS H . 18225 1
746 . 1 1 64 64 HIS HA H 1 4.437 0.02 . 1 . . 583 . A 64 HIS HA . 18225 1
747 . 1 1 64 64 HIS HB2 H 1 3.122 0.02 . 2 . . 584 . A 64 HIS HB2 . 18225 1
748 . 1 1 64 64 HIS HB3 H 1 3.223 0.02 . 2 . . 585 . A 64 HIS HB3 . 18225 1
749 . 1 1 64 64 HIS HD2 H 1 7.288 0.02 . 1 . . 701 . A 64 HIS HD2 . 18225 1
750 . 1 1 64 64 HIS HE1 H 1 8.564 0.02 . 1 . . 703 . A 64 HIS HE1 . 18225 1
751 . 1 1 64 64 HIS CA C 13 57.027 0.2 . 1 . . 132 . A 64 HIS CA . 18225 1
752 . 1 1 64 64 HIS CB C 13 29.579 0.2 . 1 . . 237 . A 64 HIS CB . 18225 1
753 . 1 1 64 64 HIS CD2 C 13 120.387 0.2 . 1 . . 702 . A 64 HIS CD2 . 18225 1
754 . 1 1 64 64 HIS CE1 C 13 136.516 0.2 . 1 . . 704 . A 64 HIS CE1 . 18225 1
755 . 1 1 64 64 HIS N N 15 125.283 0.3 . 1 . . 30 . A 64 HIS N . 18225 1
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