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 26953
_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 0.05
_Assigned_chem_shift_list.Chem_shift_13C_err 0.1
_Assigned_chem_shift_list.Chem_shift_15N_err 0.1
_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' . . isotropic 26953 1
2 '3D CBCA(CO)NH' . . isotropic 26953 1
3 '3D C(CO)NH' . . isotropic 26953 1
4 '3D HNCO' . . isotropic 26953 1
5 '3D HN(CA)CO' . . isotropic 26953 1
6 '3D HNCACB' . . isotropic 26953 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_Analysis . . 26953 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 2 2 SER C C 13 174.419 0.1 . 1 . 518 . . 2 SER C . 26953 1
2 . 1 1 2 2 SER CA C 13 58.208 0.08 . 1 . 516 . . 2 SER CA . 26953 1
3 . 1 1 2 2 SER CB C 13 63.999 0.1 . 1 . 517 . . 2 SER CB . 26953 1
4 . 1 1 3 3 MET H H 1 8.541 0.003 . 1 . 19 . . 3 MET H . 26953 1
5 . 1 1 3 3 MET C C 13 175.952 0.003 . 1 . 515 . . 3 MET C . 26953 1
6 . 1 1 3 3 MET CA C 13 55.620 0.034 . 1 . 513 . . 3 MET CA . 26953 1
7 . 1 1 3 3 MET CB C 13 33.017 0.042 . 1 . 511 . . 3 MET CB . 26953 1
8 . 1 1 3 3 MET N N 15 122.466 0.007 . 1 . 20 . . 3 MET N . 26953 1
9 . 1 1 4 4 ARG H H 1 8.407 0.001 . 1 . 169 . . 4 ARG H . 26953 1
10 . 1 1 4 4 ARG C C 13 175.811 0.016 . 1 . 514 . . 4 ARG C . 26953 1
11 . 1 1 4 4 ARG CA C 13 56.015 0.083 . 1 . 512 . . 4 ARG CA . 26953 1
12 . 1 1 4 4 ARG CB C 13 30.781 0.02 . 1 . 510 . . 4 ARG CB . 26953 1
13 . 1 1 4 4 ARG N N 15 122.784 0.009 . 1 . 170 . . 4 ARG N . 26953 1
14 . 1 1 5 5 GLN H H 1 8.424 0.002 . 1 . 45 . . 5 GLN H . 26953 1
15 . 1 1 5 5 GLN C C 13 173.395 0.1 . 1 . 519 . . 5 GLN C . 26953 1
16 . 1 1 5 5 GLN CA C 13 53.626 0.1 . 1 . 520 . . 5 GLN CA . 26953 1
17 . 1 1 5 5 GLN CB C 13 29.120 0.1 . 1 . 521 . . 5 GLN CB . 26953 1
18 . 1 1 5 5 GLN N N 15 123.241 0.034 . 1 . 46 . . 5 GLN N . 26953 1
19 . 1 1 7 7 PRO C C 13 177.393 0.1 . 1 . 503 . . 7 PRO C . 26953 1
20 . 1 1 7 7 PRO CA C 13 63.233 0.01 . 1 . 501 . . 7 PRO CA . 26953 1
21 . 1 1 7 7 PRO CB C 13 32.067 0.1 . 1 . 500 . . 7 PRO CB . 26953 1
22 . 1 1 8 8 GLY H H 1 8.437 0.004 . 1 . 93 . . 8 GLY H . 26953 1
23 . 1 1 8 8 GLY C C 13 173.722 0.1 . 1 . 502 . . 8 GLY C . 26953 1
24 . 1 1 8 8 GLY CA C 13 45.242 0.1 . 1 . 499 . . 8 GLY CA . 26953 1
25 . 1 1 8 8 GLY N N 15 109.092 0.033 . 1 . 94 . . 8 GLY N . 26953 1
26 . 1 1 9 9 GLU H H 1 8.057 0.006 . 1 . 137 . . 9 GLU H . 26953 1
27 . 1 1 9 9 GLU C C 13 176.829 0.003 . 1 . 413 . . 9 GLU C . 26953 1
28 . 1 1 9 9 GLU CA C 13 56.946 0.04 . 1 . 411 . . 9 GLU CA . 26953 1
29 . 1 1 9 9 GLU CB C 13 30.341 0.041 . 1 . 498 . . 9 GLU CB . 26953 1
30 . 1 1 9 9 GLU N N 15 121.089 0.013 . 1 . 138 . . 9 GLU N . 26953 1
31 . 1 1 10 10 SER H H 1 8.369 0.001 . 1 . 153 . . 10 SER H . 26953 1
32 . 1 1 10 10 SER C C 13 174.323 0.007 . 1 . 412 . . 10 SER C . 26953 1
33 . 1 1 10 10 SER CA C 13 58.496 0.024 . 1 . 409 . . 10 SER CA . 26953 1
34 . 1 1 10 10 SER CB C 13 63.897 0.007 . 1 . 410 . . 10 SER CB . 26953 1
35 . 1 1 10 10 SER N N 15 115.898 0.013 . 1 . 154 . . 10 SER N . 26953 1
36 . 1 1 11 11 ASP H H 1 8.298 0.002 . 1 . 133 . . 11 ASP H . 26953 1
37 . 1 1 11 11 ASP C C 13 176.275 0.001 . 1 . 453 . . 11 ASP C . 26953 1
38 . 1 1 11 11 ASP CA C 13 54.585 0.016 . 1 . 451 . . 11 ASP CA . 26953 1
39 . 1 1 11 11 ASP CB C 13 41.099 0.021 . 1 . 452 . . 11 ASP CB . 26953 1
40 . 1 1 11 11 ASP N N 15 122.238 0.014 . 1 . 134 . . 11 ASP N . 26953 1
41 . 1 1 12 12 MET H H 1 8.189 0.001 . 1 . 157 . . 12 MET H . 26953 1
42 . 1 1 12 12 MET C C 13 175.890 0.016 . 1 . 454 . . 12 MET C . 26953 1
43 . 1 1 12 12 MET CA C 13 55.571 0.019 . 1 . 455 . . 12 MET CA . 26953 1
44 . 1 1 12 12 MET CB C 13 32.902 0.068 . 1 . 456 . . 12 MET CB . 26953 1
45 . 1 1 12 12 MET N N 15 120.369 0.018 . 1 . 158 . . 12 MET N . 26953 1
46 . 1 1 13 13 ALA H H 1 8.262 0.001 . 1 . 175 . . 13 ALA H . 26953 1
47 . 1 1 13 13 ALA C C 13 177.785 0.003 . 1 . 459 . . 13 ALA C . 26953 1
48 . 1 1 13 13 ALA CA C 13 52.661 0.027 . 1 . 458 . . 13 ALA CA . 26953 1
49 . 1 1 13 13 ALA CB C 13 19.207 0.026 . 1 . 457 . . 13 ALA CB . 26953 1
50 . 1 1 13 13 ALA N N 15 125.040 0.007 . 1 . 176 . . 13 ALA N . 26953 1
51 . 1 1 14 14 VAL H H 1 8.053 0.001 . 1 . 57 . . 14 VAL H . 26953 1
52 . 1 1 14 14 VAL C C 13 176.330 0.003 . 1 . 462 . . 14 VAL C . 26953 1
53 . 1 1 14 14 VAL CA C 13 62.321 0.019 . 1 . 461 . . 14 VAL CA . 26953 1
54 . 1 1 14 14 VAL CB C 13 32.812 0.039 . 1 . 460 . . 14 VAL CB . 26953 1
55 . 1 1 14 14 VAL N N 15 119.038 0.021 . 1 . 58 . . 14 VAL N . 26953 1
56 . 1 1 15 15 SER H H 1 8.283 0.001 . 1 . 7 . . 15 SER H . 26953 1
57 . 1 1 15 15 SER C C 13 174.573 0.003 . 1 . 465 . . 15 SER C . 26953 1
58 . 1 1 15 15 SER CA C 13 58.372 0.013 . 1 . 463 . . 15 SER CA . 26953 1
59 . 1 1 15 15 SER CB C 13 63.887 0.008 . 1 . 464 . . 15 SER CB . 26953 1
60 . 1 1 15 15 SER N N 15 118.798 0.026 . 1 . 8 . . 15 SER N . 26953 1
61 . 1 1 16 16 ASP H H 1 8.327 0.001 . 1 . 43 . . 16 ASP H . 26953 1
62 . 1 1 16 16 ASP C C 13 176.163 0.1 . 1 . 471 . . 16 ASP C . 26953 1
63 . 1 1 16 16 ASP CA C 13 54.657 0.1 . 1 . 469 . . 16 ASP CA . 26953 1
64 . 1 1 16 16 ASP CB C 13 41.082 0.1 . 1 . 470 . . 16 ASP CB . 26953 1
65 . 1 1 16 16 ASP N N 15 122.935 0.013 . 1 . 44 . . 16 ASP N . 26953 1
66 . 1 1 17 17 ALA H H 1 8.072 0.05 . 1 . 155 . . 17 ALA H . 26953 1
67 . 1 1 17 17 ALA C C 13 177.551 0.014 . 1 . 476 . . 17 ALA C . 26953 1
68 . 1 1 17 17 ALA CA C 13 52.786 0.002 . 1 . 474 . . 17 ALA CA . 26953 1
69 . 1 1 17 17 ALA CB C 13 19.167 0.021 . 1 . 472 . . 17 ALA CB . 26953 1
70 . 1 1 17 17 ALA N N 15 123.241 0.1 . 1 . 156 . . 17 ALA N . 26953 1
71 . 1 1 18 18 LEU H H 1 8.049 0.001 . 1 . 123 . . 18 LEU H . 26953 1
72 . 1 1 18 18 LEU C C 13 177.071 0.007 . 1 . 477 . . 18 LEU C . 26953 1
73 . 1 1 18 18 LEU CA C 13 54.861 0.019 . 1 . 475 . . 18 LEU CA . 26953 1
74 . 1 1 18 18 LEU CB C 13 42.213 0.04 . 1 . 473 . . 18 LEU CB . 26953 1
75 . 1 1 18 18 LEU N N 15 119.971 0.011 . 1 . 124 . . 18 LEU N . 26953 1
76 . 1 1 19 19 LEU H H 1 7.963 0.001 . 1 . 37 . . 19 LEU H . 26953 1
77 . 1 1 19 19 LEU C C 13 175.273 0.1 . 1 . 478 . . 19 LEU C . 26953 1
78 . 1 1 19 19 LEU CA C 13 53.210 0.1 . 1 . 479 . . 19 LEU CA . 26953 1
79 . 1 1 19 19 LEU CB C 13 41.875 0.1 . 1 . 480 . . 19 LEU CB . 26953 1
80 . 1 1 19 19 LEU N N 15 123.660 0.033 . 1 . 38 . . 19 LEU N . 26953 1
81 . 1 1 20 20 PRO C C 13 176.853 0.004 . 1 . 509 . . 20 PRO C . 26953 1
82 . 1 1 20 20 PRO CA C 13 63.278 0.1 . 1 . 506 . . 20 PRO CA . 26953 1
83 . 1 1 20 20 PRO CB C 13 32.002 0.026 . 1 . 507 . . 20 PRO CB . 26953 1
84 . 1 1 21 21 SER H H 1 8.208 0.0 . 1 . 59 . . 21 SER H . 26953 1
85 . 1 1 21 21 SER C C 13 174.459 0.006 . 1 . 508 . . 21 SER C . 26953 1
86 . 1 1 21 21 SER CA C 13 58.290 0.009 . 1 . 504 . . 21 SER CA . 26953 1
87 . 1 1 21 21 SER CB C 13 63.761 0.058 . 1 . 505 . . 21 SER CB . 26953 1
88 . 1 1 21 21 SER N N 15 114.940 0.007 . 1 . 60 . . 21 SER N . 26953 1
89 . 1 1 22 22 PHE H H 1 8.152 0.002 . 1 . 588 . . 22 PHE H . 26953 1
90 . 1 1 22 22 PHE C C 13 175.801 0.023 . 1 . 497 . . 22 PHE C . 26953 1
91 . 1 1 22 22 PHE CA C 13 57.968 0.047 . 1 . 495 . . 22 PHE CA . 26953 1
92 . 1 1 22 22 PHE CB C 13 39.596 0.01 . 1 . 496 . . 22 PHE CB . 26953 1
93 . 1 1 22 22 PHE N N 15 121.668 0.014 . 1 . 589 . . 22 PHE N . 26953 1
94 . 1 1 23 23 SER H H 1 8.173 0.002 . 1 . 127 . . 23 SER H . 26953 1
95 . 1 1 23 23 SER C C 13 174.598 0.006 . 1 . 466 . . 23 SER C . 26953 1
96 . 1 1 23 23 SER CA C 13 58.379 0.053 . 1 . 468 . . 23 SER CA . 26953 1
97 . 1 1 23 23 SER CB C 13 63.858 0.003 . 1 . 467 . . 23 SER CB . 26953 1
98 . 1 1 23 23 SER N N 15 116.534 0.025 . 1 . 128 . . 23 SER N . 26953 1
99 . 1 1 24 24 THR H H 1 8.048 0.001 . 1 . 149 . . 24 THR H . 26953 1
100 . 1 1 24 24 THR C C 13 174.381 0.027 . 1 . 492 . . 24 THR C . 26953 1
101 . 1 1 24 24 THR CA C 13 62.136 0.048 . 1 . 493 . . 24 THR CA . 26953 1
102 . 1 1 24 24 THR CB C 13 69.562 0.002 . 1 . 494 . . 24 THR CB . 26953 1
103 . 1 1 24 24 THR N N 15 115.508 0.02 . 1 . 150 . . 24 THR N . 26953 1
104 . 1 1 25 25 PHE H H 1 8.108 0.001 . 1 . 151 . . 25 PHE H . 26953 1
105 . 1 1 25 25 PHE C C 13 175.520 0.006 . 1 . 489 . . 25 PHE C . 26953 1
106 . 1 1 25 25 PHE CA C 13 57.849 0.029 . 1 . 490 . . 25 PHE CA . 26953 1
107 . 1 1 25 25 PHE CB C 13 39.553 0.01 . 1 . 491 . . 25 PHE CB . 26953 1
108 . 1 1 25 25 PHE N N 15 121.783 0.031 . 1 . 152 . . 25 PHE N . 26953 1
109 . 1 1 26 26 ALA H H 1 8.168 0.0 . 1 . 187 . . 26 ALA H . 26953 1
110 . 1 1 26 26 ALA C C 13 177.280 0.002 . 1 . 488 . . 26 ALA C . 26953 1
111 . 1 1 26 26 ALA CA C 13 52.523 0.034 . 1 . 482 . . 26 ALA CA . 26953 1
112 . 1 1 26 26 ALA CB C 13 19.355 0.026 . 1 . 481 . . 26 ALA CB . 26953 1
113 . 1 1 26 26 ALA N N 15 125.116 0.023 . 1 . 188 . . 26 ALA N . 26953 1
114 . 1 1 27 27 SER H H 1 8.133 0.001 . 1 . 165 . . 27 SER H . 26953 1
115 . 1 1 27 27 SER C C 13 174.619 0.004 . 1 . 485 . . 27 SER C . 26953 1
116 . 1 1 27 27 SER CA C 13 58.282 0.004 . 1 . 483 . . 27 SER CA . 26953 1
117 . 1 1 27 27 SER CB C 13 64.008 0.014 . 1 . 484 . . 27 SER CB . 26953 1
118 . 1 1 27 27 SER N N 15 114.670 0.009 . 1 . 166 . . 27 SER N . 26953 1
119 . 1 1 28 28 GLY H H 1 8.158 0.001 . 1 . 191 . . 28 GLY H . 26953 1
120 . 1 1 28 28 GLY C C 13 171.951 0.1 . 1 . 487 . . 28 GLY C . 26953 1
121 . 1 1 28 28 GLY CA C 13 44.793 0.1 . 1 . 486 . . 28 GLY CA . 26953 1
122 . 1 1 28 28 GLY N N 15 110.383 0.008 . 1 . 192 . . 28 GLY N . 26953 1
123 . 1 1 29 29 PRO C C 13 177.173 0.002 . 1 . 450 . . 29 PRO C . 26953 1
124 . 1 1 29 29 PRO CA C 13 63.585 0.008 . 1 . 449 . . 29 PRO CA . 26953 1
125 . 1 1 29 29 PRO CB C 13 32.064 0.001 . 1 . 448 . . 29 PRO CB . 26953 1
126 . 1 1 30 30 ALA H H 1 8.412 0.001 . 1 . 41 . . 30 ALA H . 26953 1
127 . 1 1 30 30 ALA C C 13 178.474 0.005 . 1 . 445 . . 30 ALA C . 26953 1
128 . 1 1 30 30 ALA CA C 13 52.851 0.085 . 1 . 446 . . 30 ALA CA . 26953 1
129 . 1 1 30 30 ALA CB C 13 19.160 0.016 . 1 . 447 . . 30 ALA CB . 26953 1
130 . 1 1 30 30 ALA N N 15 123.474 0.01 . 1 . 42 . . 30 ALA N . 26953 1
131 . 1 1 31 31 GLY H H 1 8.301 0.002 . 1 . 21 . . 31 GLY H . 26953 1
132 . 1 1 31 31 GLY C C 13 174.600 0.012 . 1 . 443 . . 31 GLY C . 26953 1
133 . 1 1 31 31 GLY CA C 13 45.560 0.034 . 1 . 444 . . 31 GLY CA . 26953 1
134 . 1 1 31 31 GLY N N 15 107.879 0.025 . 1 . 22 . . 31 GLY N . 26953 1
135 . 1 1 32 32 ARG H H 1 8.113 0.001 . 1 . 105 . . 32 ARG H . 26953 1
136 . 1 1 32 32 ARG C C 13 176.615 0.02 . 1 . 440 . . 32 ARG C . 26953 1
137 . 1 1 32 32 ARG CA C 13 56.562 0.029 . 1 . 441 . . 32 ARG CA . 26953 1
138 . 1 1 32 32 ARG CB C 13 30.739 0.036 . 1 . 442 . . 32 ARG CB . 26953 1
139 . 1 1 32 32 ARG N N 15 120.462 0.022 . 1 . 106 . . 32 ARG N . 26953 1
140 . 1 1 33 33 GLU H H 1 8.543 0.001 . 1 . 115 . . 33 GLU H . 26953 1
141 . 1 1 33 33 GLU C C 13 176.824 0.009 . 1 . 438 . . 33 GLU C . 26953 1
142 . 1 1 33 33 GLU CA C 13 57.323 0.043 . 1 . 439 . . 33 GLU CA . 26953 1
143 . 1 1 33 33 GLU CB C 13 29.960 0.001 . 1 . 437 . . 33 GLU CB . 26953 1
144 . 1 1 33 33 GLU N N 15 121.217 0.027 . 1 . 116 . . 33 GLU N . 26953 1
145 . 1 1 34 34 LYS H H 1 8.297 0.001 . 1 . 97 . . 34 LYS H . 26953 1
146 . 1 1 34 34 LYS C C 13 176.872 0.007 . 1 . 436 . . 34 LYS C . 26953 1
147 . 1 1 34 34 LYS CA C 13 56.908 0.052 . 1 . 434 . . 34 LYS CA . 26953 1
148 . 1 1 34 34 LYS CB C 13 32.877 0.03 . 1 . 435 . . 34 LYS CB . 26953 1
149 . 1 1 34 34 LYS N N 15 121.537 0.029 . 1 . 98 . . 34 LYS N . 26953 1
150 . 1 1 35 35 THR H H 1 8.031 0.001 . 1 . 125 . . 35 THR H . 26953 1
151 . 1 1 35 35 THR C C 13 174.539 0.017 . 1 . 433 . . 35 THR C . 26953 1
152 . 1 1 35 35 THR CA C 13 62.285 0.03 . 1 . 431 . . 35 THR CA . 26953 1
153 . 1 1 35 35 THR CB C 13 69.764 0.026 . 1 . 432 . . 35 THR CB . 26953 1
154 . 1 1 35 35 THR N N 15 114.744 0.017 . 1 . 126 . . 35 THR N . 26953 1
155 . 1 1 36 36 LEU H H 1 8.205 0.001 . 1 . 39 . . 36 LEU H . 26953 1
156 . 1 1 36 36 LEU C C 13 177.298 0.007 . 1 . 428 . . 36 LEU C . 26953 1
157 . 1 1 36 36 LEU CA C 13 55.487 0.008 . 1 . 429 . . 36 LEU CA . 26953 1
158 . 1 1 36 36 LEU CB C 13 42.382 0.018 . 1 . 430 . . 36 LEU CB . 26953 1
159 . 1 1 36 36 LEU N N 15 124.371 0.015 . 1 . 40 . . 36 LEU N . 26953 1
160 . 1 1 37 37 ARG H H 1 8.267 0.001 . 1 . 205 . . 37 ARG H . 26953 1
161 . 1 1 37 37 ARG C C 13 176.230 0.004 . 1 . 427 . . 37 ARG C . 26953 1
162 . 1 1 37 37 ARG CA C 13 56.244 0.058 . 1 . 426 . . 37 ARG CA . 26953 1
163 . 1 1 37 37 ARG CB C 13 30.765 0.031 . 1 . 425 . . 37 ARG CB . 26953 1
164 . 1 1 37 37 ARG N N 15 121.696 0.027 . 1 . 206 . . 37 ARG N . 26953 1
165 . 1 1 38 38 GLN H H 1 8.327 0.002 . 1 . 147 . . 38 GLN H . 26953 1
166 . 1 1 38 38 GLN C C 13 175.653 0.008 . 1 . 422 . . 38 GLN C . 26953 1
167 . 1 1 38 38 GLN CA C 13 55.832 0.036 . 1 . 423 . . 38 GLN CA . 26953 1
168 . 1 1 38 38 GLN CB C 13 29.621 0.03 . 1 . 424 . . 38 GLN CB . 26953 1
169 . 1 1 38 38 GLN N N 15 121.559 0.023 . 1 . 148 . . 38 GLN N . 26953 1
170 . 1 1 39 39 ALA H H 1 8.365 0.001 . 1 . 67 . . 39 ALA H . 26953 1
171 . 1 1 39 39 ALA C C 13 178.027 0.007 . 1 . 421 . . 39 ALA C . 26953 1
172 . 1 1 39 39 ALA CA C 13 52.783 0.008 . 1 . 419 . . 39 ALA CA . 26953 1
173 . 1 1 39 39 ALA CB C 13 19.274 0.021 . 1 . 420 . . 39 ALA CB . 26953 1
174 . 1 1 39 39 ALA N N 15 125.486 0.02 . 1 . 68 . . 39 ALA N . 26953 1
175 . 1 1 40 40 GLY H H 1 8.332 0.001 . 1 . 81 . . 40 GLY H . 26953 1
176 . 1 1 40 40 GLY C C 13 173.391 0.003 . 1 . 418 . . 40 GLY C . 26953 1
177 . 1 1 40 40 GLY CA C 13 45.006 0.026 . 1 . 415 . . 40 GLY CA . 26953 1
178 . 1 1 40 40 GLY N N 15 108.131 0.019 . 1 . 82 . . 40 GLY N . 26953 1
179 . 1 1 41 41 ALA H H 1 8.077 0.001 . 1 . 55 . . 41 ALA H . 26953 1
180 . 1 1 41 41 ALA C C 13 175.774 0.1 . 1 . 417 . . 41 ALA C . 26953 1
181 . 1 1 41 41 ALA CA C 13 50.569 0.1 . 1 . 414 . . 41 ALA CA . 26953 1
182 . 1 1 41 41 ALA CB C 13 18.391 0.1 . 1 . 416 . . 41 ALA CB . 26953 1
183 . 1 1 41 41 ALA N N 15 124.587 0.009 . 1 . 56 . . 41 ALA N . 26953 1
184 . 1 1 42 42 PRO C C 13 176.746 0.001 . 1 . 543 . . 42 PRO C . 26953 1
185 . 1 1 42 42 PRO CA C 13 63.441 0.1 . 1 . 544 . . 42 PRO CA . 26953 1
186 . 1 1 42 42 PRO CB C 13 31.999 0.1 . 1 . 545 . . 42 PRO CB . 26953 1
187 . 1 1 43 43 ASN H H 1 8.448 0.001 . 1 . 113 . . 43 ASN H . 26953 1
188 . 1 1 43 43 ASN C C 13 175.106 0.025 . 1 . 542 . . 43 ASN C . 26953 1
189 . 1 1 43 43 ASN CA C 13 53.298 0.1 . 1 . 540 . . 43 ASN CA . 26953 1
190 . 1 1 43 43 ASN CB C 13 38.748 0.007 . 1 . 541 . . 43 ASN CB . 26953 1
191 . 1 1 43 43 ASN N N 15 118.043 0.007 . 1 . 114 . . 43 ASN N . 26953 1
192 . 1 1 44 44 ASN H H 1 8.363 0.001 . 1 . 95 . . 44 ASN H . 26953 1
193 . 1 1 44 44 ASN C C 13 175.646 0.1 . 1 . 537 . . 44 ASN C . 26953 1
194 . 1 1 44 44 ASN CA C 13 53.604 0.035 . 1 . 538 . . 44 ASN CA . 26953 1
195 . 1 1 44 44 ASN CB C 13 38.828 0.019 . 1 . 539 . . 44 ASN CB . 26953 1
196 . 1 1 44 44 ASN N N 15 119.060 0.008 . 1 . 96 . . 44 ASN N . 26953 1
197 . 1 1 45 45 ARG H H 1 8.236 0.002 . 1 . 183 . . 45 ARG H . 26953 1
198 . 1 1 45 45 ARG C C 13 176.570 0.001 . 1 . 536 . . 45 ARG C . 26953 1
199 . 1 1 45 45 ARG CA C 13 57.046 0.001 . 1 . 534 . . 45 ARG CA . 26953 1
200 . 1 1 45 45 ARG CB C 13 30.166 0.001 . 1 . 535 . . 45 ARG CB . 26953 1
201 . 1 1 45 45 ARG N N 15 120.960 0.031 . 1 . 184 . . 45 ARG N . 26953 1
202 . 1 1 46 46 TRP H H 1 8.023 0.001 . 1 . 135 . . 46 TRP H . 26953 1
203 . 1 1 46 46 TRP C C 13 176.574 0.004 . 1 . 533 . . 46 TRP C . 26953 1
204 . 1 1 46 46 TRP CA C 13 58.219 0.004 . 1 . 532 . . 46 TRP CA . 26953 1
205 . 1 1 46 46 TRP CB C 13 29.102 0.04 . 1 . 531 . . 46 TRP CB . 26953 1
206 . 1 1 46 46 TRP N N 15 120.715 0.017 . 1 . 136 . . 46 TRP N . 26953 1
207 . 1 1 47 47 ARG H H 1 7.725 0.0 . 1 . 103 . . 47 ARG H . 26953 1
208 . 1 1 47 47 ARG C C 13 176.923 0.006 . 1 . 530 . . 47 ARG C . 26953 1
209 . 1 1 47 47 ARG CA C 13 57.209 0.021 . 1 . 529 . . 47 ARG CA . 26953 1
210 . 1 1 47 47 ARG CB C 13 30.464 0.003 . 1 . 528 . . 47 ARG CB . 26953 1
211 . 1 1 47 47 ARG N N 15 121.113 0.032 . 1 . 104 . . 47 ARG N . 26953 1
212 . 1 1 48 48 GLU H H 1 8.172 0.001 . 1 . 89 . . 48 GLU H . 26953 1
213 . 1 1 48 48 GLU C C 13 177.404 0.001 . 1 . 523 . . 48 GLU C . 26953 1
214 . 1 1 48 48 GLU CA C 13 57.591 0.085 . 1 . 525 . . 48 GLU CA . 26953 1
215 . 1 1 48 48 GLU CB C 13 30.041 0.068 . 1 . 526 . . 48 GLU CB . 26953 1
216 . 1 1 48 48 GLU N N 15 121.079 0.018 . 1 . 90 . . 48 GLU N . 26953 1
217 . 1 1 49 49 GLU H H 1 8.394 0.001 . 1 . 11 . . 49 GLU H . 26953 1
218 . 1 1 49 49 GLU C C 13 177.402 0.047 . 1 . 522 . . 49 GLU C . 26953 1
219 . 1 1 49 49 GLU CA C 13 57.608 0.02 . 1 . 524 . . 49 GLU CA . 26953 1
220 . 1 1 49 49 GLU CB C 13 29.898 0.04 . 1 . 527 . . 49 GLU CB . 26953 1
221 . 1 1 49 49 GLU N N 15 120.911 0.011 . 1 . 12 . . 49 GLU N . 26953 1
222 . 1 1 50 50 LEU H H 1 8.055 0.002 . 1 . 9 . . 50 LEU H . 26953 1
223 . 1 1 50 50 LEU C C 13 178.186 0.016 . 1 . 558 . . 50 LEU C . 26953 1
224 . 1 1 50 50 LEU CA C 13 56.062 0.051 . 1 . 560 . . 50 LEU CA . 26953 1
225 . 1 1 50 50 LEU CB C 13 42.011 0.008 . 1 . 559 . . 50 LEU CB . 26953 1
226 . 1 1 50 50 LEU N N 15 121.297 0.038 . 1 . 10 . . 50 LEU N . 26953 1
227 . 1 1 51 51 SER H H 1 8.047 0.005 . 1 . 553 . . 51 SER H . 26953 1
228 . 1 1 51 51 SER C C 13 175.020 0.1 . 1 . 557 . . 51 SER C . 26953 1
229 . 1 1 51 51 SER CA C 13 59.630 0.1 . 1 . 555 . . 51 SER CA . 26953 1
230 . 1 1 51 51 SER CB C 13 63.387 0.1 . 1 . 556 . . 51 SER CB . 26953 1
231 . 1 1 51 51 SER N N 15 114.722 0.042 . 1 . 554 . . 51 SER N . 26953 1
232 . 1 1 52 52 HIS C C 13 175.242 0.1 . 1 . 576 . . 52 HIS C . 26953 1
233 . 1 1 52 52 HIS CA C 13 56.374 0.1 . 1 . 575 . . 52 HIS CA . 26953 1
234 . 1 1 52 52 HIS CB C 13 29.734 0.056 . 1 . 574 . . 52 HIS CB . 26953 1
235 . 1 1 53 53 MET H H 1 7.962 0.003 . 1 . 83 . . 53 MET H . 26953 1
236 . 1 1 53 53 MET C C 13 176.035 0.1 . 1 . 577 . . 53 MET C . 26953 1
237 . 1 1 53 53 MET CA C 13 56.015 0.1 . 1 . 570 . . 53 MET CA . 26953 1
238 . 1 1 53 53 MET CB C 13 32.939 0.001 . 1 . 569 . . 53 MET CB . 26953 1
239 . 1 1 53 53 MET CG C 13 32.044 0.1 . 1 . 573 . . 53 MET CG . 26953 1
240 . 1 1 53 53 MET N N 15 119.802 0.011 . 1 . 84 . . 53 MET N . 26953 1
241 . 1 1 54 54 LYS H H 1 8.200 0.004 . 1 . 571 . . 54 LYS H . 26953 1
242 . 1 1 54 54 LYS C C 13 176.037 0.1 . 1 . 578 . . 54 LYS C . 26953 1
243 . 1 1 54 54 LYS CA C 13 56.244 0.1 . 1 . 580 . . 54 LYS CA . 26953 1
244 . 1 1 54 54 LYS CB C 13 32.955 0.1 . 1 . 579 . . 54 LYS CB . 26953 1
245 . 1 1 54 54 LYS N N 15 121.637 0.009 . 1 . 572 . . 54 LYS N . 26953 1
246 . 1 1 55 55 ARG H H 1 8.183 0.004 . 1 . 139 . . 55 ARG H . 26953 1
247 . 1 1 55 55 ARG C C 13 175.753 0.001 . 1 . 583 . . 55 ARG C . 26953 1
248 . 1 1 55 55 ARG CA C 13 55.621 0.002 . 1 . 581 . . 55 ARG CA . 26953 1
249 . 1 1 55 55 ARG CB C 13 31.077 0.015 . 1 . 582 . . 55 ARG CB . 26953 1
250 . 1 1 55 55 ARG N N 15 121.619 0.018 . 1 . 140 . . 55 ARG N . 26953 1
251 . 1 1 56 56 LEU H H 1 8.276 0.001 . 1 . 584 . . 56 LEU H . 26953 1
252 . 1 1 56 56 LEU C C 13 174.637 0.1 . 1 . 587 . . 56 LEU C . 26953 1
253 . 1 1 56 56 LEU CB C 13 41.690 0.1 . 1 . 586 . . 56 LEU CB . 26953 1
254 . 1 1 56 56 LEU N N 15 124.981 0.017 . 1 . 585 . . 56 LEU N . 26953 1
255 . 1 1 58 58 PRO C C 13 176.523 0.009 . 1 . 601 . . 58 PRO C . 26953 1
256 . 1 1 58 58 PRO CA C 13 62.879 0.009 . 1 . 599 . . 58 PRO CA . 26953 1
257 . 1 1 58 58 PRO CB C 13 32.017 0.007 . 1 . 597 . . 58 PRO CB . 26953 1
258 . 1 1 59 59 VAL H H 1 8.104 0.002 . 1 . 107 . . 59 VAL H . 26953 1
259 . 1 1 59 59 VAL C C 13 175.809 0.006 . 1 . 600 . . 59 VAL C . 26953 1
260 . 1 1 59 59 VAL CA C 13 62.148 0.015 . 1 . 598 . . 59 VAL CA . 26953 1
261 . 1 1 59 59 VAL CB C 13 32.811 0.056 . 1 . 596 . . 59 VAL CB . 26953 1
262 . 1 1 59 59 VAL N N 15 120.238 0.027 . 1 . 108 . . 59 VAL N . 26953 1
263 . 1 1 60 60 LEU H H 1 8.340 0.0 . 1 . 602 . . 60 LEU H . 26953 1
264 . 1 1 60 60 LEU C C 13 174.946 0.1 . 1 . 604 . . 60 LEU C . 26953 1
265 . 1 1 60 60 LEU CA C 13 52.554 0.1 . 1 . 606 . . 60 LEU CA . 26953 1
266 . 1 1 60 60 LEU CB C 13 41.990 0.1 . 1 . 605 . . 60 LEU CB . 26953 1
267 . 1 1 60 60 LEU N N 15 127.638 0.012 . 1 . 603 . . 60 LEU N . 26953 1
268 . 1 1 61 61 PRO C C 13 177.482 0.0 . 1 . 549 . . 61 PRO C . 26953 1
269 . 1 1 61 61 PRO CA C 13 63.314 0.017 . 1 . 547 . . 61 PRO CA . 26953 1
270 . 1 1 61 61 PRO CB C 13 32.049 0.013 . 1 . 546 . . 61 PRO CB . 26953 1
271 . 1 1 62 62 GLY H H 1 8.498 0.001 . 1 . 143 . . 62 GLY H . 26953 1
272 . 1 1 62 62 GLY C C 13 174.331 0.002 . 1 . 548 . . 62 GLY C . 26953 1
273 . 1 1 62 62 GLY CA C 13 45.200 0.013 . 1 . 378 . . 62 GLY CA . 26953 1
274 . 1 1 62 62 GLY N N 15 109.280 0.015 . 1 . 144 . . 62 GLY N . 26953 1
275 . 1 1 63 63 ARG H H 1 8.235 0.001 . 1 . 141 . . 63 ARG H . 26953 1
276 . 1 1 63 63 ARG C C 13 176.825 0.1 . 1 . 550 . . 63 ARG C . 26953 1
277 . 1 1 63 63 ARG CA C 13 57.996 0.1 . 1 . 551 . . 63 ARG CA . 26953 1
278 . 1 1 63 63 ARG CB C 13 30.497 0.1 . 1 . 552 . . 63 ARG CB . 26953 1
279 . 1 1 63 63 ARG N N 15 120.467 0.007 . 1 . 142 . . 63 ARG N . 26953 1
280 . 1 1 64 64 PRO C C 13 176.588 0.012 . 1 . 566 . . 64 PRO C . 26953 1
281 . 1 1 64 64 PRO CA C 13 63.357 0.024 . 1 . 564 . . 64 PRO CA . 26953 1
282 . 1 1 64 64 PRO CB C 13 31.952 0.023 . 1 . 563 . . 64 PRO CB . 26953 1
283 . 1 1 65 65 TYR H H 1 8.078 0.002 . 1 . 101 . . 65 TYR H . 26953 1
284 . 1 1 65 65 TYR C C 13 175.387 0.011 . 1 . 565 . . 65 TYR C . 26953 1
285 . 1 1 65 65 TYR CA C 13 57.867 0.015 . 1 . 562 . . 65 TYR CA . 26953 1
286 . 1 1 65 65 TYR CB C 13 38.670 0.1 . 1 . 561 . . 65 TYR CB . 26953 1
287 . 1 1 65 65 TYR N N 15 119.478 0.018 . 1 . 102 . . 65 TYR N . 26953 1
288 . 1 1 66 66 ASP H H 1 8.074 0.001 . 1 . 171 . . 66 ASP H . 26953 1
289 . 1 1 66 66 ASP C C 13 176.126 0.014 . 1 . 408 . . 66 ASP C . 26953 1
290 . 1 1 66 66 ASP CA C 13 54.271 0.002 . 1 . 568 . . 66 ASP CA . 26953 1
291 . 1 1 66 66 ASP CB C 13 41.218 0.084 . 1 . 567 . . 66 ASP CB . 26953 1
292 . 1 1 66 66 ASP N N 15 121.939 0.028 . 1 . 172 . . 66 ASP N . 26953 1
293 . 1 1 67 67 LEU H H 1 8.067 0.001 . 1 . 209 . . 67 LEU H . 26953 1
294 . 1 1 67 67 LEU C C 13 177.482 0.008 . 1 . 405 . . 67 LEU C . 26953 1
295 . 1 1 67 67 LEU CA C 13 55.761 0.011 . 1 . 406 . . 67 LEU CA . 26953 1
296 . 1 1 67 67 LEU CB C 13 42.240 0.088 . 1 . 407 . . 67 LEU CB . 26953 1
297 . 1 1 67 67 LEU N N 15 123.215 0.024 . 1 . 210 . . 67 LEU N . 26953 1
298 . 1 1 68 68 ALA H H 1 8.199 0.001 . 1 . 131 . . 68 ALA H . 26953 1
299 . 1 1 68 68 ALA C C 13 177.778 0.003 . 1 . 402 . . 68 ALA C . 26953 1
300 . 1 1 68 68 ALA CA C 13 52.904 0.001 . 1 . 403 . . 68 ALA CA . 26953 1
301 . 1 1 68 68 ALA CB C 13 18.935 0.0 . 1 . 404 . . 68 ALA CB . 26953 1
302 . 1 1 68 68 ALA N N 15 123.631 0.01 . 1 . 132 . . 68 ALA N . 26953 1
303 . 1 1 69 69 ALA H H 1 7.963 0.003 . 1 . 211 . . 69 ALA H . 26953 1
304 . 1 1 69 69 ALA C C 13 177.658 0.013 . 1 . 399 . . 69 ALA C . 26953 1
305 . 1 1 69 69 ALA CA C 13 52.651 0.008 . 1 . 400 . . 69 ALA CA . 26953 1
306 . 1 1 69 69 ALA CB C 13 19.174 0.001 . 1 . 401 . . 69 ALA CB . 26953 1
307 . 1 1 69 69 ALA N N 15 122.297 0.014 . 1 . 212 . . 69 ALA N . 26953 1
308 . 1 1 70 70 ALA H H 1 8.104 0.001 . 1 . 261 . . 70 ALA H . 26953 1
309 . 1 1 70 70 ALA C C 13 177.889 0.001 . 1 . 396 . . 70 ALA C . 26953 1
310 . 1 1 70 70 ALA CA C 13 52.698 0.03 . 1 . 397 . . 70 ALA CA . 26953 1
311 . 1 1 70 70 ALA CB C 13 19.283 0.049 . 1 . 398 . . 70 ALA CB . 26953 1
312 . 1 1 70 70 ALA N N 15 122.437 0.013 . 1 . 262 . . 70 ALA N . 26953 1
313 . 1 1 71 71 THR H H 1 8.093 0.001 . 1 . 77 . . 71 THR H . 26953 1
314 . 1 1 71 71 THR C C 13 174.459 0.004 . 1 . 395 . . 71 THR C . 26953 1
315 . 1 1 71 71 THR CA C 13 62.028 0.026 . 1 . 393 . . 71 THR CA . 26953 1
316 . 1 1 71 71 THR CB C 13 69.875 0.008 . 1 . 394 . . 71 THR CB . 26953 1
317 . 1 1 71 71 THR N N 15 112.942 0.006 . 1 . 78 . . 71 THR N . 26953 1
318 . 1 1 72 72 VAL H H 1 8.052 0.001 . 1 . 61 . . 72 VAL H . 26953 1
319 . 1 1 72 72 VAL C C 13 175.776 0.004 . 1 . 390 . . 72 VAL C . 26953 1
320 . 1 1 72 72 VAL CA C 13 62.134 0.029 . 1 . 391 . . 72 VAL CA . 26953 1
321 . 1 1 72 72 VAL CB C 13 32.873 0.017 . 1 . 392 . . 72 VAL CB . 26953 1
322 . 1 1 72 72 VAL N N 15 122.191 0.008 . 1 . 62 . . 72 VAL N . 26953 1
323 . 1 1 73 73 ALA H H 1 8.379 0.001 . 1 . 201 . . 73 ALA H . 26953 1
324 . 1 1 73 73 ALA C C 13 177.908 0.016 . 1 . 387 . . 73 ALA C . 26953 1
325 . 1 1 73 73 ALA CA C 13 52.690 0.015 . 1 . 388 . . 73 ALA CA . 26953 1
326 . 1 1 73 73 ALA CB C 13 19.294 0.037 . 1 . 389 . . 73 ALA CB . 26953 1
327 . 1 1 73 73 ALA N N 15 127.666 0.018 . 1 . 202 . . 73 ALA N . 26953 1
328 . 1 1 74 74 THR H H 1 8.041 0.001 . 1 . 73 . . 74 THR H . 26953 1
329 . 1 1 74 74 THR C C 13 174.463 0.0 . 1 . 384 . . 74 THR C . 26953 1
330 . 1 1 74 74 THR CA C 13 62.043 0.021 . 1 . 385 . . 74 THR CA . 26953 1
331 . 1 1 74 74 THR CB C 13 69.793 0.003 . 1 . 386 . . 74 THR CB . 26953 1
332 . 1 1 74 74 THR N N 15 113.413 0.031 . 1 . 74 . . 74 THR N . 26953 1
333 . 1 1 75 75 ASP H H 1 8.323 0.001 . 1 . 47 . . 75 ASP H . 26953 1
334 . 1 1 75 75 ASP C C 13 176.474 0.008 . 1 . 383 . . 75 ASP C . 26953 1
335 . 1 1 75 75 ASP CA C 13 54.495 0.033 . 1 . 381 . . 75 ASP CA . 26953 1
336 . 1 1 75 75 ASP CB C 13 40.942 0.004 . 1 . 382 . . 75 ASP CB . 26953 1
337 . 1 1 75 75 ASP N N 15 122.243 0.043 . 1 . 48 . . 75 ASP N . 26953 1
338 . 1 1 76 76 LEU H H 1 8.170 0.001 . 1 . 17 . . 76 LEU H . 26953 1
339 . 1 1 76 76 LEU C C 13 178.004 0.007 . 1 . 380 . . 76 LEU C . 26953 1
340 . 1 1 76 76 LEU CA C 13 55.785 0.015 . 1 . 379 . . 76 LEU CA . 26953 1
341 . 1 1 76 76 LEU CB C 13 42.345 0.007 . 1 . 377 . . 76 LEU CB . 26953 1
342 . 1 1 76 76 LEU N N 15 122.150 0.018 . 1 . 18 . . 76 LEU N . 26953 1
343 . 1 1 77 77 GLU H H 1 8.353 0.001 . 1 . 87 . . 77 GLU H . 26953 1
344 . 1 1 77 77 GLU C C 13 176.993 0.012 . 1 . 374 . . 77 GLU C . 26953 1
345 . 1 1 77 77 GLU CA C 13 57.078 0.042 . 1 . 375 . . 77 GLU CA . 26953 1
346 . 1 1 77 77 GLU CB C 13 30.024 0.009 . 1 . 376 . . 77 GLU CB . 26953 1
347 . 1 1 77 77 GLU N N 15 120.607 0.017 . 1 . 88 . . 77 GLU N . 26953 1
348 . 1 1 78 78 SER H H 1 8.237 0.0 . 1 . 207 . . 78 SER H . 26953 1
349 . 1 1 78 78 SER C C 13 175.341 0.009 . 1 . 373 . . 78 SER C . 26953 1
350 . 1 1 78 78 SER CA C 13 58.737 0.027 . 1 . 371 . . 78 SER CA . 26953 1
351 . 1 1 78 78 SER CB C 13 63.714 0.007 . 1 . 372 . . 78 SER CB . 26953 1
352 . 1 1 78 78 SER N N 15 115.992 0.034 . 1 . 208 . . 78 SER N . 26953 1
353 . 1 1 79 79 GLY H H 1 8.369 0.001 . 1 . 35 . . 79 GLY H . 26953 1
354 . 1 1 79 79 GLY C C 13 174.790 0.013 . 1 . 370 . . 79 GLY C . 26953 1
355 . 1 1 79 79 GLY CA C 13 45.581 0.008 . 1 . 369 . . 79 GLY CA . 26953 1
356 . 1 1 79 79 GLY N N 15 110.579 0.009 . 1 . 36 . . 79 GLY N . 26953 1
357 . 1 1 80 80 GLY H H 1 8.226 0.0 . 1 . 5 . . 80 GLY H . 26953 1
358 . 1 1 80 80 GLY C C 13 174.119 0.005 . 1 . 367 . . 80 GLY C . 26953 1
359 . 1 1 80 80 GLY CA C 13 45.291 0.045 . 1 . 368 . . 80 GLY CA . 26953 1
360 . 1 1 80 80 GLY N N 15 108.637 0.011 . 1 . 6 . . 80 GLY N . 26953 1
361 . 1 1 81 81 ALA H H 1 8.277 0.0 . 1 . 215 . . 81 ALA H . 26953 1
362 . 1 1 81 81 ALA C C 13 178.429 0.004 . 1 . 366 . . 81 ALA C . 26953 1
363 . 1 1 81 81 ALA CA C 13 52.862 0.006 . 1 . 364 . . 81 ALA CA . 26953 1
364 . 1 1 81 81 ALA CB C 13 19.219 0.024 . 1 . 365 . . 81 ALA CB . 26953 1
365 . 1 1 81 81 ALA N N 15 123.732 0.009 . 1 . 216 . . 81 ALA N . 26953 1
366 . 1 1 82 82 GLY H H 1 8.406 0.0 . 1 . 49 . . 82 GLY H . 26953 1
367 . 1 1 82 82 GLY C C 13 174.104 0.004 . 1 . 363 . . 82 GLY C . 26953 1
368 . 1 1 82 82 GLY CA C 13 45.361 0.016 . 1 . 362 . . 82 GLY CA . 26953 1
369 . 1 1 82 82 GLY N N 15 107.988 0.024 . 1 . 50 . . 82 GLY N . 26953 1
370 . 1 1 83 83 ALA H H 1 8.062 0.001 . 1 . 25 . . 83 ALA H . 26953 1
371 . 1 1 83 83 ALA C C 13 177.743 0.004 . 1 . 359 . . 83 ALA C . 26953 1
372 . 1 1 83 83 ALA CA C 13 52.642 0.045 . 1 . 360 . . 83 ALA CA . 26953 1
373 . 1 1 83 83 ALA CB C 13 19.317 0.013 . 1 . 361 . . 83 ALA CB . 26953 1
374 . 1 1 83 83 ALA N N 15 123.597 0.043 . 1 . 26 . . 83 ALA N . 26953 1
375 . 1 1 84 84 ALA H H 1 8.296 0.001 . 1 . 23 . . 84 ALA H . 26953 1
376 . 1 1 84 84 ALA C C 13 177.845 0.012 . 1 . 225 . . 84 ALA C . 26953 1
377 . 1 1 84 84 ALA CA C 13 52.656 0.006 . 1 . 223 . . 84 ALA CA . 26953 1
378 . 1 1 84 84 ALA CB C 13 19.045 0.027 . 1 . 222 . . 84 ALA CB . 26953 1
379 . 1 1 84 84 ALA N N 15 122.952 0.023 . 1 . 24 . . 84 ALA N . 26953 1
380 . 1 1 85 85 CYS H H 1 8.283 0.001 . 1 . 69 . . 85 CYS H . 26953 1
381 . 1 1 85 85 CYS C C 13 175.155 0.011 . 1 . 221 . . 85 CYS C . 26953 1
382 . 1 1 85 85 CYS CA C 13 58.469 0.044 . 1 . 219 . . 85 CYS CA . 26953 1
383 . 1 1 85 85 CYS CB C 13 28.128 0.078 . 1 . 218 . . 85 CYS CB . 26953 1
384 . 1 1 85 85 CYS N N 15 117.901 0.033 . 1 . 70 . . 85 CYS N . 26953 1
385 . 1 1 86 86 GLY H H 1 8.447 0.001 . 1 . 13 . . 86 GLY H . 26953 1
386 . 1 1 86 86 GLY C C 13 174.570 0.005 . 1 . 220 . . 86 GLY C . 26953 1
387 . 1 1 86 86 GLY CA C 13 45.502 0.012 . 1 . 217 . . 86 GLY CA . 26953 1
388 . 1 1 86 86 GLY N N 15 111.074 0.014 . 1 . 14 . . 86 GLY N . 26953 1
389 . 1 1 87 87 GLY H H 1 8.284 0.001 . 1 . 173 . . 87 GLY H . 26953 1
390 . 1 1 87 87 GLY C C 13 174.274 0.01 . 1 . 302 . . 87 GLY C . 26953 1
391 . 1 1 87 87 GLY CA C 13 45.314 0.033 . 1 . 303 . . 87 GLY CA . 26953 1
392 . 1 1 87 87 GLY N N 15 108.779 0.015 . 1 . 174 . . 87 GLY N . 26953 1
393 . 1 1 88 88 SER H H 1 8.261 0.001 . 1 . 199 . . 88 SER H . 26953 1
394 . 1 1 88 88 SER C C 13 174.307 0.014 . 1 . 304 . . 88 SER C . 26953 1
395 . 1 1 88 88 SER CA C 13 58.333 0.02 . 1 . 306 . . 88 SER CA . 26953 1
396 . 1 1 88 88 SER CB C 13 63.920 0.012 . 1 . 305 . . 88 SER CB . 26953 1
397 . 1 1 88 88 SER N N 15 115.459 0.039 . 1 . 200 . . 88 SER N . 26953 1
398 . 1 1 89 89 ASN H H 1 8.508 0.001 . 1 . 53 . . 89 ASN H . 26953 1
399 . 1 1 89 89 ASN C C 13 174.834 0.008 . 1 . 309 . . 89 ASN C . 26953 1
400 . 1 1 89 89 ASN CA C 13 53.447 0.055 . 1 . 307 . . 89 ASN CA . 26953 1
401 . 1 1 89 89 ASN CB C 13 38.683 0.028 . 1 . 308 . . 89 ASN CB . 26953 1
402 . 1 1 89 89 ASN N N 15 120.527 0.025 . 1 . 54 . . 89 ASN N . 26953 1
403 . 1 1 90 90 LEU H H 1 8.093 0.002 . 1 . 79 . . 90 LEU H . 26953 1
404 . 1 1 90 90 LEU HA H 1 3.960 0.05 . 1 . 611 . . 90 LEU HA . 26953 1
405 . 1 1 90 90 LEU C C 13 176.592 0.006 . 1 . 310 . . 90 LEU C . 26953 1
406 . 1 1 90 90 LEU CA C 13 54.873 0.003 . 1 . 311 . . 90 LEU CA . 26953 1
407 . 1 1 90 90 LEU CB C 13 42.489 0.021 . 1 . 312 . . 90 LEU CB . 26953 1
408 . 1 1 90 90 LEU CG C 13 26.894 0.1 . 1 . 610 . . 90 LEU CG . 26953 1
409 . 1 1 90 90 LEU CD1 C 13 23.347 0.1 . 2 . 608 . . 90 LEU CD1 . 26953 1
410 . 1 1 90 90 LEU CD2 C 13 25.006 0.1 . 2 . 609 . . 90 LEU CD2 . 26953 1
411 . 1 1 90 90 LEU N N 15 121.923 0.018 . 1 . 80 . . 90 LEU N . 26953 1
412 . 1 1 91 91 ALA H H 1 8.146 0.001 . 1 . 111 . . 91 ALA H . 26953 1
413 . 1 1 91 91 ALA C C 13 175.167 0.1 . 1 . 224 . . 91 ALA C . 26953 1
414 . 1 1 91 91 ALA CA C 13 50.436 0.1 . 1 . 313 . . 91 ALA CA . 26953 1
415 . 1 1 91 91 ALA CB C 13 18.323 0.1 . 1 . 314 . . 91 ALA CB . 26953 1
416 . 1 1 91 91 ALA N N 15 125.954 0.039 . 1 . 112 . . 91 ALA N . 26953 1
417 . 1 1 92 92 PRO C C 13 176.638 0.007 . 1 . 593 . . 92 PRO C . 26953 1
418 . 1 1 92 92 PRO CA C 13 62.707 0.016 . 1 . 594 . . 92 PRO CA . 26953 1
419 . 1 1 92 92 PRO CB C 13 32.008 0.001 . 1 . 591 . . 92 PRO CB . 26953 1
420 . 1 1 93 93 LEU H H 1 8.276 0.0 . 1 . 71 . . 93 LEU H . 26953 1
421 . 1 1 93 93 LEU C C 13 175.344 0.1 . 1 . 592 . . 93 LEU C . 26953 1
422 . 1 1 93 93 LEU CA C 13 53.023 0.1 . 1 . 595 . . 93 LEU CA . 26953 1
423 . 1 1 93 93 LEU CB C 13 41.773 0.1 . 1 . 590 . . 93 LEU CB . 26953 1
424 . 1 1 93 93 LEU N N 15 123.599 0.013 . 1 . 72 . . 93 LEU N . 26953 1
425 . 1 1 94 94 PRO C C 13 176.602 0.015 . 1 . 301 . . 94 PRO C . 26953 1
426 . 1 1 94 94 PRO CA C 13 62.944 0.017 . 1 . 299 . . 94 PRO CA . 26953 1
427 . 1 1 94 94 PRO CB C 13 32.050 0.01 . 1 . 300 . . 94 PRO CB . 26953 1
428 . 1 1 95 95 ARG H H 1 8.374 0.001 . 1 . 33 . . 95 ARG H . 26953 1
429 . 1 1 95 95 ARG C C 13 176.319 0.013 . 1 . 296 . . 95 ARG C . 26953 1
430 . 1 1 95 95 ARG CA C 13 56.034 0.019 . 1 . 297 . . 95 ARG CA . 26953 1
431 . 1 1 95 95 ARG CB C 13 31.002 0.024 . 1 . 298 . . 95 ARG CB . 26953 1
432 . 1 1 95 95 ARG N N 15 121.712 0.007 . 1 . 34 . . 95 ARG N . 26953 1
433 . 1 1 96 96 ARG H H 1 8.514 0.001 . 1 . 213 . . 96 ARG H . 26953 1
434 . 1 1 96 96 ARG C C 13 176.421 0.02 . 1 . 295 . . 96 ARG C . 26953 1
435 . 1 1 96 96 ARG CA C 13 56.140 0.035 . 1 . 294 . . 96 ARG CA . 26953 1
436 . 1 1 96 96 ARG CB C 13 30.919 0.019 . 1 . 293 . . 96 ARG CB . 26953 1
437 . 1 1 96 96 ARG N N 15 123.229 0.024 . 1 . 214 . . 96 ARG N . 26953 1
438 . 1 1 97 97 GLU H H 1 8.706 0.001 . 1 . 63 . . 97 GLU H . 26953 1
439 . 1 1 97 97 GLU C C 13 176.680 0.025 . 1 . 290 . . 97 GLU C . 26953 1
440 . 1 1 97 97 GLU CA C 13 57.197 0.012 . 1 . 291 . . 97 GLU CA . 26953 1
441 . 1 1 97 97 GLU CB C 13 30.033 0.064 . 1 . 292 . . 97 GLU CB . 26953 1
442 . 1 1 97 97 GLU N N 15 122.132 0.02 . 1 . 64 . . 97 GLU N . 26953 1
443 . 1 1 98 98 THR H H 1 7.995 0.004 . 1 . 181 . . 98 THR H . 26953 1
444 . 1 1 98 98 THR C C 13 174.485 0.003 . 1 . 289 . . 98 THR C . 26953 1
445 . 1 1 98 98 THR CA C 13 61.862 0.033 . 1 . 288 . . 98 THR CA . 26953 1
446 . 1 1 98 98 THR CB C 13 69.741 0.019 . 1 . 287 . . 98 THR CB . 26953 1
447 . 1 1 98 98 THR N N 15 113.075 0.047 . 1 . 182 . . 98 THR N . 26953 1
448 . 1 1 99 99 GLU H H 1 8.345 0.002 . 1 . 31 . . 99 GLU H . 26953 1
449 . 1 1 99 99 GLU C C 13 176.267 0.004 . 1 . 284 . . 99 GLU C . 26953 1
450 . 1 1 99 99 GLU CA C 13 56.757 0.003 . 1 . 285 . . 99 GLU CA . 26953 1
451 . 1 1 99 99 GLU CB C 13 30.236 0.001 . 1 . 286 . . 99 GLU CB . 26953 1
452 . 1 1 99 99 GLU N N 15 122.556 0.036 . 1 . 32 . . 99 GLU N . 26953 1
453 . 1 1 100 100 GLU H H 1 8.290 0.002 . 1 . 3 . . 100 GLU H . 26953 1
454 . 1 1 100 100 GLU C C 13 176.110 0.013 . 1 . 283 . . 100 GLU C . 26953 1
455 . 1 1 100 100 GLU CA C 13 56.779 0.044 . 1 . 282 . . 100 GLU CA . 26953 1
456 . 1 1 100 100 GLU CB C 13 30.383 0.019 . 1 . 281 . . 100 GLU CB . 26953 1
457 . 1 1 100 100 GLU N N 15 121.217 0.038 . 1 . 4 . . 100 GLU N . 26953 1
458 . 1 1 101 101 PHE H H 1 8.229 0.002 . 1 . 51 . . 101 PHE H . 26953 1
459 . 1 1 101 101 PHE C C 13 175.408 0.008 . 1 . 278 . . 101 PHE C . 26953 1
460 . 1 1 101 101 PHE CA C 13 57.810 0.078 . 1 . 279 . . 101 PHE CA . 26953 1
461 . 1 1 101 101 PHE CB C 13 39.467 0.003 . 1 . 280 . . 101 PHE CB . 26953 1
462 . 1 1 101 101 PHE N N 15 120.583 0.041 . 1 . 52 . . 101 PHE N . 26953 1
463 . 1 1 102 102 ASN H H 1 8.267 0.002 . 1 . 91 . . 102 ASN H . 26953 1
464 . 1 1 102 102 ASN C C 13 174.811 0.002 . 1 . 277 . . 102 ASN C . 26953 1
465 . 1 1 102 102 ASN CA C 13 53.426 0.048 . 1 . 276 . . 102 ASN CA . 26953 1
466 . 1 1 102 102 ASN CB C 13 39.259 0.014 . 1 . 275 . . 102 ASN CB . 26953 1
467 . 1 1 102 102 ASN N N 15 120.530 0.039 . 1 . 92 . . 102 ASN N . 26953 1
468 . 1 1 103 103 ASP H H 1 8.280 0.001 . 1 . 195 . . 103 ASP H . 26953 1
469 . 1 1 103 103 ASP C C 13 176.221 0.009 . 1 . 272 . . 103 ASP C . 26953 1
470 . 1 1 103 103 ASP CA C 13 54.795 0.007 . 1 . 273 . . 103 ASP CA . 26953 1
471 . 1 1 103 103 ASP CB C 13 40.980 0.028 . 1 . 274 . . 103 ASP CB . 26953 1
472 . 1 1 103 103 ASP N N 15 120.800 0.071 . 1 . 196 . . 103 ASP N . 26953 1
473 . 1 1 104 104 LEU H H 1 8.017 0.001 . 1 . 159 . . 104 LEU H . 26953 1
474 . 1 1 104 104 LEU C C 13 177.401 0.012 . 1 . 269 . . 104 LEU C . 26953 1
475 . 1 1 104 104 LEU CA C 13 55.451 0.035 . 1 . 270 . . 104 LEU CA . 26953 1
476 . 1 1 104 104 LEU CB C 13 42.059 0.013 . 1 . 271 . . 104 LEU CB . 26953 1
477 . 1 1 104 104 LEU N N 15 120.965 0.011 . 1 . 160 . . 104 LEU N . 26953 1
478 . 1 1 105 105 LEU H H 1 7.970 0.001 . 1 . 163 . . 105 LEU H . 26953 1
479 . 1 1 105 105 LEU C C 13 177.030 0.024 . 1 . 268 . . 105 LEU C . 26953 1
480 . 1 1 105 105 LEU CA C 13 55.410 0.058 . 1 . 266 . . 105 LEU CA . 26953 1
481 . 1 1 105 105 LEU CB C 13 42.435 0.057 . 1 . 267 . . 105 LEU CB . 26953 1
482 . 1 1 105 105 LEU CD1 C 13 23.486 0.1 . 2 . 612 . . 105 LEU CD1 . 26953 1
483 . 1 1 105 105 LEU CD2 C 13 25.105 0.1 . 2 . 613 . . 105 LEU CD2 . 26953 1
484 . 1 1 105 105 LEU N N 15 121.369 0.041 . 1 . 164 . . 105 LEU N . 26953 1
485 . 1 1 106 106 ASP H H 1 8.164 0.001 . 1 . 129 . . 106 ASP H . 26953 1
486 . 1 1 106 106 ASP C C 13 176.499 0.003 . 1 . 265 . . 106 ASP C . 26953 1
487 . 1 1 106 106 ASP CA C 13 54.267 0.036 . 1 . 264 . . 106 ASP CA . 26953 1
488 . 1 1 106 106 ASP CB C 13 41.055 0.014 . 1 . 263 . . 106 ASP CB . 26953 1
489 . 1 1 106 106 ASP N N 15 120.786 0.025 . 1 . 130 . . 106 ASP N . 26953 1
490 . 1 1 107 107 LEU H H 1 8.102 0.002 . 1 . 189 . . 107 LEU H . 26953 1
491 . 1 1 107 107 LEU C C 13 177.663 0.004 . 1 . 260 . . 107 LEU C . 26953 1
492 . 1 1 107 107 LEU CA C 13 56.360 0.017 . 1 . 259 . . 107 LEU CA . 26953 1
493 . 1 1 107 107 LEU CB C 13 42.079 0.007 . 1 . 258 . . 107 LEU CB . 26953 1
494 . 1 1 107 107 LEU N N 15 122.536 0.029 . 1 . 190 . . 107 LEU N . 26953 1
495 . 1 1 108 108 ASP H H 1 8.252 0.001 . 1 . 197 . . 108 ASP H . 26953 1
496 . 1 1 108 108 ASP C C 13 177.115 0.015 . 1 . 255 . . 108 ASP C . 26953 1
497 . 1 1 108 108 ASP CA C 13 55.840 0.014 . 1 . 256 . . 108 ASP CA . 26953 1
498 . 1 1 108 108 ASP CB C 13 40.847 0.007 . 1 . 257 . . 108 ASP CB . 26953 1
499 . 1 1 108 108 ASP N N 15 119.141 0.015 . 1 . 198 . . 108 ASP N . 26953 1
500 . 1 1 109 109 PHE H H 1 7.941 0.002 . 1 . 65 . . 109 PHE H . 26953 1
501 . 1 1 109 109 PHE C C 13 176.564 0.005 . 1 . 233 . . 109 PHE C . 26953 1
502 . 1 1 109 109 PHE CA C 13 59.265 0.035 . 1 . 232 . . 109 PHE CA . 26953 1
503 . 1 1 109 109 PHE CB C 13 39.367 0.007 . 1 . 234 . . 109 PHE CB . 26953 1
504 . 1 1 109 109 PHE N N 15 120.237 0.046 . 1 . 66 . . 109 PHE N . 26953 1
505 . 1 1 110 110 ILE H H 1 7.945 0.001 . 1 . 167 . . 110 ILE H . 26953 1
506 . 1 1 110 110 ILE C C 13 177.354 0.007 . 1 . 230 . . 110 ILE C . 26953 1
507 . 1 1 110 110 ILE CA C 13 62.554 0.023 . 1 . 229 . . 110 ILE CA . 26953 1
508 . 1 1 110 110 ILE CB C 13 38.468 0.05 . 1 . 231 . . 110 ILE CB . 26953 1
509 . 1 1 110 110 ILE N N 15 121.161 0.032 . 1 . 168 . . 110 ILE N . 26953 1
510 . 1 1 111 111 LEU H H 1 8.236 0.002 . 1 . 15 . . 111 LEU H . 26953 1
511 . 1 1 111 111 LEU C C 13 178.288 0.028 . 1 . 228 . . 111 LEU C . 26953 1
512 . 1 1 111 111 LEU CA C 13 56.197 0.063 . 1 . 226 . . 111 LEU CA . 26953 1
513 . 1 1 111 111 LEU CB C 13 41.955 0.027 . 1 . 227 . . 111 LEU CB . 26953 1
514 . 1 1 111 111 LEU N N 15 123.007 0.053 . 1 . 16 . . 111 LEU N . 26953 1
515 . 1 1 112 112 SER H H 1 8.097 0.004 . 1 . 99 . . 112 SER H . 26953 1
516 . 1 1 112 112 SER C C 13 174.891 0.041 . 1 . 236 . . 112 SER C . 26953 1
517 . 1 1 112 112 SER CA C 13 59.327 0.062 . 1 . 235 . . 112 SER CA . 26953 1
518 . 1 1 112 112 SER CB C 13 63.556 0.023 . 1 . 237 . . 112 SER CB . 26953 1
519 . 1 1 112 112 SER N N 15 115.283 0.022 . 1 . 100 . . 112 SER N . 26953 1
520 . 1 1 113 113 ASN H H 1 8.131 0.003 . 1 . 193 . . 113 ASN H . 26953 1
521 . 1 1 113 113 ASN C C 13 175.396 0.023 . 1 . 240 . . 113 ASN C . 26953 1
522 . 1 1 113 113 ASN CA C 13 53.836 0.029 . 1 . 238 . . 113 ASN CA . 26953 1
523 . 1 1 113 113 ASN CB C 13 39.024 0.043 . 1 . 239 . . 113 ASN CB . 26953 1
524 . 1 1 113 113 ASN N N 15 120.077 0.036 . 1 . 194 . . 113 ASN N . 26953 1
525 . 1 1 114 114 SER H H 1 8.081 0.002 . 1 . 241 . . 114 SER H . 26953 1
526 . 1 1 114 114 SER C C 13 174.530 0.025 . 1 . 243 . . 114 SER C . 26953 1
527 . 1 1 114 114 SER CA C 13 59.096 0.044 . 1 . 244 . . 114 SER CA . 26953 1
528 . 1 1 114 114 SER CB C 13 63.628 0.009 . 1 . 245 . . 114 SER CB . 26953 1
529 . 1 1 114 114 SER N N 15 115.344 0.054 . 1 . 242 . . 114 SER N . 26953 1
530 . 1 1 115 115 LEU H H 1 8.081 0.001 . 1 . 119 . . 115 LEU H . 26953 1
531 . 1 1 115 115 LEU C C 13 177.556 0.002 . 1 . 248 . . 115 LEU C . 26953 1
532 . 1 1 115 115 LEU CA C 13 55.456 0.029 . 1 . 246 . . 115 LEU CA . 26953 1
533 . 1 1 115 115 LEU CB C 13 42.307 0.039 . 1 . 247 . . 115 LEU CB . 26953 1
534 . 1 1 115 115 LEU N N 15 122.785 0.041 . 1 . 120 . . 115 LEU N . 26953 1
535 . 1 1 116 116 THR H H 1 7.930 0.001 . 1 . 29 . . 116 THR H . 26953 1
536 . 1 1 116 116 THR C C 13 173.980 0.008 . 1 . 251 . . 116 THR C . 26953 1
537 . 1 1 116 116 THR CA C 13 61.836 0.013 . 1 . 249 . . 116 THR CA . 26953 1
538 . 1 1 116 116 THR CB C 13 69.722 0.023 . 1 . 250 . . 116 THR CB . 26953 1
539 . 1 1 116 116 THR N N 15 113.260 0.035 . 1 . 30 . . 116 THR N . 26953 1
540 . 1 1 117 117 HIS H H 1 8.235 0.001 . 1 . 185 . . 117 HIS H . 26953 1
541 . 1 1 117 117 HIS C C 13 171.948 0.1 . 1 . 252 . . 117 HIS C . 26953 1
542 . 1 1 117 117 HIS CA C 13 53.470 0.1 . 1 . 253 . . 117 HIS CA . 26953 1
543 . 1 1 117 117 HIS CB C 13 29.151 0.1 . 1 . 254 . . 117 HIS CB . 26953 1
544 . 1 1 117 117 HIS N N 15 121.293 0.041 . 1 . 186 . . 117 HIS N . 26953 1
545 . 1 1 119 119 PRO C C 13 177.034 0.004 . 1 . 358 . . 119 PRO C . 26953 1
546 . 1 1 119 119 PRO CA C 13 63.185 0.017 . 1 . 356 . . 119 PRO CA . 26953 1
547 . 1 1 119 119 PRO CB C 13 32.007 0.1 . 1 . 357 . . 119 PRO CB . 26953 1
548 . 1 1 120 120 GLU H H 1 8.646 0.0 . 1 . 145 . . 120 GLU H . 26953 1
549 . 1 1 120 120 GLU C C 13 176.619 0.012 . 1 . 355 . . 120 GLU C . 26953 1
550 . 1 1 120 120 GLU CA C 13 56.811 0.044 . 1 . 353 . . 120 GLU CA . 26953 1
551 . 1 1 120 120 GLU CB C 13 30.236 0.018 . 1 . 354 . . 120 GLU CB . 26953 1
552 . 1 1 120 120 GLU N N 15 120.920 0.028 . 1 . 146 . . 120 GLU N . 26953 1
553 . 1 1 121 121 SER H H 1 8.327 0.001 . 1 . 179 . . 121 SER H . 26953 1
554 . 1 1 121 121 SER C C 13 174.459 0.008 . 1 . 352 . . 121 SER C . 26953 1
555 . 1 1 121 121 SER CA C 13 58.270 0.013 . 1 . 351 . . 121 SER CA . 26953 1
556 . 1 1 121 121 SER CB C 13 63.811 0.006 . 1 . 350 . . 121 SER CB . 26953 1
557 . 1 1 121 121 SER N N 15 116.696 0.008 . 1 . 180 . . 121 SER N . 26953 1
558 . 1 1 122 122 VAL H H 1 8.120 0.002 . 1 . 121 . . 122 VAL H . 26953 1
559 . 1 1 122 122 VAL C C 13 175.883 0.004 . 1 . 348 . . 122 VAL C . 26953 1
560 . 1 1 122 122 VAL CA C 13 62.169 0.018 . 1 . 347 . . 122 VAL CA . 26953 1
561 . 1 1 122 122 VAL CB C 13 32.755 0.013 . 1 . 349 . . 122 VAL CB . 26953 1
562 . 1 1 122 122 VAL N N 15 121.929 0.022 . 1 . 122 . . 122 VAL N . 26953 1
563 . 1 1 123 123 ALA H H 1 8.318 0.001 . 1 . 85 . . 123 ALA H . 26953 1
564 . 1 1 123 123 ALA C C 13 177.408 0.004 . 1 . 344 . . 123 ALA C . 26953 1
565 . 1 1 123 123 ALA CA C 13 52.503 0.007 . 1 . 345 . . 123 ALA CA . 26953 1
566 . 1 1 123 123 ALA CB C 13 19.208 0.002 . 1 . 346 . . 123 ALA CB . 26953 1
567 . 1 1 123 123 ALA N N 15 127.637 0.013 . 1 . 86 . . 123 ALA N . 26953 1
568 . 1 1 124 124 ALA H H 1 8.263 0.001 . 1 . 177 . . 124 ALA H . 26953 1
569 . 1 1 124 124 ALA C C 13 177.933 0.009 . 1 . 343 . . 124 ALA C . 26953 1
570 . 1 1 124 124 ALA CA C 13 52.504 0.013 . 1 . 341 . . 124 ALA CA . 26953 1
571 . 1 1 124 124 ALA CB C 13 19.269 0.008 . 1 . 342 . . 124 ALA CB . 26953 1
572 . 1 1 124 124 ALA N N 15 123.437 0.041 . 1 . 178 . . 124 ALA N . 26953 1
573 . 1 1 125 125 THR H H 1 8.130 0.001 . 1 . 117 . . 125 THR H . 26953 1
574 . 1 1 125 125 THR C C 13 174.610 0.002 . 1 . 336 . . 125 THR C . 26953 1
575 . 1 1 125 125 THR CA C 13 61.921 0.009 . 1 . 331 . . 125 THR CA . 26953 1
576 . 1 1 125 125 THR CB C 13 69.904 0.002 . 1 . 334 . . 125 THR CB . 26953 1
577 . 1 1 125 125 THR N N 15 113.880 0.02 . 1 . 118 . . 125 THR N . 26953 1
578 . 1 1 126 126 VAL H H 1 8.178 0.002 . 1 . 75 . . 126 VAL H . 26953 1
579 . 1 1 126 126 VAL C C 13 176.139 0.006 . 1 . 335 . . 126 VAL C . 26953 1
580 . 1 1 126 126 VAL CA C 13 62.186 0.065 . 1 . 332 . . 126 VAL CA . 26953 1
581 . 1 1 126 126 VAL CB C 13 32.868 0.009 . 1 . 333 . . 126 VAL CB . 26953 1
582 . 1 1 126 126 VAL N N 15 122.657 0.043 . 1 . 76 . . 126 VAL N . 26953 1
583 . 1 1 127 127 SER H H 1 8.438 0.001 . 1 . 203 . . 127 SER H . 26953 1
584 . 1 1 127 127 SER C C 13 174.671 0.004 . 1 . 339 . . 127 SER C . 26953 1
585 . 1 1 127 127 SER CA C 13 58.199 0.005 . 1 . 337 . . 127 SER CA . 26953 1
586 . 1 1 127 127 SER CB C 13 63.847 0.015 . 1 . 338 . . 127 SER CB . 26953 1
587 . 1 1 127 127 SER N N 15 119.719 0.041 . 1 . 204 . . 127 SER N . 26953 1
588 . 1 1 128 128 SER H H 1 8.425 0.001 . 1 . 161 . . 128 SER H . 26953 1
589 . 1 1 128 128 SER C C 13 174.624 0.024 . 1 . 330 . . 128 SER C . 26953 1
590 . 1 1 128 128 SER CA C 13 58.351 0.03 . 1 . 340 . . 128 SER CA . 26953 1
591 . 1 1 128 128 SER CB C 13 63.819 0.1 . 1 . 329 . . 128 SER CB . 26953 1
592 . 1 1 128 128 SER N N 15 118.312 0.014 . 1 . 162 . . 128 SER N . 26953 1
593 . 1 1 129 129 SER H H 1 8.345 0.001 . 1 . 27 . . 129 SER H . 26953 1
594 . 1 1 129 129 SER C C 13 174.166 0.02 . 1 . 326 . . 129 SER C . 26953 1
595 . 1 1 129 129 SER CA C 13 58.336 0.007 . 1 . 327 . . 129 SER CA . 26953 1
596 . 1 1 129 129 SER CB C 13 63.867 0.024 . 1 . 328 . . 129 SER CB . 26953 1
597 . 1 1 129 129 SER N N 15 117.731 0.061 . 1 . 28 . . 129 SER N . 26953 1
598 . 1 1 130 130 ALA H H 1 8.280 0.001 . 1 . 109 . . 130 ALA H . 26953 1
599 . 1 1 130 130 ALA C C 13 177.580 0.011 . 1 . 323 . . 130 ALA C . 26953 1
600 . 1 1 130 130 ALA CA C 13 52.610 0.02 . 1 . 324 . . 130 ALA CA . 26953 1
601 . 1 1 130 130 ALA CB C 13 19.385 0.033 . 1 . 325 . . 130 ALA CB . 26953 1
602 . 1 1 130 130 ALA N N 15 125.986 0.019 . 1 . 110 . . 130 ALA N . 26953 1
603 . 1 1 131 131 SER H H 1 8.235 0.002 . 1 . 321 . . 131 SER H . 26953 1
604 . 1 1 131 131 SER C C 13 173.228 0.01 . 1 . 320 . . 131 SER C . 26953 1
605 . 1 1 131 131 SER CA C 13 58.189 0.032 . 1 . 316 . . 131 SER CA . 26953 1
606 . 1 1 131 131 SER CB C 13 64.001 0.023 . 1 . 317 . . 131 SER CB . 26953 1
607 . 1 1 131 131 SER N N 15 115.517 0.013 . 1 . 322 . . 131 SER N . 26953 1
608 . 1 1 132 132 ALA H H 1 7.945 0.001 . 1 . 1 . . 132 ALA H . 26953 1
609 . 1 1 132 132 ALA C C 13 182.434 0.1 . 1 . 319 . . 132 ALA C . 26953 1
610 . 1 1 132 132 ALA CA C 13 53.921 0.1 . 1 . 315 . . 132 ALA CA . 26953 1
611 . 1 1 132 132 ALA CB C 13 20.235 0.1 . 1 . 318 . . 132 ALA CB . 26953 1
612 . 1 1 132 132 ALA N N 15 131.504 0.014 . 1 . 2 . . 132 ALA N . 26953 1
stop_
save_