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 26053
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $CondSet1
_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 0.01
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC/HMQC' 1 $sample_1 isotropic 26053 1
3 '3D HNCO' 1 $sample_1 isotropic 26053 1
4 '3D HNCACB' 1 $sample_1 isotropic 26053 1
6 '3D C(CO)NH' 1 $sample_1 isotropic 26053 1
7 '3D 1H-15N NOESY' 1 $sample_1 isotropic 26053 1
10 '2D 1H-13C HSQC/HMQC' 1 $sample_1 isotropic 26053 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
3 $CcpNmr_Analysis 0 . 26053 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 3 3 MET HE1 H 1 2.082 0.002 . 1 . 611 . A 3 MET HE1 . 26053 1
2 . 1 1 3 3 MET HE2 H 1 2.082 0.002 . 1 . 611 . A 3 MET HE2 . 26053 1
3 . 1 1 3 3 MET HE3 H 1 2.082 0.002 . 1 . 611 . A 3 MET HE3 . 26053 1
4 . 1 1 3 3 MET CE C 13 16.878 0.001 . 1 . 610 . A 3 MET CE . 26053 1
5 . 1 1 6 6 SER HA H 1 4.464 0.005 . 1 . 1011 . A 6 SER HA . 26053 1
6 . 1 1 6 6 SER HB2 H 1 3.888 0.003 . 2 . 1010 . A 6 SER HB2 . 26053 1
7 . 1 1 6 6 SER HB3 H 1 3.889 0.003 . 2 . 1012 . A 6 SER HB3 . 26053 1
8 . 1 1 6 6 SER C C 13 174.460 0.003 . 1 . 583 . A 6 SER C . 26053 1
9 . 1 1 6 6 SER CA C 13 58.493 0.026 . 1 . 501 . A 6 SER CA . 26053 1
10 . 1 1 6 6 SER CB C 13 63.850 0.057 . 1 . 502 . A 6 SER CB . 26053 1
11 . 1 1 7 7 GLU H H 1 8.476 0.005 . 1 . 113 . A 7 GLU H . 26053 1
12 . 1 1 7 7 GLU HA H 1 4.373 0.01 . 1 . 595 . A 7 GLU HA . 26053 1
13 . 1 1 7 7 GLU HB2 H 1 2.072 0.012 . 2 . 598 . A 7 GLU HB2 . 26053 1
14 . 1 1 7 7 GLU HB3 H 1 1.944 0.009 . 2 . 599 . A 7 GLU HB3 . 26053 1
15 . 1 1 7 7 GLU HG2 H 1 2.272 0.014 . 2 . 596 . A 7 GLU HG2 . 26053 1
16 . 1 1 7 7 GLU HG3 H 1 2.238 0.02 . 2 . 597 . A 7 GLU HG3 . 26053 1
17 . 1 1 7 7 GLU C C 13 176.345 0.017 . 1 . 402 . A 7 GLU C . 26053 1
18 . 1 1 7 7 GLU CA C 13 56.507 0.052 . 1 . 393 . A 7 GLU CA . 26053 1
19 . 1 1 7 7 GLU CB C 13 30.461 0.078 . 1 . 392 . A 7 GLU CB . 26053 1
20 . 1 1 7 7 GLU CG C 13 36.336 0.034 . 1 . 503 . A 7 GLU CG . 26053 1
21 . 1 1 7 7 GLU N N 15 123.126 0.112 . 1 . 114 . A 7 GLU N . 26053 1
22 . 1 1 8 8 VAL H H 1 8.139 0.007 . 1 . 79 . A 8 VAL H . 26053 1
23 . 1 1 8 8 VAL HA H 1 3.990 0.011 . 1 . 603 . A 8 VAL HA . 26053 1
24 . 1 1 8 8 VAL HB H 1 2.026 0.004 . 1 . 600 . A 8 VAL HB . 26053 1
25 . 1 1 8 8 VAL HG11 H 1 0.826 0.006 . 2 . 601 . A 8 VAL HG11 . 26053 1
26 . 1 1 8 8 VAL HG12 H 1 0.826 0.006 . 2 . 601 . A 8 VAL HG12 . 26053 1
27 . 1 1 8 8 VAL HG13 H 1 0.826 0.006 . 2 . 601 . A 8 VAL HG13 . 26053 1
28 . 1 1 8 8 VAL HG21 H 1 0.944 0.014 . 2 . 602 . A 8 VAL HG21 . 26053 1
29 . 1 1 8 8 VAL HG22 H 1 0.944 0.014 . 2 . 602 . A 8 VAL HG22 . 26053 1
30 . 1 1 8 8 VAL HG23 H 1 0.944 0.014 . 2 . 602 . A 8 VAL HG23 . 26053 1
31 . 1 1 8 8 VAL C C 13 175.329 0.012 . 1 . 403 . A 8 VAL C . 26053 1
32 . 1 1 8 8 VAL CA C 13 62.175 0.037 . 1 . 390 . A 8 VAL CA . 26053 1
33 . 1 1 8 8 VAL CB C 13 33.099 0.029 . 1 . 391 . A 8 VAL CB . 26053 1
34 . 1 1 8 8 VAL CG1 C 13 21.524 0.024 . 2 . 505 . A 8 VAL CG1 . 26053 1
35 . 1 1 8 8 VAL CG2 C 13 21.010 0.071 . 2 . 504 . A 8 VAL CG2 . 26053 1
36 . 1 1 8 8 VAL N N 15 120.816 0.104 . 1 . 80 . A 8 VAL N . 26053 1
37 . 1 1 9 9 ASN H H 1 8.411 0.003 . 1 . 97 . A 9 ASN H . 26053 1
38 . 1 1 9 9 ASN HA H 1 4.717 0.002 . 1 . 606 . A 9 ASN HA . 26053 1
39 . 1 1 9 9 ASN HB2 H 1 2.751 0.006 . 2 . 604 . A 9 ASN HB2 . 26053 1
40 . 1 1 9 9 ASN HB3 H 1 2.910 0.007 . 2 . 605 . A 9 ASN HB3 . 26053 1
41 . 1 1 9 9 ASN HD21 H 1 6.942 0.009 . 1 . 1061 . A 9 ASN HD21 . 26053 1
42 . 1 1 9 9 ASN HD22 H 1 7.527 0.003 . 1 . 1062 . A 9 ASN HD22 . 26053 1
43 . 1 1 9 9 ASN C C 13 175.366 0.018 . 1 . 404 . A 9 ASN C . 26053 1
44 . 1 1 9 9 ASN CA C 13 53.011 0.065 . 1 . 389 . A 9 ASN CA . 26053 1
45 . 1 1 9 9 ASN CB C 13 38.155 0.035 . 1 . 388 . A 9 ASN CB . 26053 1
46 . 1 1 9 9 ASN N N 15 122.704 0.08 . 1 . 98 . A 9 ASN N . 26053 1
47 . 1 1 9 9 ASN ND2 N 15 111.680 0.042 . 1 . 1060 . A 9 ASN ND2 . 26053 1
48 . 1 1 10 10 MET H H 1 8.583 0.005 . 1 . 19 . A 10 MET H . 26053 1
49 . 1 1 10 10 MET HA H 1 4.719 0.002 . 1 . 607 . A 10 MET HA . 26053 1
50 . 1 1 10 10 MET HB2 H 1 2.039 0.009 . 2 . 612 . A 10 MET HB2 . 26053 1
51 . 1 1 10 10 MET HB3 H 1 2.515 0.004 . 2 . 1017 . A 10 MET HB3 . 26053 1
52 . 1 1 10 10 MET HG2 H 1 2.596 0.015 . 2 . 614 . A 10 MET HG2 . 26053 1
53 . 1 1 10 10 MET HG3 H 1 2.731 0.007 . 2 . 1018 . A 10 MET HG3 . 26053 1
54 . 1 1 10 10 MET HE1 H 1 2.165 0.011 . 1 . 609 . A 10 MET HE1 . 26053 1
55 . 1 1 10 10 MET HE2 H 1 2.165 0.011 . 1 . 609 . A 10 MET HE2 . 26053 1
56 . 1 1 10 10 MET HE3 H 1 2.165 0.011 . 1 . 609 . A 10 MET HE3 . 26053 1
57 . 1 1 10 10 MET C C 13 176.144 0.013 . 1 . 405 . A 10 MET C . 26053 1
58 . 1 1 10 10 MET CA C 13 55.094 0.071 . 1 . 394 . A 10 MET CA . 26053 1
59 . 1 1 10 10 MET CB C 13 31.793 0.027 . 1 . 395 . A 10 MET CB . 26053 1
60 . 1 1 10 10 MET CG C 13 32.626 0.042 . 1 . 613 . A 10 MET CG . 26053 1
61 . 1 1 10 10 MET CE C 13 17.144 0.006 . 1 . 608 . A 10 MET CE . 26053 1
62 . 1 1 10 10 MET N N 15 123.821 0.078 . 1 . 20 . A 10 MET N . 26053 1
63 . 1 1 11 11 GLY H H 1 8.387 0.006 . 1 . 149 . A 11 GLY H . 26053 1
64 . 1 1 11 11 GLY HA2 H 1 3.102 0.008 . 2 . 615 . A 11 GLY HA2 . 26053 1
65 . 1 1 11 11 GLY HA3 H 1 3.662 0.004 . 2 . 616 . A 11 GLY HA3 . 26053 1
66 . 1 1 11 11 GLY C C 13 174.623 0.024 . 1 . 406 . A 11 GLY C . 26053 1
67 . 1 1 11 11 GLY CA C 13 44.501 0.04 . 1 . 396 . A 11 GLY CA . 26053 1
68 . 1 1 11 11 GLY N N 15 109.338 0.116 . 1 . 150 . A 11 GLY N . 26053 1
69 . 1 1 12 12 LEU H H 1 8.600 0.005 . 1 . 73 . A 12 LEU H . 26053 1
70 . 1 1 12 12 LEU HA H 1 4.232 0.006 . 1 . 617 . A 12 LEU HA . 26053 1
71 . 1 1 12 12 LEU HB2 H 1 1.417 0.006 . 2 . 618 . A 12 LEU HB2 . 26053 1
72 . 1 1 12 12 LEU HB3 H 1 1.543 0.006 . 2 . 619 . A 12 LEU HB3 . 26053 1
73 . 1 1 12 12 LEU HG H 1 1.695 0.005 . 1 . 622 . A 12 LEU HG . 26053 1
74 . 1 1 12 12 LEU HD11 H 1 0.775 0.005 . 2 . 620 . A 12 LEU HD11 . 26053 1
75 . 1 1 12 12 LEU HD12 H 1 0.775 0.005 . 2 . 620 . A 12 LEU HD12 . 26053 1
76 . 1 1 12 12 LEU HD13 H 1 0.775 0.005 . 2 . 620 . A 12 LEU HD13 . 26053 1
77 . 1 1 12 12 LEU HD21 H 1 0.853 0.009 . 2 . 621 . A 12 LEU HD21 . 26053 1
78 . 1 1 12 12 LEU HD22 H 1 0.853 0.009 . 2 . 621 . A 12 LEU HD22 . 26053 1
79 . 1 1 12 12 LEU HD23 H 1 0.853 0.009 . 2 . 621 . A 12 LEU HD23 . 26053 1
80 . 1 1 12 12 LEU C C 13 177.199 0.009 . 1 . 407 . A 12 LEU C . 26053 1
81 . 1 1 12 12 LEU CA C 13 54.052 0.04 . 1 . 398 . A 12 LEU CA . 26053 1
82 . 1 1 12 12 LEU CB C 13 43.159 0.034 . 1 . 397 . A 12 LEU CB . 26053 1
83 . 1 1 12 12 LEU CG C 13 26.869 0.014 . 1 . 507 . A 12 LEU CG . 26053 1
84 . 1 1 12 12 LEU CD1 C 13 25.650 0.025 . 2 . 506 . A 12 LEU CD1 . 26053 1
85 . 1 1 12 12 LEU CD2 C 13 22.401 0.03 . 2 . 508 . A 12 LEU CD2 . 26053 1
86 . 1 1 12 12 LEU N N 15 121.233 0.071 . 1 . 74 . A 12 LEU N . 26053 1
87 . 1 1 13 13 SER H H 1 8.240 0.004 . 1 . 141 . A 13 SER H . 26053 1
88 . 1 1 13 13 SER HA H 1 4.384 0.006 . 1 . 623 . A 13 SER HA . 26053 1
89 . 1 1 13 13 SER HB2 H 1 4.031 0.01 . 2 . 624 . A 13 SER HB2 . 26053 1
90 . 1 1 13 13 SER HB3 H 1 3.759 0.007 . 2 . 625 . A 13 SER HB3 . 26053 1
91 . 1 1 13 13 SER C C 13 175.430 0.003 . 1 . 408 . A 13 SER C . 26053 1
92 . 1 1 13 13 SER CA C 13 57.986 0.053 . 1 . 399 . A 13 SER CA . 26053 1
93 . 1 1 13 13 SER CB C 13 63.634 0.089 . 1 . 631 . A 13 SER CB . 26053 1
94 . 1 1 13 13 SER N N 15 112.929 0.078 . 1 . 142 . A 13 SER N . 26053 1
95 . 1 1 14 14 SER H H 1 8.595 0.009 . 1 . 67 . A 14 SER H . 26053 1
96 . 1 1 14 14 SER HA H 1 4.247 0.002 . 1 . 632 . A 14 SER HA . 26053 1
97 . 1 1 14 14 SER HB2 H 1 3.979 0.011 . 2 . 629 . A 14 SER HB2 . 26053 1
98 . 1 1 14 14 SER HB3 H 1 3.650 0.006 . 2 . 630 . A 14 SER HB3 . 26053 1
99 . 1 1 14 14 SER C C 13 174.975 0.01 . 1 . 409 . A 14 SER C . 26053 1
100 . 1 1 14 14 SER CA C 13 57.588 0.034 . 1 . 411 . A 14 SER CA . 26053 1
101 . 1 1 14 14 SER CB C 13 63.716 0.095 . 1 . 410 . A 14 SER CB . 26053 1
102 . 1 1 14 14 SER N N 15 118.670 0.074 . 1 . 68 . A 14 SER N . 26053 1
103 . 1 1 15 15 ALA H H 1 8.069 0.004 . 1 . 129 . A 15 ALA H . 26053 1
104 . 1 1 15 15 ALA HA H 1 4.141 0.006 . 1 . 634 . A 15 ALA HA . 26053 1
105 . 1 1 15 15 ALA HB1 H 1 1.314 0.005 . 1 . 633 . A 15 ALA HB1 . 26053 1
106 . 1 1 15 15 ALA HB2 H 1 1.314 0.005 . 1 . 633 . A 15 ALA HB2 . 26053 1
107 . 1 1 15 15 ALA HB3 H 1 1.314 0.005 . 1 . 633 . A 15 ALA HB3 . 26053 1
108 . 1 1 15 15 ALA C C 13 178.861 0.1 . 1 . 628 . A 15 ALA C . 26053 1
109 . 1 1 15 15 ALA CA C 13 53.980 0.038 . 1 . 626 . A 15 ALA CA . 26053 1
110 . 1 1 15 15 ALA CB C 13 17.881 0.023 . 1 . 627 . A 15 ALA CB . 26053 1
111 . 1 1 15 15 ALA N N 15 127.015 0.096 . 1 . 130 . A 15 ALA N . 26053 1
112 . 1 1 16 16 GLY HA2 H 1 3.739 0.005 . 2 . 635 . A 16 GLY HA2 . 26053 1
113 . 1 1 16 16 GLY HA3 H 1 3.999 0.015 . 2 . 636 . A 16 GLY HA3 . 26053 1
114 . 1 1 16 16 GLY C C 13 173.722 0.0 . 1 . 584 . A 16 GLY C . 26053 1
115 . 1 1 16 16 GLY CA C 13 45.646 0.018 . 1 . 509 . A 16 GLY CA . 26053 1
116 . 1 1 17 17 VAL H H 1 7.799 0.007 . 1 . 115 . A 17 VAL H . 26053 1
117 . 1 1 17 17 VAL HA H 1 3.948 0.011 . 1 . 637 . A 17 VAL HA . 26053 1
118 . 1 1 17 17 VAL HB H 1 1.784 0.006 . 1 . 638 . A 17 VAL HB . 26053 1
119 . 1 1 17 17 VAL HG11 H 1 0.755 0.009 . 2 . 639 . A 17 VAL HG11 . 26053 1
120 . 1 1 17 17 VAL HG12 H 1 0.755 0.009 . 2 . 639 . A 17 VAL HG12 . 26053 1
121 . 1 1 17 17 VAL HG13 H 1 0.755 0.009 . 2 . 639 . A 17 VAL HG13 . 26053 1
122 . 1 1 17 17 VAL HG21 H 1 0.543 0.006 . 2 . 640 . A 17 VAL HG21 . 26053 1
123 . 1 1 17 17 VAL HG22 H 1 0.543 0.006 . 2 . 640 . A 17 VAL HG22 . 26053 1
124 . 1 1 17 17 VAL HG23 H 1 0.543 0.006 . 2 . 640 . A 17 VAL HG23 . 26053 1
125 . 1 1 17 17 VAL C C 13 175.578 0.013 . 1 . 455 . A 17 VAL C . 26053 1
126 . 1 1 17 17 VAL CA C 13 61.387 0.082 . 1 . 453 . A 17 VAL CA . 26053 1
127 . 1 1 17 17 VAL CB C 13 33.051 0.051 . 1 . 454 . A 17 VAL CB . 26053 1
128 . 1 1 17 17 VAL CG1 C 13 21.104 0.039 . 2 . 510 . A 17 VAL CG1 . 26053 1
129 . 1 1 17 17 VAL CG2 C 13 21.069 0.022 . 2 . 511 . A 17 VAL CG2 . 26053 1
130 . 1 1 17 17 VAL N N 15 121.164 0.075 . 1 . 116 . A 17 VAL N . 26053 1
131 . 1 1 18 18 ALA H H 1 8.661 0.012 . 1 . 103 . A 18 ALA H . 26053 1
132 . 1 1 18 18 ALA HA H 1 4.503 0.008 . 1 . 642 . A 18 ALA HA . 26053 1
133 . 1 1 18 18 ALA HB1 H 1 1.258 0.005 . 1 . 641 . A 18 ALA HB1 . 26053 1
134 . 1 1 18 18 ALA HB2 H 1 1.258 0.005 . 1 . 641 . A 18 ALA HB2 . 26053 1
135 . 1 1 18 18 ALA HB3 H 1 1.258 0.005 . 1 . 641 . A 18 ALA HB3 . 26053 1
136 . 1 1 18 18 ALA C C 13 175.952 0.008 . 1 . 456 . A 18 ALA C . 26053 1
137 . 1 1 18 18 ALA CA C 13 50.498 0.035 . 1 . 452 . A 18 ALA CA . 26053 1
138 . 1 1 18 18 ALA CB C 13 16.111 0.024 . 1 . 451 . A 18 ALA CB . 26053 1
139 . 1 1 18 18 ALA N N 15 132.796 0.085 . 1 . 104 . A 18 ALA N . 26053 1
140 . 1 1 19 19 VAL H H 1 7.759 0.007 . 1 . 169 . A 19 VAL H . 26053 1
141 . 1 1 19 19 VAL HA H 1 3.447 0.005 . 1 . 646 . A 19 VAL HA . 26053 1
142 . 1 1 19 19 VAL HB H 1 1.408 0.007 . 1 . 645 . A 19 VAL HB . 26053 1
143 . 1 1 19 19 VAL HG11 H 1 0.638 0.011 . 2 . 643 . A 19 VAL HG11 . 26053 1
144 . 1 1 19 19 VAL HG12 H 1 0.638 0.011 . 2 . 643 . A 19 VAL HG12 . 26053 1
145 . 1 1 19 19 VAL HG13 H 1 0.638 0.011 . 2 . 643 . A 19 VAL HG13 . 26053 1
146 . 1 1 19 19 VAL HG21 H 1 -0.187 0.005 . 2 . 644 . A 19 VAL HG21 . 26053 1
147 . 1 1 19 19 VAL HG22 H 1 -0.187 0.005 . 2 . 644 . A 19 VAL HG22 . 26053 1
148 . 1 1 19 19 VAL HG23 H 1 -0.187 0.005 . 2 . 644 . A 19 VAL HG23 . 26053 1
149 . 1 1 19 19 VAL C C 13 178.250 0.008 . 1 . 457 . A 19 VAL C . 26053 1
150 . 1 1 19 19 VAL CA C 13 63.602 0.03 . 1 . 450 . A 19 VAL CA . 26053 1
151 . 1 1 19 19 VAL CB C 13 31.754 0.051 . 1 . 449 . A 19 VAL CB . 26053 1
152 . 1 1 19 19 VAL CG1 C 13 21.946 0.017 . 2 . 513 . A 19 VAL CG1 . 26053 1
153 . 1 1 19 19 VAL CG2 C 13 20.671 0.017 . 2 . 512 . A 19 VAL CG2 . 26053 1
154 . 1 1 19 19 VAL N N 15 123.887 0.078 . 1 . 170 . A 19 VAL N . 26053 1
155 . 1 1 20 20 GLN H H 1 8.577 0.008 . 1 . 191 . A 20 GLN H . 26053 1
156 . 1 1 20 20 GLN HA H 1 4.478 0.003 . 1 . 647 . A 20 GLN HA . 26053 1
157 . 1 1 20 20 GLN HB2 H 1 2.458 0.008 . 2 . 648 . A 20 GLN HB2 . 26053 1
158 . 1 1 20 20 GLN HB3 H 1 2.216 0.007 . 2 . 649 . A 20 GLN HB3 . 26053 1
159 . 1 1 20 20 GLN HG2 H 1 2.548 0.011 . 2 . 650 . A 20 GLN HG2 . 26053 1
160 . 1 1 20 20 GLN HG3 H 1 2.415 0.011 . 2 . 651 . A 20 GLN HG3 . 26053 1
161 . 1 1 20 20 GLN HE21 H 1 7.546 0.003 . 1 . 1055 . A 20 GLN HE21 . 26053 1
162 . 1 1 20 20 GLN HE22 H 1 6.950 0.003 . 1 . 1056 . A 20 GLN HE22 . 26053 1
163 . 1 1 20 20 GLN C C 13 176.620 0.013 . 1 . 458 . A 20 GLN C . 26053 1
164 . 1 1 20 20 GLN CA C 13 55.106 0.057 . 1 . 448 . A 20 GLN CA . 26053 1
165 . 1 1 20 20 GLN CB C 13 27.095 0.034 . 1 . 447 . A 20 GLN CB . 26053 1
166 . 1 1 20 20 GLN CG C 13 33.806 0.089 . 1 . 514 . A 20 GLN CG . 26053 1
167 . 1 1 20 20 GLN N N 15 130.865 0.109 . 1 . 192 . A 20 GLN N . 26053 1
168 . 1 1 20 20 GLN NE2 N 15 112.325 0.044 . 1 . 1054 . A 20 GLN NE2 . 26053 1
169 . 1 1 21 21 ARG H H 1 8.300 0.003 . 1 . 99 . A 21 ARG H . 26053 1
170 . 1 1 21 21 ARG HA H 1 4.408 0.007 . 1 . 1122 . A 21 ARG HA . 26053 1
171 . 1 1 21 21 ARG HB2 H 1 1.385 0.006 . 2 . 1126 . A 21 ARG HB2 . 26053 1
172 . 1 1 21 21 ARG HB3 H 1 1.512 0.009 . 2 . 1127 . A 21 ARG HB3 . 26053 1
173 . 1 1 21 21 ARG HG2 H 1 1.386 0.011 . 2 . 1123 . A 21 ARG HG2 . 26053 1
174 . 1 1 21 21 ARG HG3 H 1 1.277 0.006 . 2 . 1125 . A 21 ARG HG3 . 26053 1
175 . 1 1 21 21 ARG HD2 H 1 2.754 0.013 . 2 . 1128 . A 21 ARG HD2 . 26053 1
176 . 1 1 21 21 ARG HD3 H 1 1.712 0.009 . 2 . 1130 . A 21 ARG HD3 . 26053 1
177 . 1 1 21 21 ARG C C 13 179.861 0.1 . 1 . 459 . A 21 ARG C . 26053 1
178 . 1 1 21 21 ARG CA C 13 59.801 0.063 . 1 . 461 . A 21 ARG CA . 26053 1
179 . 1 1 21 21 ARG CB C 13 29.236 0.053 . 1 . 460 . A 21 ARG CB . 26053 1
180 . 1 1 21 21 ARG CG C 13 30.547 0.097 . 1 . 1124 . A 21 ARG CG . 26053 1
181 . 1 1 21 21 ARG CD C 13 42.512 0.053 . 1 . 1129 . A 21 ARG CD . 26053 1
182 . 1 1 21 21 ARG N N 15 123.701 0.078 . 1 . 100 . A 21 ARG N . 26053 1
183 . 1 1 22 22 SER HA H 1 4.130 0.002 . 1 . 652 . A 22 SER HA . 26053 1
184 . 1 1 22 22 SER HB2 H 1 3.864 0.005 . 2 . 653 . A 22 SER HB2 . 26053 1
185 . 1 1 22 22 SER HB3 H 1 3.973 0.012 . 2 . 654 . A 22 SER HB3 . 26053 1
186 . 1 1 22 22 SER C C 13 174.676 0.1 . 1 . 585 . A 22 SER C . 26053 1
187 . 1 1 22 22 SER CA C 13 60.001 0.071 . 1 . 515 . A 22 SER CA . 26053 1
188 . 1 1 22 22 SER CB C 13 62.566 0.079 . 1 . 516 . A 22 SER CB . 26053 1
189 . 1 1 23 23 ALA H H 1 7.169 0.003 . 1 . 133 . A 23 ALA H . 26053 1
190 . 1 1 23 23 ALA HA H 1 4.200 0.007 . 1 . 655 . A 23 ALA HA . 26053 1
191 . 1 1 23 23 ALA HB1 H 1 1.286 0.011 . 1 . 656 . A 23 ALA HB1 . 26053 1
192 . 1 1 23 23 ALA HB2 H 1 1.286 0.011 . 1 . 656 . A 23 ALA HB2 . 26053 1
193 . 1 1 23 23 ALA HB3 H 1 1.286 0.011 . 1 . 656 . A 23 ALA HB3 . 26053 1
194 . 1 1 23 23 ALA C C 13 175.928 0.013 . 1 . 426 . A 23 ALA C . 26053 1
195 . 1 1 23 23 ALA CA C 13 51.877 0.031 . 1 . 424 . A 23 ALA CA . 26053 1
196 . 1 1 23 23 ALA CB C 13 19.223 0.017 . 1 . 425 . A 23 ALA CB . 26053 1
197 . 1 1 23 23 ALA N N 15 123.313 0.094 . 1 . 134 . A 23 ALA N . 26053 1
198 . 1 1 24 24 SER H H 1 6.783 0.004 . 1 . 71 . A 24 SER H . 26053 1
199 . 1 1 24 24 SER HA H 1 2.953 0.015 . 1 . 657 . A 24 SER HA . 26053 1
200 . 1 1 24 24 SER HB2 H 1 3.717 0.008 . 2 . 658 . A 24 SER HB2 . 26053 1
201 . 1 1 24 24 SER HB3 H 1 3.857 0.005 . 2 . 659 . A 24 SER HB3 . 26053 1
202 . 1 1 24 24 SER C C 13 176.587 0.01 . 1 . 427 . A 24 SER C . 26053 1
203 . 1 1 24 24 SER CA C 13 58.740 0.021 . 1 . 421 . A 24 SER CA . 26053 1
204 . 1 1 24 24 SER CB C 13 62.830 0.025 . 1 . 420 . A 24 SER CB . 26053 1
205 . 1 1 24 24 SER N N 15 107.662 0.08 . 1 . 72 . A 24 SER N . 26053 1
206 . 1 1 25 25 ARG H H 1 7.577 0.007 . 1 . 77 . A 25 ARG H . 26053 1
207 . 1 1 25 25 ARG HA H 1 4.216 0.008 . 1 . 660 . A 25 ARG HA . 26053 1
208 . 1 1 25 25 ARG HB2 H 1 1.957 0.007 . 2 . 663 . A 25 ARG HB2 . 26053 1
209 . 1 1 25 25 ARG HB3 H 1 1.702 0.01 . 2 . 664 . A 25 ARG HB3 . 26053 1
210 . 1 1 25 25 ARG HG2 H 1 1.797 0.012 . 2 . 665 . A 25 ARG HG2 . 26053 1
211 . 1 1 25 25 ARG HG3 H 1 1.845 0.007 . 2 . 666 . A 25 ARG HG3 . 26053 1
212 . 1 1 25 25 ARG HD2 H 1 3.332 0.006 . 2 . 661 . A 25 ARG HD2 . 26053 1
213 . 1 1 25 25 ARG HD3 H 1 3.331 0.006 . 2 . 662 . A 25 ARG HD3 . 26053 1
214 . 1 1 25 25 ARG C C 13 175.713 0.004 . 1 . 428 . A 25 ARG C . 26053 1
215 . 1 1 25 25 ARG CA C 13 56.688 0.044 . 1 . 418 . A 25 ARG CA . 26053 1
216 . 1 1 25 25 ARG CB C 13 30.118 0.066 . 1 . 419 . A 25 ARG CB . 26053 1
217 . 1 1 25 25 ARG CG C 13 27.072 0.082 . 1 . 518 . A 25 ARG CG . 26053 1
218 . 1 1 25 25 ARG CD C 13 41.640 0.035 . 1 . 517 . A 25 ARG CD . 26053 1
219 . 1 1 25 25 ARG N N 15 125.512 0.064 . 1 . 78 . A 25 ARG N . 26053 1
220 . 1 1 26 26 VAL H H 1 7.170 0.005 . 1 . 35 . A 26 VAL H . 26053 1
221 . 1 1 26 26 VAL HA H 1 4.055 0.008 . 1 . 667 . A 26 VAL HA . 26053 1
222 . 1 1 26 26 VAL HB H 1 1.557 0.01 . 1 . 668 . A 26 VAL HB . 26053 1
223 . 1 1 26 26 VAL HG11 H 1 0.677 0.01 . 2 . 670 . A 26 VAL HG11 . 26053 1
224 . 1 1 26 26 VAL HG12 H 1 0.677 0.01 . 2 . 670 . A 26 VAL HG12 . 26053 1
225 . 1 1 26 26 VAL HG13 H 1 0.677 0.01 . 2 . 670 . A 26 VAL HG13 . 26053 1
226 . 1 1 26 26 VAL HG21 H 1 0.705 0.014 . 2 . 851 . A 26 VAL HG21 . 26053 1
227 . 1 1 26 26 VAL HG22 H 1 0.705 0.014 . 2 . 851 . A 26 VAL HG22 . 26053 1
228 . 1 1 26 26 VAL HG23 H 1 0.705 0.014 . 2 . 851 . A 26 VAL HG23 . 26053 1
229 . 1 1 26 26 VAL C C 13 174.155 0.004 . 1 . 429 . A 26 VAL C . 26053 1
230 . 1 1 26 26 VAL CA C 13 60.800 0.015 . 1 . 416 . A 26 VAL CA . 26053 1
231 . 1 1 26 26 VAL CB C 13 34.919 0.024 . 1 . 417 . A 26 VAL CB . 26053 1
232 . 1 1 26 26 VAL CG1 C 13 20.371 0.056 . 2 . 519 . A 26 VAL CG1 . 26053 1
233 . 1 1 26 26 VAL CG2 C 13 21.852 0.042 . 2 . 850 . A 26 VAL CG2 . 26053 1
234 . 1 1 26 26 VAL N N 15 115.894 0.096 . 1 . 36 . A 26 VAL N . 26053 1
235 . 1 1 27 27 ALA H H 1 8.567 0.004 . 1 . 43 . A 27 ALA H . 26053 1
236 . 1 1 27 27 ALA HA H 1 4.229 0.011 . 1 . 671 . A 27 ALA HA . 26053 1
237 . 1 1 27 27 ALA HB1 H 1 1.320 0.014 . 1 . 672 . A 27 ALA HB1 . 26053 1
238 . 1 1 27 27 ALA HB2 H 1 1.320 0.014 . 1 . 672 . A 27 ALA HB2 . 26053 1
239 . 1 1 27 27 ALA HB3 H 1 1.320 0.014 . 1 . 672 . A 27 ALA HB3 . 26053 1
240 . 1 1 27 27 ALA C C 13 177.483 0.016 . 1 . 430 . A 27 ALA C . 26053 1
241 . 1 1 27 27 ALA CA C 13 52.826 0.032 . 1 . 415 . A 27 ALA CA . 26053 1
242 . 1 1 27 27 ALA CB C 13 18.806 0.021 . 1 . 414 . A 27 ALA CB . 26053 1
243 . 1 1 27 27 ALA N N 15 131.113 0.082 . 1 . 44 . A 27 ALA N . 26053 1
244 . 1 1 28 28 TYR H H 1 8.365 0.009 . 1 . 33 . A 28 TYR H . 26053 1
245 . 1 1 28 28 TYR HA H 1 4.346 0.01 . 1 . 673 . A 28 TYR HA . 26053 1
246 . 1 1 28 28 TYR HB2 H 1 3.006 0.004 . 2 . 674 . A 28 TYR HB2 . 26053 1
247 . 1 1 28 28 TYR HB3 H 1 2.779 0.01 . 2 . 675 . A 28 TYR HB3 . 26053 1
248 . 1 1 28 28 TYR HD1 H 1 7.350 0.003 . 1 . 1115 . A 28 TYR HD1 . 26053 1
249 . 1 1 28 28 TYR HD2 H 1 7.350 0.003 . 1 . 1115 . A 28 TYR HD2 . 26053 1
250 . 1 1 28 28 TYR HE1 H 1 6.914 0.005 . 1 . 1116 . A 28 TYR HE1 . 26053 1
251 . 1 1 28 28 TYR HE2 H 1 6.914 0.005 . 1 . 1116 . A 28 TYR HE2 . 26053 1
252 . 1 1 28 28 TYR C C 13 177.815 0.025 . 1 . 431 . A 28 TYR C . 26053 1
253 . 1 1 28 28 TYR CA C 13 59.043 0.058 . 1 . 412 . A 28 TYR CA . 26053 1
254 . 1 1 28 28 TYR CB C 13 39.400 0.061 . 1 . 413 . A 28 TYR CB . 26053 1
255 . 1 1 28 28 TYR CD1 C 13 133.520 0.045 . 1 . 1131 . A 28 TYR CD1 . 26053 1
256 . 1 1 28 28 TYR CD2 C 13 133.520 0.045 . 1 . 1131 . A 28 TYR CD2 . 26053 1
257 . 1 1 28 28 TYR CE1 C 13 119.259 0.095 . 1 . 1121 . A 28 TYR CE1 . 26053 1
258 . 1 1 28 28 TYR CE2 C 13 119.259 0.095 . 1 . 1121 . A 28 TYR CE2 . 26053 1
259 . 1 1 28 28 TYR N N 15 119.529 0.082 . 1 . 34 . A 28 TYR N . 26053 1
260 . 1 1 29 29 ASN H H 1 8.400 0.006 . 1 . 25 . A 29 ASN H . 26053 1
261 . 1 1 29 29 ASN HA H 1 5.004 0.003 . 1 . 677 . A 29 ASN HA . 26053 1
262 . 1 1 29 29 ASN HB2 H 1 2.674 0.005 . 2 . 678 . A 29 ASN HB2 . 26053 1
263 . 1 1 29 29 ASN HB3 H 1 3.026 0.009 . 2 . 679 . A 29 ASN HB3 . 26053 1
264 . 1 1 29 29 ASN HD21 H 1 7.574 0.005 . 1 . 1063 . A 29 ASN HD21 . 26053 1
265 . 1 1 29 29 ASN HD22 H 1 7.111 0.017 . 1 . 1065 . A 29 ASN HD22 . 26053 1
266 . 1 1 29 29 ASN C C 13 175.020 0.1 . 1 . 432 . A 29 ASN C . 26053 1
267 . 1 1 29 29 ASN CA C 13 51.137 0.044 . 1 . 433 . A 29 ASN CA . 26053 1
268 . 1 1 29 29 ASN CB C 13 39.514 0.062 . 1 . 676 . A 29 ASN CB . 26053 1
269 . 1 1 29 29 ASN N N 15 120.389 0.069 . 1 . 26 . A 29 ASN N . 26053 1
270 . 1 1 29 29 ASN ND2 N 15 111.439 0.116 . 1 . 1064 . A 29 ASN ND2 . 26053 1
271 . 1 1 30 30 GLN HA H 1 3.855 0.004 . 1 . 680 . A 30 GLN HA . 26053 1
272 . 1 1 30 30 GLN HB2 H 1 2.072 0.004 . 2 . 683 . A 30 GLN HB2 . 26053 1
273 . 1 1 30 30 GLN HB3 H 1 2.232 0.004 . 2 . 684 . A 30 GLN HB3 . 26053 1
274 . 1 1 30 30 GLN HG2 H 1 2.412 0.004 . 2 . 681 . A 30 GLN HG2 . 26053 1
275 . 1 1 30 30 GLN HG3 H 1 2.543 0.009 . 2 . 682 . A 30 GLN HG3 . 26053 1
276 . 1 1 30 30 GLN HE21 H 1 6.826 0.005 . 1 . 1028 . A 30 GLN HE21 . 26053 1
277 . 1 1 30 30 GLN HE22 H 1 8.070 0.009 . 1 . 1030 . A 30 GLN HE22 . 26053 1
278 . 1 1 30 30 GLN C C 13 176.594 0.006 . 1 . 579 . A 30 GLN C . 26053 1
279 . 1 1 30 30 GLN CA C 13 58.360 0.045 . 1 . 575 . A 30 GLN CA . 26053 1
280 . 1 1 30 30 GLN CB C 13 28.491 0.018 . 1 . 577 . A 30 GLN CB . 26053 1
281 . 1 1 30 30 GLN CG C 13 33.363 0.1 . 1 . 576 . A 30 GLN CG . 26053 1
282 . 1 1 30 30 GLN NE2 N 15 115.884 0.041 . 1 . 1029 . A 30 GLN NE2 . 26053 1
283 . 1 1 31 31 SER H H 1 8.126 0.005 . 1 . 139 . A 31 SER H . 26053 1
284 . 1 1 31 31 SER HA H 1 4.292 0.005 . 1 . 685 . A 31 SER HA . 26053 1
285 . 1 1 31 31 SER HB2 H 1 3.999 0.004 . 1 . 686 . A 31 SER HB2 . 26053 1
286 . 1 1 31 31 SER HB3 H 1 3.999 0.004 . 1 . 687 . A 31 SER HB3 . 26053 1
287 . 1 1 31 31 SER C C 13 176.597 0.008 . 1 . 297 . A 31 SER C . 26053 1
288 . 1 1 31 31 SER CA C 13 61.708 0.17 . 1 . 295 . A 31 SER CA . 26053 1
289 . 1 1 31 31 SER CB C 13 62.968 0.007 . 1 . 296 . A 31 SER CB . 26053 1
290 . 1 1 31 31 SER N N 15 112.516 0.062 . 1 . 140 . A 31 SER N . 26053 1
291 . 1 1 32 32 ALA H H 1 7.173 0.007 . 1 . 422 . A 32 ALA H . 26053 1
292 . 1 1 32 32 ALA HA H 1 4.493 0.004 . 1 . 689 . A 32 ALA HA . 26053 1
293 . 1 1 32 32 ALA HB1 H 1 1.641 0.008 . 1 . 688 . A 32 ALA HB1 . 26053 1
294 . 1 1 32 32 ALA HB2 H 1 1.641 0.008 . 1 . 688 . A 32 ALA HB2 . 26053 1
295 . 1 1 32 32 ALA HB3 H 1 1.641 0.008 . 1 . 688 . A 32 ALA HB3 . 26053 1
296 . 1 1 32 32 ALA C C 13 179.520 0.003 . 1 . 246 . A 32 ALA C . 26053 1
297 . 1 1 32 32 ALA CA C 13 54.590 0.035 . 1 . 521 . A 32 ALA CA . 26053 1
298 . 1 1 32 32 ALA CB C 13 18.225 0.029 . 1 . 520 . A 32 ALA CB . 26053 1
299 . 1 1 32 32 ALA N N 15 123.537 0.079 . 1 . 423 . A 32 ALA N . 26053 1
300 . 1 1 33 33 ILE H H 1 7.897 0.003 . 1 . 147 . A 33 ILE H . 26053 1
301 . 1 1 33 33 ILE HA H 1 3.369 0.01 . 1 . 690 . A 33 ILE HA . 26053 1
302 . 1 1 33 33 ILE HB H 1 1.738 0.003 . 1 . 691 . A 33 ILE HB . 26053 1
303 . 1 1 33 33 ILE HG12 H 1 1.663 0.014 . 2 . 692 . A 33 ILE HG12 . 26053 1
304 . 1 1 33 33 ILE HG13 H 1 0.497 0.008 . 2 . 693 . A 33 ILE HG13 . 26053 1
305 . 1 1 33 33 ILE HG21 H 1 0.788 0.004 . 1 . 694 . A 33 ILE HG21 . 26053 1
306 . 1 1 33 33 ILE HG22 H 1 0.788 0.004 . 1 . 694 . A 33 ILE HG22 . 26053 1
307 . 1 1 33 33 ILE HG23 H 1 0.788 0.004 . 1 . 694 . A 33 ILE HG23 . 26053 1
308 . 1 1 33 33 ILE HD11 H 1 0.977 0.007 . 1 . 695 . A 33 ILE HD11 . 26053 1
309 . 1 1 33 33 ILE HD12 H 1 0.977 0.007 . 1 . 695 . A 33 ILE HD12 . 26053 1
310 . 1 1 33 33 ILE HD13 H 1 0.977 0.007 . 1 . 695 . A 33 ILE HD13 . 26053 1
311 . 1 1 33 33 ILE C C 13 178.317 0.006 . 1 . 247 . A 33 ILE C . 26053 1
312 . 1 1 33 33 ILE CA C 13 65.396 0.033 . 1 . 216 . A 33 ILE CA . 26053 1
313 . 1 1 33 33 ILE CB C 13 38.729 0.028 . 1 . 215 . A 33 ILE CB . 26053 1
314 . 1 1 33 33 ILE CG1 C 13 29.735 0.101 . 1 . 522 . A 33 ILE CG1 . 26053 1
315 . 1 1 33 33 ILE CG2 C 13 17.722 0.022 . 1 . 523 . A 33 ILE CG2 . 26053 1
316 . 1 1 33 33 ILE CD1 C 13 14.795 0.026 . 1 . 524 . A 33 ILE CD1 . 26053 1
317 . 1 1 33 33 ILE N N 15 120.916 0.058 . 1 . 148 . A 33 ILE N . 26053 1
318 . 1 1 34 34 ASP H H 1 8.621 0.006 . 1 . 1 . A 34 ASP H . 26053 1
319 . 1 1 34 34 ASP HA H 1 4.474 0.007 . 1 . 696 . A 34 ASP HA . 26053 1
320 . 1 1 34 34 ASP HB2 H 1 2.769 0.005 . 2 . 697 . A 34 ASP HB2 . 26053 1
321 . 1 1 34 34 ASP HB3 H 1 2.769 0.006 . 2 . 698 . A 34 ASP HB3 . 26053 1
322 . 1 1 34 34 ASP C C 13 177.492 0.003 . 1 . 248 . A 34 ASP C . 26053 1
323 . 1 1 34 34 ASP CA C 13 56.148 0.05 . 1 . 217 . A 34 ASP CA . 26053 1
324 . 1 1 34 34 ASP CB C 13 40.404 0.059 . 1 . 218 . A 34 ASP CB . 26053 1
325 . 1 1 34 34 ASP N N 15 118.107 0.061 . 1 . 2 . A 34 ASP N . 26053 1
326 . 1 1 35 35 ASP H H 1 7.517 0.003 . 1 . 125 . A 35 ASP H . 26053 1
327 . 1 1 35 35 ASP HA H 1 4.999 0.004 . 1 . 701 . A 35 ASP HA . 26053 1
328 . 1 1 35 35 ASP HB2 H 1 3.569 0.005 . 2 . 699 . A 35 ASP HB2 . 26053 1
329 . 1 1 35 35 ASP HB3 H 1 2.619 0.005 . 2 . 700 . A 35 ASP HB3 . 26053 1
330 . 1 1 35 35 ASP C C 13 178.253 0.005 . 1 . 249 . A 35 ASP C . 26053 1
331 . 1 1 35 35 ASP CA C 13 52.148 0.022 . 1 . 219 . A 35 ASP CA . 26053 1
332 . 1 1 35 35 ASP CB C 13 38.344 0.047 . 1 . 220 . A 35 ASP CB . 26053 1
333 . 1 1 35 35 ASP N N 15 122.965 0.08 . 1 . 126 . A 35 ASP N . 26053 1
334 . 1 1 36 36 SER H H 1 7.895 0.003 . 1 . 61 . A 36 SER H . 26053 1
335 . 1 1 36 36 SER HA H 1 3.939 0.012 . 1 . 702 . A 36 SER HA . 26053 1
336 . 1 1 36 36 SER HB2 H 1 3.915 0.01 . 2 . 703 . A 36 SER HB2 . 26053 1
337 . 1 1 36 36 SER HB3 H 1 3.909 0.0 . 2 . 704 . A 36 SER HB3 . 26053 1
338 . 1 1 36 36 SER C C 13 175.351 0.026 . 1 . 250 . A 36 SER C . 26053 1
339 . 1 1 36 36 SER CA C 13 61.027 0.031 . 1 . 222 . A 36 SER CA . 26053 1
340 . 1 1 36 36 SER CB C 13 63.764 0.024 . 1 . 221 . A 36 SER CB . 26053 1
341 . 1 1 36 36 SER N N 15 115.620 0.08 . 1 . 62 . A 36 SER N . 26053 1
342 . 1 1 37 37 ASN H H 1 8.888 0.003 . 1 . 209 . A 37 ASN H . 26053 1
343 . 1 1 37 37 ASN HA H 1 5.045 0.006 . 1 . 705 . A 37 ASN HA . 26053 1
344 . 1 1 37 37 ASN HB2 H 1 3.035 0.004 . 2 . 706 . A 37 ASN HB2 . 26053 1
345 . 1 1 37 37 ASN HB3 H 1 2.787 0.004 . 2 . 707 . A 37 ASN HB3 . 26053 1
346 . 1 1 37 37 ASN HD21 H 1 6.984 0.013 . 1 . 1046 . A 37 ASN HD21 . 26053 1
347 . 1 1 37 37 ASN HD22 H 1 7.612 0.004 . 1 . 1047 . A 37 ASN HD22 . 26053 1
348 . 1 1 37 37 ASN C C 13 174.922 0.009 . 1 . 251 . A 37 ASN C . 26053 1
349 . 1 1 37 37 ASN CA C 13 52.628 0.02 . 1 . 224 . A 37 ASN CA . 26053 1
350 . 1 1 37 37 ASN CB C 13 38.811 0.028 . 1 . 223 . A 37 ASN CB . 26053 1
351 . 1 1 37 37 ASN N N 15 117.533 0.071 . 1 . 210 . A 37 ASN N . 26053 1
352 . 1 1 37 37 ASN ND2 N 15 113.236 0.042 . 1 . 1045 . A 37 ASN ND2 . 26053 1
353 . 1 1 38 38 ASN H H 1 7.368 0.004 . 1 . 45 . A 38 ASN H . 26053 1
354 . 1 1 38 38 ASN HA H 1 4.362 0.008 . 1 . 708 . A 38 ASN HA . 26053 1
355 . 1 1 38 38 ASN HB2 H 1 2.770 0.011 . 2 . 709 . A 38 ASN HB2 . 26053 1
356 . 1 1 38 38 ASN HB3 H 1 2.561 0.013 . 2 . 710 . A 38 ASN HB3 . 26053 1
357 . 1 1 38 38 ASN HD21 H 1 6.822 0.005 . 1 . 1032 . A 38 ASN HD21 . 26053 1
358 . 1 1 38 38 ASN HD22 H 1 8.288 0.01 . 1 . 1066 . A 38 ASN HD22 . 26053 1
359 . 1 1 38 38 ASN C C 13 178.064 0.1 . 1 . 252 . A 38 ASN C . 26053 1
360 . 1 1 38 38 ASN CA C 13 55.100 0.033 . 1 . 226 . A 38 ASN CA . 26053 1
361 . 1 1 38 38 ASN CB C 13 39.142 0.071 . 1 . 225 . A 38 ASN CB . 26053 1
362 . 1 1 38 38 ASN N N 15 120.658 0.082 . 1 . 46 . A 38 ASN N . 26053 1
363 . 1 1 38 38 ASN ND2 N 15 115.063 0.041 . 1 . 1031 . A 38 ASN ND2 . 26053 1
364 . 1 1 39 39 SER HA H 1 4.233 0.013 . 1 . 711 . A 39 SER HA . 26053 1
365 . 1 1 39 39 SER HB2 H 1 3.990 0.006 . 2 . 712 . A 39 SER HB2 . 26053 1
366 . 1 1 39 39 SER HB3 H 1 4.052 0.011 . 2 . 1132 . A 39 SER HB3 . 26053 1
367 . 1 1 39 39 SER C C 13 176.654 0.002 . 1 . 586 . A 39 SER C . 26053 1
368 . 1 1 39 39 SER CA C 13 60.990 0.031 . 1 . 525 . A 39 SER CA . 26053 1
369 . 1 1 39 39 SER CB C 13 62.854 0.09 . 1 . 526 . A 39 SER CB . 26053 1
370 . 1 1 40 40 ALA H H 1 9.496 0.004 . 1 . 83 . A 40 ALA H . 26053 1
371 . 1 1 40 40 ALA HA H 1 3.793 0.002 . 1 . 714 . A 40 ALA HA . 26053 1
372 . 1 1 40 40 ALA HB1 H 1 0.622 0.01 . 1 . 713 . A 40 ALA HB1 . 26053 1
373 . 1 1 40 40 ALA HB2 H 1 0.622 0.01 . 1 . 713 . A 40 ALA HB2 . 26053 1
374 . 1 1 40 40 ALA HB3 H 1 0.622 0.01 . 1 . 713 . A 40 ALA HB3 . 26053 1
375 . 1 1 40 40 ALA C C 13 177.247 0.007 . 1 . 342 . A 40 ALA C . 26053 1
376 . 1 1 40 40 ALA CA C 13 54.431 0.032 . 1 . 340 . A 40 ALA CA . 26053 1
377 . 1 1 40 40 ALA CB C 13 19.446 0.036 . 1 . 341 . A 40 ALA CB . 26053 1
378 . 1 1 40 40 ALA N N 15 127.247 0.059 . 1 . 84 . A 40 ALA N . 26053 1
379 . 1 1 41 41 TRP H H 1 7.350 0.006 . 1 . 197 . A 41 TRP H . 26053 1
380 . 1 1 41 41 TRP HA H 1 4.810 0.008 . 1 . 717 . A 41 TRP HA . 26053 1
381 . 1 1 41 41 TRP HB2 H 1 3.498 0.008 . 2 . 715 . A 41 TRP HB2 . 26053 1
382 . 1 1 41 41 TRP HB3 H 1 3.225 0.017 . 2 . 716 . A 41 TRP HB3 . 26053 1
383 . 1 1 41 41 TRP HD1 H 1 7.352 0.004 . 1 . 1068 . A 41 TRP HD1 . 26053 1
384 . 1 1 41 41 TRP HE1 H 1 9.178 0.01 . 1 . 27 . A 41 TRP HE1 . 26053 1
385 . 1 1 41 41 TRP HE3 H 1 7.253 0.004 . 1 . 1138 . A 41 TRP HE3 . 26053 1
386 . 1 1 41 41 TRP HZ2 H 1 6.813 0.005 . 1 . 1070 . A 41 TRP HZ2 . 26053 1
387 . 1 1 41 41 TRP HZ3 H 1 6.962 0.019 . 1 . 1074 . A 41 TRP HZ3 . 26053 1
388 . 1 1 41 41 TRP HH2 H 1 6.637 0.004 . 1 . 1072 . A 41 TRP HH2 . 26053 1
389 . 1 1 41 41 TRP C C 13 177.625 0.002 . 1 . 343 . A 41 TRP C . 26053 1
390 . 1 1 41 41 TRP CA C 13 56.475 0.073 . 1 . 338 . A 41 TRP CA . 26053 1
391 . 1 1 41 41 TRP CB C 13 31.210 0.016 . 1 . 339 . A 41 TRP CB . 26053 1
392 . 1 1 41 41 TRP CD1 C 13 129.095 0.082 . 1 . 1067 . A 41 TRP CD1 . 26053 1
393 . 1 1 41 41 TRP CE3 C 13 120.528 0.031 . 1 . 1139 . A 41 TRP CE3 . 26053 1
394 . 1 1 41 41 TRP CZ2 C 13 114.237 0.025 . 1 . 1069 . A 41 TRP CZ2 . 26053 1
395 . 1 1 41 41 TRP CZ3 C 13 121.571 0.084 . 1 . 1073 . A 41 TRP CZ3 . 26053 1
396 . 1 1 41 41 TRP CH2 C 13 124.173 0.051 . 1 . 1071 . A 41 TRP CH2 . 26053 1
397 . 1 1 41 41 TRP N N 15 110.195 0.062 . 1 . 198 . A 41 TRP N . 26053 1
398 . 1 1 41 41 TRP NE1 N 15 127.603 0.029 . 1 . 28 . A 41 TRP NE1 . 26053 1
399 . 1 1 42 42 ASP H H 1 7.594 0.004 . 1 . 187 . A 42 ASP H . 26053 1
400 . 1 1 42 42 ASP HA H 1 4.681 0.001 . 1 . 720 . A 42 ASP HA . 26053 1
401 . 1 1 42 42 ASP HB2 H 1 2.694 0.002 . 2 . 718 . A 42 ASP HB2 . 26053 1
402 . 1 1 42 42 ASP HB3 H 1 2.602 0.011 . 2 . 719 . A 42 ASP HB3 . 26053 1
403 . 1 1 42 42 ASP C C 13 177.474 0.002 . 1 . 344 . A 42 ASP C . 26053 1
404 . 1 1 42 42 ASP CA C 13 54.770 0.026 . 1 . 337 . A 42 ASP CA . 26053 1
405 . 1 1 42 42 ASP CB C 13 39.988 0.026 . 1 . 336 . A 42 ASP CB . 26053 1
406 . 1 1 42 42 ASP N N 15 119.378 0.062 . 1 . 188 . A 42 ASP N . 26053 1
407 . 1 1 43 43 PHE H H 1 9.220 0.005 . 1 . 47 . A 43 PHE H . 26053 1
408 . 1 1 43 43 PHE HA H 1 4.247 0.011 . 1 . 723 . A 43 PHE HA . 26053 1
409 . 1 1 43 43 PHE HB2 H 1 3.209 0.006 . 2 . 721 . A 43 PHE HB2 . 26053 1
410 . 1 1 43 43 PHE HB3 H 1 2.977 0.014 . 2 . 722 . A 43 PHE HB3 . 26053 1
411 . 1 1 43 43 PHE HD1 H 1 7.337 0.005 . 1 . 1075 . A 43 PHE HD1 . 26053 1
412 . 1 1 43 43 PHE HD2 H 1 7.337 0.005 . 1 . 1075 . A 43 PHE HD2 . 26053 1
413 . 1 1 43 43 PHE HE1 H 1 6.646 0.004 . 1 . 1077 . A 43 PHE HE1 . 26053 1
414 . 1 1 43 43 PHE HE2 H 1 6.646 0.004 . 1 . 1077 . A 43 PHE HE2 . 26053 1
415 . 1 1 43 43 PHE HZ H 1 6.006 0.01 . 1 . 1079 . A 43 PHE HZ . 26053 1
416 . 1 1 43 43 PHE C C 13 178.141 0.015 . 1 . 329 . A 43 PHE C . 26053 1
417 . 1 1 43 43 PHE CA C 13 59.037 0.031 . 1 . 328 . A 43 PHE CA . 26053 1
418 . 1 1 43 43 PHE CB C 13 40.123 0.075 . 1 . 327 . A 43 PHE CB . 26053 1
419 . 1 1 43 43 PHE CD1 C 13 132.120 0.065 . 1 . 1076 . A 43 PHE CD1 . 26053 1
420 . 1 1 43 43 PHE CD2 C 13 132.120 0.065 . 1 . 1076 . A 43 PHE CD2 . 26053 1
421 . 1 1 43 43 PHE CE1 C 13 130.387 0.061 . 1 . 1078 . A 43 PHE CE1 . 26053 1
422 . 1 1 43 43 PHE CE2 C 13 130.387 0.061 . 1 . 1078 . A 43 PHE CE2 . 26053 1
423 . 1 1 43 43 PHE CZ C 13 128.731 0.046 . 1 . 1080 . A 43 PHE CZ . 26053 1
424 . 1 1 43 43 PHE N N 15 124.914 0.07 . 1 . 48 . A 43 PHE N . 26053 1
425 . 1 1 44 44 ALA H H 1 8.354 0.005 . 1 . 85 . A 44 ALA H . 26053 1
426 . 1 1 44 44 ALA HA H 1 4.553 0.013 . 1 . 725 . A 44 ALA HA . 26053 1
427 . 1 1 44 44 ALA HB1 H 1 1.645 0.005 . 1 . 724 . A 44 ALA HB1 . 26053 1
428 . 1 1 44 44 ALA HB2 H 1 1.645 0.005 . 1 . 724 . A 44 ALA HB2 . 26053 1
429 . 1 1 44 44 ALA HB3 H 1 1.645 0.005 . 1 . 724 . A 44 ALA HB3 . 26053 1
430 . 1 1 44 44 ALA C C 13 177.917 0.016 . 1 . 330 . A 44 ALA C . 26053 1
431 . 1 1 44 44 ALA CA C 13 51.597 0.012 . 1 . 326 . A 44 ALA CA . 26053 1
432 . 1 1 44 44 ALA CB C 13 19.987 0.024 . 1 . 325 . A 44 ALA CB . 26053 1
433 . 1 1 44 44 ALA N N 15 125.098 0.085 . 1 . 86 . A 44 ALA N . 26053 1
434 . 1 1 45 45 ASP H H 1 8.679 0.004 . 1 . 21 . A 45 ASP H . 26053 1
435 . 1 1 45 45 ASP HA H 1 4.427 0.003 . 1 . 726 . A 45 ASP HA . 26053 1
436 . 1 1 45 45 ASP HB2 H 1 2.625 0.004 . 1 . 727 . A 45 ASP HB2 . 26053 1
437 . 1 1 45 45 ASP HB3 H 1 2.625 0.004 . 1 . 728 . A 45 ASP HB3 . 26053 1
438 . 1 1 45 45 ASP C C 13 177.958 0.023 . 1 . 331 . A 45 ASP C . 26053 1
439 . 1 1 45 45 ASP CA C 13 56.130 0.046 . 1 . 323 . A 45 ASP CA . 26053 1
440 . 1 1 45 45 ASP CB C 13 40.655 0.03 . 1 . 324 . A 45 ASP CB . 26053 1
441 . 1 1 45 45 ASP N N 15 122.330 0.1 . 1 . 22 . A 45 ASP N . 26053 1
442 . 1 1 46 46 GLY H H 1 9.014 0.004 . 1 . 39 . A 46 GLY H . 26053 1
443 . 1 1 46 46 GLY HA2 H 1 4.148 0.009 . 2 . 729 . A 46 GLY HA2 . 26053 1
444 . 1 1 46 46 GLY HA3 H 1 3.777 0.004 . 2 . 730 . A 46 GLY HA3 . 26053 1
445 . 1 1 46 46 GLY C C 13 175.493 0.009 . 1 . 332 . A 46 GLY C . 26053 1
446 . 1 1 46 46 GLY CA C 13 46.575 0.041 . 1 . 527 . A 46 GLY CA . 26053 1
447 . 1 1 46 46 GLY N N 15 112.955 0.08 . 1 . 40 . A 46 GLY N . 26053 1
448 . 1 1 47 47 VAL H H 1 7.528 0.003 . 1 . 135 . A 47 VAL H . 26053 1
449 . 1 1 47 47 VAL HA H 1 3.663 0.007 . 1 . 735 . A 47 VAL HA . 26053 1
450 . 1 1 47 47 VAL HB H 1 2.220 0.01 . 1 . 734 . A 47 VAL HB . 26053 1
451 . 1 1 47 47 VAL HG11 H 1 0.833 0.007 . 2 . 732 . A 47 VAL HG11 . 26053 1
452 . 1 1 47 47 VAL HG12 H 1 0.833 0.007 . 2 . 732 . A 47 VAL HG12 . 26053 1
453 . 1 1 47 47 VAL HG13 H 1 0.833 0.007 . 2 . 732 . A 47 VAL HG13 . 26053 1
454 . 1 1 47 47 VAL HG21 H 1 1.002 0.007 . 2 . 733 . A 47 VAL HG21 . 26053 1
455 . 1 1 47 47 VAL HG22 H 1 1.002 0.007 . 2 . 733 . A 47 VAL HG22 . 26053 1
456 . 1 1 47 47 VAL HG23 H 1 1.002 0.007 . 2 . 733 . A 47 VAL HG23 . 26053 1
457 . 1 1 47 47 VAL C C 13 177.542 0.014 . 1 . 333 . A 47 VAL C . 26053 1
458 . 1 1 47 47 VAL CA C 13 66.909 0.026 . 1 . 321 . A 47 VAL CA . 26053 1
459 . 1 1 47 47 VAL CB C 13 32.170 0.016 . 1 . 322 . A 47 VAL CB . 26053 1
460 . 1 1 47 47 VAL CG1 C 13 24.032 0.023 . 2 . 528 . A 47 VAL CG1 . 26053 1
461 . 1 1 47 47 VAL CG2 C 13 21.290 0.018 . 2 . 731 . A 47 VAL CG2 . 26053 1
462 . 1 1 47 47 VAL N N 15 121.071 0.057 . 1 . 136 . A 47 VAL N . 26053 1
463 . 1 1 48 48 LEU H H 1 8.676 0.004 . 1 . 185 . A 48 LEU H . 26053 1
464 . 1 1 48 48 LEU HA H 1 3.667 0.007 . 1 . 736 . A 48 LEU HA . 26053 1
465 . 1 1 48 48 LEU HB2 H 1 1.196 0.01 . 2 . 737 . A 48 LEU HB2 . 26053 1
466 . 1 1 48 48 LEU HB3 H 1 0.271 0.009 . 2 . 738 . A 48 LEU HB3 . 26053 1
467 . 1 1 48 48 LEU HG H 1 1.136 0.009 . 1 . 740 . A 48 LEU HG . 26053 1
468 . 1 1 48 48 LEU HD11 H 1 0.314 0.009 . 2 . 739 . A 48 LEU HD11 . 26053 1
469 . 1 1 48 48 LEU HD12 H 1 0.314 0.009 . 2 . 739 . A 48 LEU HD12 . 26053 1
470 . 1 1 48 48 LEU HD13 H 1 0.314 0.009 . 2 . 739 . A 48 LEU HD13 . 26053 1
471 . 1 1 48 48 LEU HD21 H 1 0.314 0.008 . 2 . 741 . A 48 LEU HD21 . 26053 1
472 . 1 1 48 48 LEU HD22 H 1 0.314 0.008 . 2 . 741 . A 48 LEU HD22 . 26053 1
473 . 1 1 48 48 LEU HD23 H 1 0.314 0.008 . 2 . 741 . A 48 LEU HD23 . 26053 1
474 . 1 1 48 48 LEU C C 13 178.135 0.028 . 1 . 334 . A 48 LEU C . 26053 1
475 . 1 1 48 48 LEU CA C 13 57.973 0.04 . 1 . 320 . A 48 LEU CA . 26053 1
476 . 1 1 48 48 LEU CB C 13 39.818 0.044 . 1 . 319 . A 48 LEU CB . 26053 1
477 . 1 1 48 48 LEU CG C 13 25.994 0.134 . 1 . 530 . A 48 LEU CG . 26053 1
478 . 1 1 48 48 LEU CD1 C 13 21.348 0.073 . 2 . 529 . A 48 LEU CD1 . 26053 1
479 . 1 1 48 48 LEU CD2 C 13 25.634 0.046 . 2 . 531 . A 48 LEU CD2 . 26053 1
480 . 1 1 48 48 LEU N N 15 121.366 0.066 . 1 . 186 . A 48 LEU N . 26053 1
481 . 1 1 49 49 GLU H H 1 9.522 0.004 . 1 . 9 . A 49 GLU H . 26053 1
482 . 1 1 49 49 GLU HA H 1 3.712 0.011 . 1 . 742 . A 49 GLU HA . 26053 1
483 . 1 1 49 49 GLU HB2 H 1 1.946 0.01 . 2 . 745 . A 49 GLU HB2 . 26053 1
484 . 1 1 49 49 GLU HB3 H 1 1.840 0.009 . 2 . 746 . A 49 GLU HB3 . 26053 1
485 . 1 1 49 49 GLU HG2 H 1 2.201 0.012 . 2 . 743 . A 49 GLU HG2 . 26053 1
486 . 1 1 49 49 GLU HG3 H 1 2.447 0.015 . 2 . 744 . A 49 GLU HG3 . 26053 1
487 . 1 1 49 49 GLU C C 13 179.699 0.009 . 1 . 335 . A 49 GLU C . 26053 1
488 . 1 1 49 49 GLU CA C 13 60.416 0.051 . 1 . 346 . A 49 GLU CA . 26053 1
489 . 1 1 49 49 GLU CB C 13 28.256 0.02 . 1 . 345 . A 49 GLU CB . 26053 1
490 . 1 1 49 49 GLU CG C 13 36.799 0.038 . 1 . 532 . A 49 GLU CG . 26053 1
491 . 1 1 49 49 GLU N N 15 117.565 0.06 . 1 . 10 . A 49 GLU N . 26053 1
492 . 1 1 50 50 GLN H H 1 7.704 0.003 . 1 . 53 . A 50 GLN H . 26053 1
493 . 1 1 50 50 GLN HA H 1 4.175 0.013 . 1 . 751 . A 50 GLN HA . 26053 1
494 . 1 1 50 50 GLN HB2 H 1 2.425 0.007 . 2 . 747 . A 50 GLN HB2 . 26053 1
495 . 1 1 50 50 GLN HB3 H 1 2.232 0.006 . 2 . 748 . A 50 GLN HB3 . 26053 1
496 . 1 1 50 50 GLN HG2 H 1 2.232 0.005 . 2 . 749 . A 50 GLN HG2 . 26053 1
497 . 1 1 50 50 GLN HG3 H 1 2.426 0.007 . 2 . 750 . A 50 GLN HG3 . 26053 1
498 . 1 1 50 50 GLN HE21 H 1 7.396 0.005 . 1 . 1058 . A 50 GLN HE21 . 26053 1
499 . 1 1 50 50 GLN HE22 H 1 6.846 0.006 . 1 . 1059 . A 50 GLN HE22 . 26053 1
500 . 1 1 50 50 GLN C C 13 178.696 0.005 . 1 . 357 . A 50 GLN C . 26053 1
501 . 1 1 50 50 GLN CA C 13 58.736 0.026 . 1 . 347 . A 50 GLN CA . 26053 1
502 . 1 1 50 50 GLN CB C 13 28.527 0.039 . 1 . 348 . A 50 GLN CB . 26053 1
503 . 1 1 50 50 GLN CG C 13 33.884 0.039 . 1 . 533 . A 50 GLN CG . 26053 1
504 . 1 1 50 50 GLN N N 15 118.639 0.066 . 1 . 54 . A 50 GLN N . 26053 1
505 . 1 1 50 50 GLN NE2 N 15 111.806 0.038 . 1 . 1057 . A 50 GLN NE2 . 26053 1
506 . 1 1 51 51 ILE H H 1 8.102 0.005 . 1 . 183 . A 51 ILE H . 26053 1
507 . 1 1 51 51 ILE HA H 1 3.663 0.011 . 1 . 752 . A 51 ILE HA . 26053 1
508 . 1 1 51 51 ILE HB H 1 1.959 0.01 . 1 . 753 . A 51 ILE HB . 26053 1
509 . 1 1 51 51 ILE HG12 H 1 1.216 0.008 . 2 . 754 . A 51 ILE HG12 . 26053 1
510 . 1 1 51 51 ILE HG13 H 1 1.647 0.011 . 2 . 755 . A 51 ILE HG13 . 26053 1
511 . 1 1 51 51 ILE HG21 H 1 0.675 0.01 . 1 . 756 . A 51 ILE HG21 . 26053 1
512 . 1 1 51 51 ILE HG22 H 1 0.675 0.01 . 1 . 756 . A 51 ILE HG22 . 26053 1
513 . 1 1 51 51 ILE HG23 H 1 0.675 0.01 . 1 . 756 . A 51 ILE HG23 . 26053 1
514 . 1 1 51 51 ILE HD11 H 1 0.679 0.008 . 1 . 757 . A 51 ILE HD11 . 26053 1
515 . 1 1 51 51 ILE HD12 H 1 0.679 0.008 . 1 . 757 . A 51 ILE HD12 . 26053 1
516 . 1 1 51 51 ILE HD13 H 1 0.679 0.008 . 1 . 757 . A 51 ILE HD13 . 26053 1
517 . 1 1 51 51 ILE C C 13 179.911 0.014 . 1 . 358 . A 51 ILE C . 26053 1
518 . 1 1 51 51 ILE CA C 13 64.113 0.041 . 1 . 349 . A 51 ILE CA . 26053 1
519 . 1 1 51 51 ILE CB C 13 37.219 0.055 . 1 . 350 . A 51 ILE CB . 26053 1
520 . 1 1 51 51 ILE CG1 C 13 28.942 0.048 . 1 . 534 . A 51 ILE CG1 . 26053 1
521 . 1 1 51 51 ILE CG2 C 13 17.327 0.025 . 1 . 535 . A 51 ILE CG2 . 26053 1
522 . 1 1 51 51 ILE CD1 C 13 14.077 0.104 . 1 . 536 . A 51 ILE CD1 . 26053 1
523 . 1 1 51 51 ILE N N 15 121.680 0.093 . 1 . 184 . A 51 ILE N . 26053 1
524 . 1 1 52 52 LEU H H 1 8.819 0.003 . 1 . 201 . A 52 LEU H . 26053 1
525 . 1 1 52 52 LEU HA H 1 3.762 0.011 . 1 . 758 . A 52 LEU HA . 26053 1
526 . 1 1 52 52 LEU HB2 H 1 1.731 0.01 . 2 . 759 . A 52 LEU HB2 . 26053 1
527 . 1 1 52 52 LEU HB3 H 1 1.017 0.005 . 2 . 760 . A 52 LEU HB3 . 26053 1
528 . 1 1 52 52 LEU HG H 1 1.491 0.01 . 1 . 763 . A 52 LEU HG . 26053 1
529 . 1 1 52 52 LEU HD11 H 1 0.557 0.014 . 2 . 761 . A 52 LEU HD11 . 26053 1
530 . 1 1 52 52 LEU HD12 H 1 0.557 0.014 . 2 . 761 . A 52 LEU HD12 . 26053 1
531 . 1 1 52 52 LEU HD13 H 1 0.557 0.014 . 2 . 761 . A 52 LEU HD13 . 26053 1
532 . 1 1 52 52 LEU HD21 H 1 -0.115 0.006 . 2 . 762 . A 52 LEU HD21 . 26053 1
533 . 1 1 52 52 LEU HD22 H 1 -0.115 0.006 . 2 . 762 . A 52 LEU HD22 . 26053 1
534 . 1 1 52 52 LEU HD23 H 1 -0.115 0.006 . 2 . 762 . A 52 LEU HD23 . 26053 1
535 . 1 1 52 52 LEU C C 13 178.767 0.004 . 1 . 359 . A 52 LEU C . 26053 1
536 . 1 1 52 52 LEU CA C 13 58.115 0.03 . 1 . 352 . A 52 LEU CA . 26053 1
537 . 1 1 52 52 LEU CB C 13 40.598 0.029 . 1 . 351 . A 52 LEU CB . 26053 1
538 . 1 1 52 52 LEU CG C 13 26.151 0.086 . 1 . 538 . A 52 LEU CG . 26053 1
539 . 1 1 52 52 LEU CD1 C 13 25.930 0.047 . 2 . 539 . A 52 LEU CD1 . 26053 1
540 . 1 1 52 52 LEU CD2 C 13 20.613 0.037 . 2 . 537 . A 52 LEU CD2 . 26053 1
541 . 1 1 52 52 LEU N N 15 123.207 0.06 . 1 . 202 . A 52 LEU N . 26053 1
542 . 1 1 53 53 ALA H H 1 8.272 0.006 . 1 . 173 . A 53 ALA H . 26053 1
543 . 1 1 53 53 ALA HA H 1 4.135 0.008 . 1 . 765 . A 53 ALA HA . 26053 1
544 . 1 1 53 53 ALA HB1 H 1 1.519 0.006 . 1 . 764 . A 53 ALA HB1 . 26053 1
545 . 1 1 53 53 ALA HB2 H 1 1.519 0.006 . 1 . 764 . A 53 ALA HB2 . 26053 1
546 . 1 1 53 53 ALA HB3 H 1 1.519 0.006 . 1 . 764 . A 53 ALA HB3 . 26053 1
547 . 1 1 53 53 ALA C C 13 181.723 0.006 . 1 . 360 . A 53 ALA C . 26053 1
548 . 1 1 53 53 ALA CA C 13 55.861 0.033 . 1 . 354 . A 53 ALA CA . 26053 1
549 . 1 1 53 53 ALA CB C 13 17.885 0.034 . 1 . 353 . A 53 ALA CB . 26053 1
550 . 1 1 53 53 ALA N N 15 122.190 0.056 . 1 . 174 . A 53 ALA N . 26053 1
551 . 1 1 54 54 THR H H 1 8.540 0.007 . 1 . 57 . A 54 THR H . 26053 1
552 . 1 1 54 54 THR HA H 1 3.910 0.007 . 1 . 766 . A 54 THR HA . 26053 1
553 . 1 1 54 54 THR HB H 1 4.192 0.008 . 1 . 767 . A 54 THR HB . 26053 1
554 . 1 1 54 54 THR HG21 H 1 1.164 0.008 . 1 . 768 . A 54 THR HG21 . 26053 1
555 . 1 1 54 54 THR HG22 H 1 1.164 0.008 . 1 . 768 . A 54 THR HG22 . 26053 1
556 . 1 1 54 54 THR HG23 H 1 1.164 0.008 . 1 . 768 . A 54 THR HG23 . 26053 1
557 . 1 1 54 54 THR C C 13 176.135 0.012 . 1 . 361 . A 54 THR C . 26053 1
558 . 1 1 54 54 THR CA C 13 66.592 0.024 . 1 . 355 . A 54 THR CA . 26053 1
559 . 1 1 54 54 THR CB C 13 68.785 0.019 . 1 . 356 . A 54 THR CB . 26053 1
560 . 1 1 54 54 THR CG2 C 13 21.248 0.023 . 1 . 540 . A 54 THR CG2 . 26053 1
561 . 1 1 54 54 THR N N 15 117.502 0.074 . 1 . 58 . A 54 THR N . 26053 1
562 . 1 1 55 55 SER H H 1 8.179 0.003 . 1 . 193 . A 55 SER H . 26053 1
563 . 1 1 55 55 SER HA H 1 4.039 0.011 . 1 . 1118 . A 55 SER HA . 26053 1
564 . 1 1 55 55 SER HB2 H 1 3.735 0.012 . 2 . 1135 . A 55 SER HB2 . 26053 1
565 . 1 1 55 55 SER HB3 H 1 3.728 0.014 . 2 . 1137 . A 55 SER HB3 . 26053 1
566 . 1 1 55 55 SER C C 13 176.165 0.021 . 1 . 362 . A 55 SER C . 26053 1
567 . 1 1 55 55 SER CA C 13 63.439 0.17 . 1 . 363 . A 55 SER CA . 26053 1
568 . 1 1 55 55 SER N N 15 118.031 0.062 . 1 . 194 . A 55 SER N . 26053 1
569 . 1 1 56 56 ARG H H 1 8.498 0.008 . 1 . 15 . A 56 ARG H . 26053 1
570 . 1 1 56 56 ARG HA H 1 4.681 0.004 . 1 . 770 . A 56 ARG HA . 26053 1
571 . 1 1 56 56 ARG HB2 H 1 2.002 0.007 . 2 . 773 . A 56 ARG HB2 . 26053 1
572 . 1 1 56 56 ARG HB3 H 1 1.793 0.015 . 2 . 774 . A 56 ARG HB3 . 26053 1
573 . 1 1 56 56 ARG HG2 H 1 1.765 0.013 . 2 . 775 . A 56 ARG HG2 . 26053 1
574 . 1 1 56 56 ARG HG3 H 1 1.514 0.012 . 2 . 776 . A 56 ARG HG3 . 26053 1
575 . 1 1 56 56 ARG HD2 H 1 3.019 0.005 . 2 . 771 . A 56 ARG HD2 . 26053 1
576 . 1 1 56 56 ARG HD3 H 1 3.252 0.008 . 2 . 772 . A 56 ARG HD3 . 26053 1
577 . 1 1 56 56 ARG C C 13 180.994 0.012 . 1 . 580 . A 56 ARG C . 26053 1
578 . 1 1 56 56 ARG CA C 13 58.688 0.024 . 1 . 441 . A 56 ARG CA . 26053 1
579 . 1 1 56 56 ARG CB C 13 30.480 0.036 . 1 . 440 . A 56 ARG CB . 26053 1
580 . 1 1 56 56 ARG CG C 13 28.926 0.076 . 1 . 582 . A 56 ARG CG . 26053 1
581 . 1 1 56 56 ARG CD C 13 43.749 0.084 . 1 . 581 . A 56 ARG CD . 26053 1
582 . 1 1 56 56 ARG N N 15 122.329 0.072 . 1 . 16 . A 56 ARG N . 26053 1
583 . 1 1 57 57 SER H H 1 8.375 0.004 . 1 . 131 . A 57 SER H . 26053 1
584 . 1 1 57 57 SER HA H 1 4.198 0.012 . 1 . 777 . A 57 SER HA . 26053 1
585 . 1 1 57 57 SER HB2 H 1 4.042 0.014 . 2 . 769 . A 57 SER HB2 . 26053 1
586 . 1 1 57 57 SER HB3 H 1 4.017 0.014 . 2 . 778 . A 57 SER HB3 . 26053 1
587 . 1 1 57 57 SER C C 13 176.540 0.01 . 1 . 578 . A 57 SER C . 26053 1
588 . 1 1 57 57 SER CA C 13 61.734 0.174 . 1 . 541 . A 57 SER CA . 26053 1
589 . 1 1 57 57 SER CB C 13 62.838 0.169 . 1 . 542 . A 57 SER CB . 26053 1
590 . 1 1 57 57 SER N N 15 118.120 0.076 . 1 . 132 . A 57 SER N . 26053 1
591 . 1 1 58 58 ARG H H 1 7.684 0.003 . 1 . 63 . A 58 ARG H . 26053 1
592 . 1 1 58 58 ARG HA H 1 4.148 0.006 . 1 . 779 . A 58 ARG HA . 26053 1
593 . 1 1 58 58 ARG HB2 H 1 1.409 0.003 . 2 . 782 . A 58 ARG HB2 . 26053 1
594 . 1 1 58 58 ARG HB3 H 1 0.801 0.021 . 2 . 783 . A 58 ARG HB3 . 26053 1
595 . 1 1 58 58 ARG HG2 H 1 1.745 0.01 . 2 . 784 . A 58 ARG HG2 . 26053 1
596 . 1 1 58 58 ARG HG3 H 1 1.543 0.016 . 2 . 785 . A 58 ARG HG3 . 26053 1
597 . 1 1 58 58 ARG HD2 H 1 3.089 0.004 . 2 . 780 . A 58 ARG HD2 . 26053 1
598 . 1 1 58 58 ARG HD3 H 1 2.725 0.003 . 2 . 781 . A 58 ARG HD3 . 26053 1
599 . 1 1 58 58 ARG C C 13 176.236 0.017 . 1 . 298 . A 58 ARG C . 26053 1
600 . 1 1 58 58 ARG CA C 13 56.374 0.027 . 1 . 294 . A 58 ARG CA . 26053 1
601 . 1 1 58 58 ARG CB C 13 30.338 0.031 . 1 . 293 . A 58 ARG CB . 26053 1
602 . 1 1 58 58 ARG CG C 13 27.357 0.081 . 1 . 544 . A 58 ARG CG . 26053 1
603 . 1 1 58 58 ARG CD C 13 43.677 0.053 . 1 . 543 . A 58 ARG CD . 26053 1
604 . 1 1 58 58 ARG N N 15 116.857 0.074 . 1 . 64 . A 58 ARG N . 26053 1
605 . 1 1 59 59 GLY H H 1 7.613 0.002 . 1 . 175 . A 59 GLY H . 26053 1
606 . 1 1 59 59 GLY HA2 H 1 4.120 0.006 . 2 . 786 . A 59 GLY HA2 . 26053 1
607 . 1 1 59 59 GLY HA3 H 1 3.818 0.003 . 2 . 787 . A 59 GLY HA3 . 26053 1
608 . 1 1 59 59 GLY C C 13 174.876 0.017 . 1 . 286 . A 59 GLY C . 26053 1
609 . 1 1 59 59 GLY CA C 13 45.333 0.038 . 1 . 285 . A 59 GLY CA . 26053 1
610 . 1 1 59 59 GLY N N 15 106.007 0.067 . 1 . 176 . A 59 GLY N . 26053 1
611 . 1 1 60 60 TYR H H 1 8.020 0.004 . 1 . 55 . A 60 TYR H . 26053 1
612 . 1 1 60 60 TYR HA H 1 4.611 0.006 . 1 . 790 . A 60 TYR HA . 26053 1
613 . 1 1 60 60 TYR HB2 H 1 3.251 0.008 . 2 . 788 . A 60 TYR HB2 . 26053 1
614 . 1 1 60 60 TYR HB3 H 1 2.945 0.008 . 2 . 789 . A 60 TYR HB3 . 26053 1
615 . 1 1 60 60 TYR HD1 H 1 7.030 0.006 . 1 . 1084 . A 60 TYR HD1 . 26053 1
616 . 1 1 60 60 TYR HD2 H 1 7.030 0.006 . 1 . 1084 . A 60 TYR HD2 . 26053 1
617 . 1 1 60 60 TYR HE1 H 1 6.890 0.006 . 1 . 1085 . A 60 TYR HE1 . 26053 1
618 . 1 1 60 60 TYR HE2 H 1 6.890 0.006 . 1 . 1085 . A 60 TYR HE2 . 26053 1
619 . 1 1 60 60 TYR C C 13 176.377 0.012 . 1 . 287 . A 60 TYR C . 26053 1
620 . 1 1 60 60 TYR CA C 13 57.265 0.041 . 1 . 284 . A 60 TYR CA . 26053 1
621 . 1 1 60 60 TYR CB C 13 38.769 0.056 . 1 . 283 . A 60 TYR CB . 26053 1
622 . 1 1 60 60 TYR CD1 C 13 131.467 0.022 . 1 . 1083 . A 60 TYR CD1 . 26053 1
623 . 1 1 60 60 TYR CD2 C 13 131.467 0.022 . 1 . 1083 . A 60 TYR CD2 . 26053 1
624 . 1 1 60 60 TYR CE1 C 13 118.683 0.008 . 1 . 1086 . A 60 TYR CE1 . 26053 1
625 . 1 1 60 60 TYR CE2 C 13 118.683 0.008 . 1 . 1086 . A 60 TYR CE2 . 26053 1
626 . 1 1 60 60 TYR N N 15 118.391 0.066 . 1 . 56 . A 60 TYR N . 26053 1
627 . 1 1 61 61 ILE H H 1 6.918 0.003 . 1 . 81 . A 61 ILE H . 26053 1
628 . 1 1 61 61 ILE HA H 1 4.828 0.002 . 1 . 791 . A 61 ILE HA . 26053 1
629 . 1 1 61 61 ILE HB H 1 1.767 0.003 . 1 . 792 . A 61 ILE HB . 26053 1
630 . 1 1 61 61 ILE HG12 H 1 1.095 0.006 . 2 . 793 . A 61 ILE HG12 . 26053 1
631 . 1 1 61 61 ILE HG13 H 1 0.622 0.012 . 2 . 794 . A 61 ILE HG13 . 26053 1
632 . 1 1 61 61 ILE HG21 H 1 0.847 0.005 . 1 . 795 . A 61 ILE HG21 . 26053 1
633 . 1 1 61 61 ILE HG22 H 1 0.847 0.005 . 1 . 795 . A 61 ILE HG22 . 26053 1
634 . 1 1 61 61 ILE HG23 H 1 0.847 0.005 . 1 . 795 . A 61 ILE HG23 . 26053 1
635 . 1 1 61 61 ILE HD11 H 1 0.745 0.012 . 1 . 796 . A 61 ILE HD11 . 26053 1
636 . 1 1 61 61 ILE HD12 H 1 0.745 0.012 . 1 . 796 . A 61 ILE HD12 . 26053 1
637 . 1 1 61 61 ILE HD13 H 1 0.745 0.012 . 1 . 796 . A 61 ILE HD13 . 26053 1
638 . 1 1 61 61 ILE C C 13 174.471 0.006 . 1 . 288 . A 61 ILE C . 26053 1
639 . 1 1 61 61 ILE CA C 13 57.891 0.068 . 1 . 282 . A 61 ILE CA . 26053 1
640 . 1 1 61 61 ILE CB C 13 42.952 0.039 . 1 . 281 . A 61 ILE CB . 26053 1
641 . 1 1 61 61 ILE CG1 C 13 26.006 0.09 . 1 . 547 . A 61 ILE CG1 . 26053 1
642 . 1 1 61 61 ILE CG2 C 13 18.649 0.029 . 1 . 545 . A 61 ILE CG2 . 26053 1
643 . 1 1 61 61 ILE CD1 C 13 14.097 0.069 . 1 . 546 . A 61 ILE CD1 . 26053 1
644 . 1 1 61 61 ILE N N 15 106.695 0.063 . 1 . 82 . A 61 ILE N . 26053 1
645 . 1 1 62 62 THR H H 1 8.871 0.009 . 1 . 31 . A 62 THR H . 26053 1
646 . 1 1 62 62 THR HA H 1 4.482 0.005 . 1 . 797 . A 62 THR HA . 26053 1
647 . 1 1 62 62 THR HB H 1 3.967 0.007 . 1 . 798 . A 62 THR HB . 26053 1
648 . 1 1 62 62 THR HG21 H 1 1.206 0.005 . 1 . 799 . A 62 THR HG21 . 26053 1
649 . 1 1 62 62 THR HG22 H 1 1.206 0.005 . 1 . 799 . A 62 THR HG22 . 26053 1
650 . 1 1 62 62 THR HG23 H 1 1.206 0.005 . 1 . 799 . A 62 THR HG23 . 26053 1
651 . 1 1 62 62 THR C C 13 173.847 0.018 . 1 . 289 . A 62 THR C . 26053 1
652 . 1 1 62 62 THR CA C 13 60.797 0.044 . 1 . 279 . A 62 THR CA . 26053 1
653 . 1 1 62 62 THR CB C 13 70.873 0.033 . 1 . 280 . A 62 THR CB . 26053 1
654 . 1 1 62 62 THR CG2 C 13 20.961 0.024 . 1 . 548 . A 62 THR CG2 . 26053 1
655 . 1 1 62 62 THR N N 15 117.330 0.088 . 1 . 32 . A 62 THR N . 26053 1
656 . 1 1 63 63 GLY H H 1 8.949 0.003 . 1 . 29 . A 63 GLY H . 26053 1
657 . 1 1 63 63 GLY HA2 H 1 3.826 0.013 . 2 . 800 . A 63 GLY HA2 . 26053 1
658 . 1 1 63 63 GLY HA3 H 1 3.775 0.021 . 2 . 801 . A 63 GLY HA3 . 26053 1
659 . 1 1 63 63 GLY C C 13 174.230 0.012 . 1 . 290 . A 63 GLY C . 26053 1
660 . 1 1 63 63 GLY CA C 13 47.518 0.033 . 1 . 278 . A 63 GLY CA . 26053 1
661 . 1 1 63 63 GLY N N 15 112.746 0.07 . 1 . 30 . A 63 GLY N . 26053 1
662 . 1 1 64 64 ASP H H 1 8.827 0.005 . 1 . 189 . A 64 ASP H . 26053 1
663 . 1 1 64 64 ASP HA H 1 5.190 0.006 . 1 . 804 . A 64 ASP HA . 26053 1
664 . 1 1 64 64 ASP HB2 H 1 2.449 0.011 . 2 . 802 . A 64 ASP HB2 . 26053 1
665 . 1 1 64 64 ASP HB3 H 1 2.890 0.015 . 2 . 803 . A 64 ASP HB3 . 26053 1
666 . 1 1 64 64 ASP C C 13 175.642 0.013 . 1 . 291 . A 64 ASP C . 26053 1
667 . 1 1 64 64 ASP CA C 13 53.150 0.038 . 1 . 277 . A 64 ASP CA . 26053 1
668 . 1 1 64 64 ASP CB C 13 40.116 0.127 . 1 . 276 . A 64 ASP CB . 26053 1
669 . 1 1 64 64 ASP N N 15 127.074 0.063 . 1 . 190 . A 64 ASP N . 26053 1
670 . 1 1 65 65 GLN H H 1 8.319 0.006 . 1 . 7 . A 65 GLN H . 26053 1
671 . 1 1 65 65 GLN HA H 1 4.231 0.004 . 1 . 809 . A 65 GLN HA . 26053 1
672 . 1 1 65 65 GLN HB2 H 1 1.937 0.007 . 2 . 805 . A 65 GLN HB2 . 26053 1
673 . 1 1 65 65 GLN HB3 H 1 2.680 0.009 . 2 . 806 . A 65 GLN HB3 . 26053 1
674 . 1 1 65 65 GLN HG2 H 1 2.310 0.01 . 2 . 807 . A 65 GLN HG2 . 26053 1
675 . 1 1 65 65 GLN HG3 H 1 2.400 0.007 . 2 . 808 . A 65 GLN HG3 . 26053 1
676 . 1 1 65 65 GLN HE21 H 1 6.820 0.002 . 1 . 1043 . A 65 GLN HE21 . 26053 1
677 . 1 1 65 65 GLN HE22 H 1 7.574 0.001 . 1 . 1044 . A 65 GLN HE22 . 26053 1
678 . 1 1 65 65 GLN C C 13 173.083 0.01 . 1 . 292 . A 65 GLN C . 26053 1
679 . 1 1 65 65 GLN CA C 13 54.105 0.041 . 1 . 299 . A 65 GLN CA . 26053 1
680 . 1 1 65 65 GLN CB C 13 26.610 0.061 . 1 . 300 . A 65 GLN CB . 26053 1
681 . 1 1 65 65 GLN CG C 13 33.225 0.07 . 1 . 549 . A 65 GLN CG . 26053 1
682 . 1 1 65 65 GLN N N 15 119.037 0.078 . 1 . 8 . A 65 GLN N . 26053 1
683 . 1 1 65 65 GLN NE2 N 15 113.340 0.034 . 1 . 1042 . A 65 GLN NE2 . 26053 1
684 . 1 1 66 66 TYR H H 1 7.147 0.003 . 1 . 195 . A 66 TYR H . 26053 1
685 . 1 1 66 66 TYR HA H 1 4.759 0.004 . 1 . 812 . A 66 TYR HA . 26053 1
686 . 1 1 66 66 TYR HB2 H 1 2.886 0.006 . 2 . 810 . A 66 TYR HB2 . 26053 1
687 . 1 1 66 66 TYR HB3 H 1 2.885 0.006 . 2 . 811 . A 66 TYR HB3 . 26053 1
688 . 1 1 66 66 TYR HD1 H 1 6.565 0.006 . 1 . 1088 . A 66 TYR HD1 . 26053 1
689 . 1 1 66 66 TYR HD2 H 1 6.565 0.006 . 1 . 1088 . A 66 TYR HD2 . 26053 1
690 . 1 1 66 66 TYR HE1 H 1 6.562 0.004 . 1 . 1090 . A 66 TYR HE1 . 26053 1
691 . 1 1 66 66 TYR HE2 H 1 6.562 0.004 . 1 . 1090 . A 66 TYR HE2 . 26053 1
692 . 1 1 66 66 TYR C C 13 171.665 0.004 . 1 . 311 . A 66 TYR C . 26053 1
693 . 1 1 66 66 TYR CA C 13 55.761 0.046 . 1 . 302 . A 66 TYR CA . 26053 1
694 . 1 1 66 66 TYR CB C 13 40.442 0.042 . 1 . 301 . A 66 TYR CB . 26053 1
695 . 1 1 66 66 TYR CD1 C 13 133.404 0.04 . 1 . 1087 . A 66 TYR CD1 . 26053 1
696 . 1 1 66 66 TYR CD2 C 13 133.404 0.04 . 1 . 1087 . A 66 TYR CD2 . 26053 1
697 . 1 1 66 66 TYR CE1 C 13 117.187 0.027 . 1 . 1089 . A 66 TYR CE1 . 26053 1
698 . 1 1 66 66 TYR CE2 C 13 117.187 0.027 . 1 . 1089 . A 66 TYR CE2 . 26053 1
699 . 1 1 66 66 TYR N N 15 117.910 0.073 . 1 . 196 . A 66 TYR N . 26053 1
700 . 1 1 67 67 ILE H H 1 8.732 0.004 . 1 . 167 . A 67 ILE H . 26053 1
701 . 1 1 67 67 ILE HA H 1 4.526 0.004 . 1 . 813 . A 67 ILE HA . 26053 1
702 . 1 1 67 67 ILE HB H 1 1.637 0.006 . 1 . 814 . A 67 ILE HB . 26053 1
703 . 1 1 67 67 ILE HG12 H 1 1.247 0.01 . 2 . 815 . A 67 ILE HG12 . 26053 1
704 . 1 1 67 67 ILE HG13 H 1 0.930 0.019 . 2 . 816 . A 67 ILE HG13 . 26053 1
705 . 1 1 67 67 ILE HG21 H 1 0.910 0.012 . 1 . 817 . A 67 ILE HG21 . 26053 1
706 . 1 1 67 67 ILE HG22 H 1 0.910 0.012 . 1 . 817 . A 67 ILE HG22 . 26053 1
707 . 1 1 67 67 ILE HG23 H 1 0.910 0.012 . 1 . 817 . A 67 ILE HG23 . 26053 1
708 . 1 1 67 67 ILE HD11 H 1 0.656 0.013 . 1 . 818 . A 67 ILE HD11 . 26053 1
709 . 1 1 67 67 ILE HD12 H 1 0.656 0.013 . 1 . 818 . A 67 ILE HD12 . 26053 1
710 . 1 1 67 67 ILE HD13 H 1 0.656 0.013 . 1 . 818 . A 67 ILE HD13 . 26053 1
711 . 1 1 67 67 ILE C C 13 173.550 0.005 . 1 . 312 . A 67 ILE C . 26053 1
712 . 1 1 67 67 ILE CA C 13 61.396 0.032 . 1 . 303 . A 67 ILE CA . 26053 1
713 . 1 1 67 67 ILE CB C 13 41.932 0.009 . 1 . 304 . A 67 ILE CB . 26053 1
714 . 1 1 67 67 ILE CG1 C 13 27.915 0.12 . 1 . 550 . A 67 ILE CG1 . 26053 1
715 . 1 1 67 67 ILE CG2 C 13 17.013 0.026 . 1 . 551 . A 67 ILE CG2 . 26053 1
716 . 1 1 67 67 ILE CD1 C 13 14.438 0.066 . 1 . 552 . A 67 ILE CD1 . 26053 1
717 . 1 1 67 67 ILE N N 15 119.982 0.065 . 1 . 168 . A 67 ILE N . 26053 1
718 . 1 1 68 68 LEU H H 1 9.019 0.004 . 1 . 59 . A 68 LEU H . 26053 1
719 . 1 1 68 68 LEU HA H 1 5.886 0.007 . 1 . 819 . A 68 LEU HA . 26053 1
720 . 1 1 68 68 LEU HB2 H 1 2.175 0.011 . 2 . 820 . A 68 LEU HB2 . 26053 1
721 . 1 1 68 68 LEU HB3 H 1 1.552 0.011 . 2 . 821 . A 68 LEU HB3 . 26053 1
722 . 1 1 68 68 LEU HG H 1 1.767 0.01 . 1 . 822 . A 68 LEU HG . 26053 1
723 . 1 1 68 68 LEU HD11 H 1 0.947 0.014 . 2 . 824 . A 68 LEU HD11 . 26053 1
724 . 1 1 68 68 LEU HD12 H 1 0.947 0.014 . 2 . 824 . A 68 LEU HD12 . 26053 1
725 . 1 1 68 68 LEU HD13 H 1 0.947 0.014 . 2 . 824 . A 68 LEU HD13 . 26053 1
726 . 1 1 68 68 LEU HD21 H 1 0.934 0.007 . 2 . 825 . A 68 LEU HD21 . 26053 1
727 . 1 1 68 68 LEU HD22 H 1 0.934 0.007 . 2 . 825 . A 68 LEU HD22 . 26053 1
728 . 1 1 68 68 LEU HD23 H 1 0.934 0.007 . 2 . 825 . A 68 LEU HD23 . 26053 1
729 . 1 1 68 68 LEU C C 13 175.943 0.011 . 1 . 313 . A 68 LEU C . 26053 1
730 . 1 1 68 68 LEU CA C 13 53.411 0.02 . 1 . 305 . A 68 LEU CA . 26053 1
731 . 1 1 68 68 LEU CB C 13 46.932 0.04 . 1 . 306 . A 68 LEU CB . 26053 1
732 . 1 1 68 68 LEU CG C 13 27.976 0.054 . 1 . 553 . A 68 LEU CG . 26053 1
733 . 1 1 68 68 LEU CD1 C 13 25.222 0.042 . 2 . 554 . A 68 LEU CD1 . 26053 1
734 . 1 1 68 68 LEU CD2 C 13 26.947 0.027 . 2 . 823 . A 68 LEU CD2 . 26053 1
735 . 1 1 68 68 LEU N N 15 131.336 0.081 . 1 . 60 . A 68 LEU N . 26053 1
736 . 1 1 69 69 GLU H H 1 9.143 0.003 . 1 . 23 . A 69 GLU H . 26053 1
737 . 1 1 69 69 GLU HA H 1 5.125 0.015 . 1 . 826 . A 69 GLU HA . 26053 1
738 . 1 1 69 69 GLU HB2 H 1 2.163 0.004 . 2 . 829 . A 69 GLU HB2 . 26053 1
739 . 1 1 69 69 GLU HB3 H 1 2.487 0.014 . 2 . 830 . A 69 GLU HB3 . 26053 1
740 . 1 1 69 69 GLU HG2 H 1 2.517 0.004 . 2 . 827 . A 69 GLU HG2 . 26053 1
741 . 1 1 69 69 GLU HG3 H 1 2.514 0.005 . 2 . 828 . A 69 GLU HG3 . 26053 1
742 . 1 1 69 69 GLU C C 13 175.939 0.006 . 1 . 314 . A 69 GLU C . 26053 1
743 . 1 1 69 69 GLU CA C 13 55.300 0.035 . 1 . 307 . A 69 GLU CA . 26053 1
744 . 1 1 69 69 GLU CB C 13 34.935 0.048 . 1 . 308 . A 69 GLU CB . 26053 1
745 . 1 1 69 69 GLU CG C 13 36.844 0.054 . 1 . 555 . A 69 GLU CG . 26053 1
746 . 1 1 69 69 GLU N N 15 120.926 0.064 . 1 . 24 . A 69 GLU N . 26053 1
747 . 1 1 70 70 ARG H H 1 8.554 0.003 . 1 . 13 . A 70 ARG H . 26053 1
748 . 1 1 70 70 ARG HA H 1 3.196 0.006 . 1 . 831 . A 70 ARG HA . 26053 1
749 . 1 1 70 70 ARG HB2 H 1 0.989 0.005 . 2 . 834 . A 70 ARG HB2 . 26053 1
750 . 1 1 70 70 ARG HB3 H 1 0.375 0.005 . 2 . 835 . A 70 ARG HB3 . 26053 1
751 . 1 1 70 70 ARG HG2 H 1 1.272 0.004 . 2 . 836 . A 70 ARG HG2 . 26053 1
752 . 1 1 70 70 ARG HG3 H 1 0.228 0.005 . 2 . 837 . A 70 ARG HG3 . 26053 1
753 . 1 1 70 70 ARG HD2 H 1 2.079 0.004 . 2 . 832 . A 70 ARG HD2 . 26053 1
754 . 1 1 70 70 ARG HD3 H 1 0.847 0.007 . 2 . 833 . A 70 ARG HD3 . 26053 1
755 . 1 1 70 70 ARG C C 13 175.336 0.012 . 1 . 315 . A 70 ARG C . 26053 1
756 . 1 1 70 70 ARG CA C 13 58.122 0.036 . 1 . 310 . A 70 ARG CA . 26053 1
757 . 1 1 70 70 ARG CB C 13 31.292 0.044 . 1 . 309 . A 70 ARG CB . 26053 1
758 . 1 1 70 70 ARG CG C 13 29.741 0.045 . 1 . 557 . A 70 ARG CG . 26053 1
759 . 1 1 70 70 ARG CD C 13 43.422 0.027 . 1 . 556 . A 70 ARG CD . 26053 1
760 . 1 1 70 70 ARG N N 15 122.917 0.083 . 1 . 14 . A 70 ARG N . 26053 1
761 . 1 1 71 71 VAL H H 1 8.258 0.005 . 1 . 127 . A 71 VAL H . 26053 1
762 . 1 1 71 71 VAL HA H 1 3.719 0.016 . 1 . 847 . A 71 VAL HA . 26053 1
763 . 1 1 71 71 VAL HB H 1 1.350 0.011 . 1 . 848 . A 71 VAL HB . 26053 1
764 . 1 1 71 71 VAL HG11 H 1 0.095 0.004 . 2 . 669 . A 71 VAL HG11 . 26053 1
765 . 1 1 71 71 VAL HG12 H 1 0.095 0.004 . 2 . 669 . A 71 VAL HG12 . 26053 1
766 . 1 1 71 71 VAL HG13 H 1 0.095 0.004 . 2 . 669 . A 71 VAL HG13 . 26053 1
767 . 1 1 71 71 VAL HG21 H 1 0.521 0.005 . 2 . 849 . A 71 VAL HG21 . 26053 1
768 . 1 1 71 71 VAL HG22 H 1 0.521 0.005 . 2 . 849 . A 71 VAL HG22 . 26053 1
769 . 1 1 71 71 VAL HG23 H 1 0.521 0.005 . 2 . 849 . A 71 VAL HG23 . 26053 1
770 . 1 1 71 71 VAL C C 13 173.645 0.011 . 1 . 316 . A 71 VAL C . 26053 1
771 . 1 1 71 71 VAL CA C 13 63.958 0.106 . 1 . 317 . A 71 VAL CA . 26053 1
772 . 1 1 71 71 VAL CB C 13 34.722 0.055 . 1 . 318 . A 71 VAL CB . 26053 1
773 . 1 1 71 71 VAL CG1 C 13 21.017 0.049 . 2 . 845 . A 71 VAL CG1 . 26053 1
774 . 1 1 71 71 VAL CG2 C 13 20.741 0.031 . 2 . 846 . A 71 VAL CG2 . 26053 1
775 . 1 1 71 71 VAL N N 15 118.421 0.112 . 1 . 128 . A 71 VAL N . 26053 1
776 . 1 1 72 72 ASN H H 1 7.692 0.006 . 1 . 841 . A 72 ASN H . 26053 1
777 . 1 1 72 72 ASN HA H 1 4.713 0.004 . 1 . 838 . A 72 ASN HA . 26053 1
778 . 1 1 72 72 ASN HB2 H 1 2.025 0.005 . 2 . 839 . A 72 ASN HB2 . 26053 1
779 . 1 1 72 72 ASN HB3 H 1 3.249 0.009 . 2 . 840 . A 72 ASN HB3 . 26053 1
780 . 1 1 72 72 ASN HD21 H 1 7.141 0.007 . 1 . 1037 . A 72 ASN HD21 . 26053 1
781 . 1 1 72 72 ASN HD22 H 1 7.269 0.008 . 1 . 1038 . A 72 ASN HD22 . 26053 1
782 . 1 1 72 72 ASN C C 13 172.197 0.007 . 1 . 587 . A 72 ASN C . 26053 1
783 . 1 1 72 72 ASN CA C 13 51.272 0.063 . 1 . 479 . A 72 ASN CA . 26053 1
784 . 1 1 72 72 ASN CB C 13 40.842 0.057 . 1 . 480 . A 72 ASN CB . 26053 1
785 . 1 1 72 72 ASN N N 15 111.682 0.065 . 1 . 842 . A 72 ASN N . 26053 1
786 . 1 1 72 72 ASN ND2 N 15 110.849 0.04 . 1 . 1036 . A 72 ASN ND2 . 26053 1
787 . 1 1 73 73 ILE H H 1 8.712 0.006 . 1 . 203 . A 73 ILE H . 26053 1
788 . 1 1 73 73 ILE HA H 1 4.342 0.007 . 1 . 852 . A 73 ILE HA . 26053 1
789 . 1 1 73 73 ILE HB H 1 1.067 0.004 . 1 . 853 . A 73 ILE HB . 26053 1
790 . 1 1 73 73 ILE HG12 H 1 -0.860 0.006 . 2 . 854 . A 73 ILE HG12 . 26053 1
791 . 1 1 73 73 ILE HG13 H 1 0.295 0.011 . 2 . 855 . A 73 ILE HG13 . 26053 1
792 . 1 1 73 73 ILE HG21 H 1 0.194 0.008 . 1 . 856 . A 73 ILE HG21 . 26053 1
793 . 1 1 73 73 ILE HG22 H 1 0.194 0.008 . 1 . 856 . A 73 ILE HG22 . 26053 1
794 . 1 1 73 73 ILE HG23 H 1 0.194 0.008 . 1 . 856 . A 73 ILE HG23 . 26053 1
795 . 1 1 73 73 ILE HD11 H 1 -0.037 0.006 . 1 . 857 . A 73 ILE HD11 . 26053 1
796 . 1 1 73 73 ILE HD12 H 1 -0.037 0.006 . 1 . 857 . A 73 ILE HD12 . 26053 1
797 . 1 1 73 73 ILE HD13 H 1 -0.037 0.006 . 1 . 857 . A 73 ILE HD13 . 26053 1
798 . 1 1 73 73 ILE C C 13 174.776 0.02 . 1 . 477 . A 73 ILE C . 26053 1
799 . 1 1 73 73 ILE CA C 13 60.672 0.026 . 1 . 476 . A 73 ILE CA . 26053 1
800 . 1 1 73 73 ILE CB C 13 40.423 0.078 . 1 . 475 . A 73 ILE CB . 26053 1
801 . 1 1 73 73 ILE CG1 C 13 26.378 0.044 . 1 . 558 . A 73 ILE CG1 . 26053 1
802 . 1 1 73 73 ILE CG2 C 13 16.819 0.018 . 1 . 559 . A 73 ILE CG2 . 26053 1
803 . 1 1 73 73 ILE CD1 C 13 12.794 0.011 . 1 . 560 . A 73 ILE CD1 . 26053 1
804 . 1 1 73 73 ILE N N 15 122.699 0.072 . 1 . 204 . A 73 ILE N . 26053 1
805 . 1 1 74 74 VAL H H 1 8.340 0.007 . 1 . 161 . A 74 VAL H . 26053 1
806 . 1 1 74 74 VAL HA H 1 4.091 0.002 . 1 . 858 . A 74 VAL HA . 26053 1
807 . 1 1 74 74 VAL HB H 1 1.727 0.016 . 1 . 859 . A 74 VAL HB . 26053 1
808 . 1 1 74 74 VAL HG11 H 1 0.494 0.01 . 2 . 861 . A 74 VAL HG11 . 26053 1
809 . 1 1 74 74 VAL HG12 H 1 0.494 0.01 . 2 . 861 . A 74 VAL HG12 . 26053 1
810 . 1 1 74 74 VAL HG13 H 1 0.494 0.01 . 2 . 861 . A 74 VAL HG13 . 26053 1
811 . 1 1 74 74 VAL HG21 H 1 0.344 0.008 . 2 . 863 . A 74 VAL HG21 . 26053 1
812 . 1 1 74 74 VAL HG22 H 1 0.344 0.008 . 2 . 863 . A 74 VAL HG22 . 26053 1
813 . 1 1 74 74 VAL HG23 H 1 0.344 0.008 . 2 . 863 . A 74 VAL HG23 . 26053 1
814 . 1 1 74 74 VAL C C 13 176.799 0.1 . 1 . 478 . A 74 VAL C . 26053 1
815 . 1 1 74 74 VAL CA C 13 61.212 0.078 . 1 . 481 . A 74 VAL CA . 26053 1
816 . 1 1 74 74 VAL CB C 13 34.153 0.028 . 1 . 482 . A 74 VAL CB . 26053 1
817 . 1 1 74 74 VAL CG1 C 13 20.422 0.004 . 2 . 860 . A 74 VAL CG1 . 26053 1
818 . 1 1 74 74 VAL CG2 C 13 19.338 0.024 . 2 . 862 . A 74 VAL CG2 . 26053 1
819 . 1 1 74 74 VAL N N 15 125.436 0.062 . 1 . 162 . A 74 VAL N . 26053 1
820 . 1 1 75 75 ASN HA H 1 4.294 0.013 . 1 . 594 . A 75 ASN HA . 26053 1
821 . 1 1 75 75 ASN HB2 H 1 3.029 0.003 . 2 . 592 . A 75 ASN HB2 . 26053 1
822 . 1 1 75 75 ASN HB3 H 1 2.751 0.006 . 2 . 593 . A 75 ASN HB3 . 26053 1
823 . 1 1 75 75 ASN HD21 H 1 7.664 0.012 . 1 . 1049 . A 75 ASN HD21 . 26053 1
824 . 1 1 75 75 ASN HD22 H 1 6.896 0.007 . 1 . 1050 . A 75 ASN HD22 . 26053 1
825 . 1 1 75 75 ASN C C 13 174.966 0.01 . 1 . 588 . A 75 ASN C . 26053 1
826 . 1 1 75 75 ASN CA C 13 54.013 0.022 . 1 . 470 . A 75 ASN CA . 26053 1
827 . 1 1 75 75 ASN CB C 13 37.195 0.086 . 1 . 469 . A 75 ASN CB . 26053 1
828 . 1 1 75 75 ASN ND2 N 15 112.923 0.032 . 1 . 1048 . A 75 ASN ND2 . 26053 1
829 . 1 1 76 76 GLY H H 1 8.224 0.004 . 1 . 119 . A 76 GLY H . 26053 1
830 . 1 1 76 76 GLY HA2 H 1 3.338 0.01 . 2 . 864 . A 76 GLY HA2 . 26053 1
831 . 1 1 76 76 GLY HA3 H 1 3.952 0.004 . 2 . 865 . A 76 GLY HA3 . 26053 1
832 . 1 1 76 76 GLY C C 13 172.877 0.034 . 1 . 465 . A 76 GLY C . 26053 1
833 . 1 1 76 76 GLY CA C 13 45.442 0.021 . 1 . 464 . A 76 GLY CA . 26053 1
834 . 1 1 76 76 GLY N N 15 101.222 0.089 . 1 . 120 . A 76 GLY N . 26053 1
835 . 1 1 77 77 ASN H H 1 7.706 0.008 . 1 . 153 . A 77 ASN H . 26053 1
836 . 1 1 77 77 ASN HA H 1 4.783 0.003 . 1 . 866 . A 77 ASN HA . 26053 1
837 . 1 1 77 77 ASN HB2 H 1 2.885 0.01 . 2 . 867 . A 77 ASN HB2 . 26053 1
838 . 1 1 77 77 ASN HB3 H 1 2.463 0.011 . 2 . 868 . A 77 ASN HB3 . 26053 1
839 . 1 1 77 77 ASN HD21 H 1 7.444 0.006 . 1 . 1051 . A 77 ASN HD21 . 26053 1
840 . 1 1 77 77 ASN HD22 H 1 6.887 0.005 . 1 . 1053 . A 77 ASN HD22 . 26053 1
841 . 1 1 77 77 ASN C C 13 172.684 0.014 . 1 . 466 . A 77 ASN C . 26053 1
842 . 1 1 77 77 ASN CA C 13 51.539 0.032 . 1 . 468 . A 77 ASN CA . 26053 1
843 . 1 1 77 77 ASN CB C 13 40.602 0.096 . 1 . 467 . A 77 ASN CB . 26053 1
844 . 1 1 77 77 ASN N N 15 117.244 0.066 . 1 . 154 . A 77 ASN N . 26053 1
845 . 1 1 77 77 ASN ND2 N 15 112.417 0.054 . 1 . 1052 . A 77 ASN ND2 . 26053 1
846 . 1 1 78 78 GLY H H 1 7.030 0.009 . 1 . 843 . A 78 GLY H . 26053 1
847 . 1 1 78 78 GLY HA2 H 1 3.474 0.013 . 2 . 869 . A 78 GLY HA2 . 26053 1
848 . 1 1 78 78 GLY HA3 H 1 3.662 0.005 . 2 . 870 . A 78 GLY HA3 . 26053 1
849 . 1 1 78 78 GLY C C 13 171.239 0.005 . 1 . 253 . A 78 GLY C . 26053 1
850 . 1 1 78 78 GLY CA C 13 45.654 0.045 . 1 . 245 . A 78 GLY CA . 26053 1
851 . 1 1 78 78 GLY N N 15 111.674 0.077 . 1 . 844 . A 78 GLY N . 26053 1
852 . 1 1 79 79 TYR H H 1 9.206 0.005 . 1 . 159 . A 79 TYR H . 26053 1
853 . 1 1 79 79 TYR HA H 1 5.858 0.004 . 1 . 871 . A 79 TYR HA . 26053 1
854 . 1 1 79 79 TYR HB2 H 1 2.531 0.009 . 2 . 872 . A 79 TYR HB2 . 26053 1
855 . 1 1 79 79 TYR HB3 H 1 2.744 0.006 . 2 . 873 . A 79 TYR HB3 . 26053 1
856 . 1 1 79 79 TYR HD1 H 1 7.003 0.01 . 1 . 1105 . A 79 TYR HD1 . 26053 1
857 . 1 1 79 79 TYR HD2 H 1 7.003 0.01 . 1 . 1105 . A 79 TYR HD2 . 26053 1
858 . 1 1 79 79 TYR HE1 H 1 6.878 0.016 . 1 . 1106 . A 79 TYR HE1 . 26053 1
859 . 1 1 79 79 TYR HE2 H 1 6.878 0.016 . 1 . 1106 . A 79 TYR HE2 . 26053 1
860 . 1 1 79 79 TYR C C 13 175.163 0.012 . 1 . 234 . A 79 TYR C . 26053 1
861 . 1 1 79 79 TYR CA C 13 56.762 0.037 . 1 . 229 . A 79 TYR CA . 26053 1
862 . 1 1 79 79 TYR CB C 13 39.292 0.068 . 1 . 230 . A 79 TYR CB . 26053 1
863 . 1 1 79 79 TYR CD1 C 13 132.511 0.142 . 1 . 1133 . A 79 TYR CD1 . 26053 1
864 . 1 1 79 79 TYR CD2 C 13 132.511 0.142 . 1 . 1133 . A 79 TYR CD2 . 26053 1
865 . 1 1 79 79 TYR CE1 C 13 117.768 0.03 . 1 . 1134 . A 79 TYR CE1 . 26053 1
866 . 1 1 79 79 TYR CE2 C 13 117.768 0.03 . 1 . 1134 . A 79 TYR CE2 . 26053 1
867 . 1 1 79 79 TYR N N 15 123.112 0.074 . 1 . 160 . A 79 TYR N . 26053 1
868 . 1 1 80 80 TYR H H 1 9.307 0.01 . 1 . 171 . A 80 TYR H . 26053 1
869 . 1 1 80 80 TYR HA H 1 5.601 0.017 . 1 . 874 . A 80 TYR HA . 26053 1
870 . 1 1 80 80 TYR HB2 H 1 2.963 0.004 . 2 . 875 . A 80 TYR HB2 . 26053 1
871 . 1 1 80 80 TYR HB3 H 1 2.741 0.006 . 2 . 876 . A 80 TYR HB3 . 26053 1
872 . 1 1 80 80 TYR HD1 H 1 6.910 0.011 . 1 . 1103 . A 80 TYR HD1 . 26053 1
873 . 1 1 80 80 TYR HD2 H 1 6.910 0.011 . 1 . 1103 . A 80 TYR HD2 . 26053 1
874 . 1 1 80 80 TYR C C 13 173.683 0.042 . 1 . 233 . A 80 TYR C . 26053 1
875 . 1 1 80 80 TYR CA C 13 55.505 0.122 . 1 . 228 . A 80 TYR CA . 26053 1
876 . 1 1 80 80 TYR CB C 13 43.089 0.053 . 1 . 227 . A 80 TYR CB . 26053 1
877 . 1 1 80 80 TYR N N 15 121.424 0.069 . 1 . 172 . A 80 TYR N . 26053 1
878 . 1 1 81 81 ASN H H 1 9.346 0.006 . 1 . 3 . A 81 ASN H . 26053 1
879 . 1 1 81 81 ASN HA H 1 6.043 0.009 . 1 . 877 . A 81 ASN HA . 26053 1
880 . 1 1 81 81 ASN HB2 H 1 2.181 0.007 . 2 . 878 . A 81 ASN HB2 . 26053 1
881 . 1 1 81 81 ASN HB3 H 1 2.701 0.011 . 2 . 879 . A 81 ASN HB3 . 26053 1
882 . 1 1 81 81 ASN HD21 H 1 8.399 0.007 . 1 . 1034 . A 81 ASN HD21 . 26053 1
883 . 1 1 81 81 ASN HD22 H 1 7.652 0.016 . 1 . 1035 . A 81 ASN HD22 . 26053 1
884 . 1 1 81 81 ASN C C 13 173.349 0.013 . 1 . 231 . A 81 ASN C . 26053 1
885 . 1 1 81 81 ASN CA C 13 50.256 0.036 . 1 . 235 . A 81 ASN CA . 26053 1
886 . 1 1 81 81 ASN CB C 13 42.410 0.056 . 1 . 236 . A 81 ASN CB . 26053 1
887 . 1 1 81 81 ASN N N 15 118.659 0.053 . 1 . 4 . A 81 ASN N . 26053 1
888 . 1 1 81 81 ASN ND2 N 15 108.808 0.05 . 1 . 1033 . A 81 ASN ND2 . 26053 1
889 . 1 1 82 82 LEU H H 1 8.147 0.004 . 1 . 143 . A 82 LEU H . 26053 1
890 . 1 1 82 82 LEU HA H 1 5.161 0.01 . 1 . 880 . A 82 LEU HA . 26053 1
891 . 1 1 82 82 LEU HB2 H 1 0.943 0.01 . 2 . 881 . A 82 LEU HB2 . 26053 1
892 . 1 1 82 82 LEU HB3 H 1 0.593 0.014 . 2 . 882 . A 82 LEU HB3 . 26053 1
893 . 1 1 82 82 LEU HG H 1 1.250 0.014 . 1 . 884 . A 82 LEU HG . 26053 1
894 . 1 1 82 82 LEU HD11 H 1 0.361 0.015 . 2 . 885 . A 82 LEU HD11 . 26053 1
895 . 1 1 82 82 LEU HD12 H 1 0.361 0.015 . 2 . 885 . A 82 LEU HD12 . 26053 1
896 . 1 1 82 82 LEU HD13 H 1 0.361 0.015 . 2 . 885 . A 82 LEU HD13 . 26053 1
897 . 1 1 82 82 LEU HD21 H 1 0.617 0.01 . 2 . 928 . A 82 LEU HD21 . 26053 1
898 . 1 1 82 82 LEU HD22 H 1 0.617 0.01 . 2 . 928 . A 82 LEU HD22 . 26053 1
899 . 1 1 82 82 LEU HD23 H 1 0.617 0.01 . 2 . 928 . A 82 LEU HD23 . 26053 1
900 . 1 1 82 82 LEU C C 13 173.963 0.013 . 1 . 232 . A 82 LEU C . 26053 1
901 . 1 1 82 82 LEU CA C 13 52.900 0.088 . 1 . 238 . A 82 LEU CA . 26053 1
902 . 1 1 82 82 LEU CB C 13 45.661 0.044 . 1 . 239 . A 82 LEU CB . 26053 1
903 . 1 1 82 82 LEU CG C 13 27.359 0.0 . 1 . 883 . A 82 LEU CG . 26053 1
904 . 1 1 82 82 LEU CD1 C 13 27.182 0.065 . 2 . 561 . A 82 LEU CD1 . 26053 1
905 . 1 1 82 82 LEU CD2 C 13 25.792 0.032 . 2 . 562 . A 82 LEU CD2 . 26053 1
906 . 1 1 82 82 LEU N N 15 122.431 0.081 . 1 . 144 . A 82 LEU N . 26053 1
907 . 1 1 83 83 TYR H H 1 9.444 0.004 . 1 . 117 . A 83 TYR H . 26053 1
908 . 1 1 83 83 TYR HA H 1 5.239 0.004 . 1 . 889 . A 83 TYR HA . 26053 1
909 . 1 1 83 83 TYR HB2 H 1 2.883 0.011 . 2 . 887 . A 83 TYR HB2 . 26053 1
910 . 1 1 83 83 TYR HB3 H 1 2.722 0.006 . 2 . 888 . A 83 TYR HB3 . 26053 1
911 . 1 1 83 83 TYR C C 13 176.709 0.004 . 1 . 237 . A 83 TYR C . 26053 1
912 . 1 1 83 83 TYR CA C 13 55.628 0.035 . 1 . 241 . A 83 TYR CA . 26053 1
913 . 1 1 83 83 TYR CB C 13 41.758 0.04 . 1 . 242 . A 83 TYR CB . 26053 1
914 . 1 1 83 83 TYR N N 15 122.451 0.075 . 1 . 118 . A 83 TYR N . 26053 1
915 . 1 1 84 84 LYS H H 1 8.651 0.007 . 1 . 51 . A 84 LYS H . 26053 1
916 . 1 1 84 84 LYS HA H 1 4.403 0.003 . 1 . 890 . A 84 LYS HA . 26053 1
917 . 1 1 84 84 LYS HB2 H 1 2.196 0.01 . 2 . 891 . A 84 LYS HB2 . 26053 1
918 . 1 1 84 84 LYS HB3 H 1 1.947 0.01 . 2 . 892 . A 84 LYS HB3 . 26053 1
919 . 1 1 84 84 LYS HG2 H 1 1.470 0.008 . 2 . 894 . A 84 LYS HG2 . 26053 1
920 . 1 1 84 84 LYS HG3 H 1 1.651 0.008 . 2 . 895 . A 84 LYS HG3 . 26053 1
921 . 1 1 84 84 LYS HD2 H 1 1.835 0.014 . 2 . 897 . A 84 LYS HD2 . 26053 1
922 . 1 1 84 84 LYS HD3 H 1 1.805 0.009 . 2 . 898 . A 84 LYS HD3 . 26053 1
923 . 1 1 84 84 LYS HE2 H 1 3.221 0.014 . 2 . 900 . A 84 LYS HE2 . 26053 1
924 . 1 1 84 84 LYS HE3 H 1 3.025 0.003 . 2 . 901 . A 84 LYS HE3 . 26053 1
925 . 1 1 84 84 LYS C C 13 175.986 0.1 . 1 . 240 . A 84 LYS C . 26053 1
926 . 1 1 84 84 LYS CA C 13 56.439 0.033 . 1 . 244 . A 84 LYS CA . 26053 1
927 . 1 1 84 84 LYS CB C 13 32.271 0.062 . 1 . 243 . A 84 LYS CB . 26053 1
928 . 1 1 84 84 LYS CG C 13 26.628 0.068 . 1 . 893 . A 84 LYS CG . 26053 1
929 . 1 1 84 84 LYS CD C 13 29.986 0.039 . 1 . 896 . A 84 LYS CD . 26053 1
930 . 1 1 84 84 LYS CE C 13 42.144 0.023 . 1 . 899 . A 84 LYS CE . 26053 1
931 . 1 1 84 84 LYS N N 15 118.011 0.06 . 1 . 52 . A 84 LYS N . 26053 1
932 . 1 1 85 85 PRO HA H 1 3.970 0.011 . 1 . 902 . A 85 PRO HA . 26053 1
933 . 1 1 85 85 PRO HB2 H 1 2.197 0.007 . 2 . 907 . A 85 PRO HB2 . 26053 1
934 . 1 1 85 85 PRO HB3 H 1 1.923 0.01 . 2 . 908 . A 85 PRO HB3 . 26053 1
935 . 1 1 85 85 PRO HG2 H 1 1.533 0.016 . 2 . 909 . A 85 PRO HG2 . 26053 1
936 . 1 1 85 85 PRO HG3 H 1 2.197 0.006 . 2 . 910 . A 85 PRO HG3 . 26053 1
937 . 1 1 85 85 PRO HD2 H 1 3.950 0.013 . 2 . 905 . A 85 PRO HD2 . 26053 1
938 . 1 1 85 85 PRO HD3 H 1 3.947 0.01 . 2 . 906 . A 85 PRO HD3 . 26053 1
939 . 1 1 85 85 PRO C C 13 175.185 0.007 . 1 . 369 . A 85 PRO C . 26053 1
940 . 1 1 85 85 PRO CA C 13 65.163 0.073 . 1 . 376 . A 85 PRO CA . 26053 1
941 . 1 1 85 85 PRO CB C 13 31.834 0.041 . 1 . 374 . A 85 PRO CB . 26053 1
942 . 1 1 85 85 PRO CG C 13 29.219 0.029 . 1 . 375 . A 85 PRO CG . 26053 1
943 . 1 1 85 85 PRO CD C 13 50.418 0.037 . 1 . 904 . A 85 PRO CD . 26053 1
944 . 1 1 86 86 ASP H H 1 7.024 0.002 . 1 . 75 . A 86 ASP H . 26053 1
945 . 1 1 86 86 ASP HA H 1 4.442 0.007 . 1 . 911 . A 86 ASP HA . 26053 1
946 . 1 1 86 86 ASP HB2 H 1 3.099 0.003 . 2 . 912 . A 86 ASP HB2 . 26053 1
947 . 1 1 86 86 ASP HB3 H 1 2.576 0.009 . 2 . 913 . A 86 ASP HB3 . 26053 1
948 . 1 1 86 86 ASP C C 13 177.359 0.009 . 1 . 370 . A 86 ASP C . 26053 1
949 . 1 1 86 86 ASP CA C 13 52.898 0.038 . 1 . 367 . A 86 ASP CA . 26053 1
950 . 1 1 86 86 ASP CB C 13 39.917 0.051 . 1 . 368 . A 86 ASP CB . 26053 1
951 . 1 1 86 86 ASP N N 15 110.042 0.069 . 1 . 76 . A 86 ASP N . 26053 1
952 . 1 1 87 87 GLY H H 1 8.625 0.008 . 1 . 165 . A 87 GLY H . 26053 1
953 . 1 1 87 87 GLY HA2 H 1 2.994 0.005 . 2 . 914 . A 87 GLY HA2 . 26053 1
954 . 1 1 87 87 GLY HA3 H 1 4.409 0.007 . 2 . 915 . A 87 GLY HA3 . 26053 1
955 . 1 1 87 87 GLY C C 13 173.751 0.015 . 1 . 371 . A 87 GLY C . 26053 1
956 . 1 1 87 87 GLY CA C 13 45.561 0.023 . 1 . 366 . A 87 GLY CA . 26053 1
957 . 1 1 87 87 GLY N N 15 108.932 0.073 . 1 . 166 . A 87 GLY N . 26053 1
958 . 1 1 88 88 THR H H 1 8.103 0.003 . 1 . 177 . A 88 THR H . 26053 1
959 . 1 1 88 88 THR HA H 1 3.944 0.015 . 1 . 917 . A 88 THR HA . 26053 1
960 . 1 1 88 88 THR HB H 1 3.880 0.015 . 1 . 916 . A 88 THR HB . 26053 1
961 . 1 1 88 88 THR HG21 H 1 1.263 0.007 . 1 . 918 . A 88 THR HG21 . 26053 1
962 . 1 1 88 88 THR HG22 H 1 1.263 0.007 . 1 . 918 . A 88 THR HG22 . 26053 1
963 . 1 1 88 88 THR HG23 H 1 1.263 0.007 . 1 . 918 . A 88 THR HG23 . 26053 1
964 . 1 1 88 88 THR C C 13 174.889 0.008 . 1 . 372 . A 88 THR C . 26053 1
965 . 1 1 88 88 THR CA C 13 64.983 0.02 . 1 . 365 . A 88 THR CA . 26053 1
966 . 1 1 88 88 THR CB C 13 69.209 0.043 . 1 . 364 . A 88 THR CB . 26053 1
967 . 1 1 88 88 THR CG2 C 13 20.844 0.025 . 1 . 563 . A 88 THR CG2 . 26053 1
968 . 1 1 88 88 THR N N 15 117.245 0.059 . 1 . 178 . A 88 THR N . 26053 1
969 . 1 1 89 89 TYR H H 1 8.928 0.006 . 1 . 11 . A 89 TYR H . 26053 1
970 . 1 1 89 89 TYR HA H 1 4.308 0.003 . 1 . 921 . A 89 TYR HA . 26053 1
971 . 1 1 89 89 TYR HB2 H 1 3.441 0.006 . 2 . 919 . A 89 TYR HB2 . 26053 1
972 . 1 1 89 89 TYR HB3 H 1 2.843 0.01 . 2 . 920 . A 89 TYR HB3 . 26053 1
973 . 1 1 89 89 TYR HD1 H 1 6.657 0.005 . 1 . 1102 . A 89 TYR HD1 . 26053 1
974 . 1 1 89 89 TYR HD2 H 1 6.657 0.005 . 1 . 1102 . A 89 TYR HD2 . 26053 1
975 . 1 1 89 89 TYR C C 13 173.904 0.01 . 1 . 373 . A 89 TYR C . 26053 1
976 . 1 1 89 89 TYR CA C 13 59.601 0.049 . 1 . 377 . A 89 TYR CA . 26053 1
977 . 1 1 89 89 TYR CB C 13 38.951 0.04 . 1 . 378 . A 89 TYR CB . 26053 1
978 . 1 1 89 89 TYR N N 15 128.188 0.07 . 1 . 12 . A 89 TYR N . 26053 1
979 . 1 1 90 90 LEU H H 1 7.681 0.006 . 1 . 105 . A 90 LEU H . 26053 1
980 . 1 1 90 90 LEU HA H 1 3.994 0.014 . 1 . 922 . A 90 LEU HA . 26053 1
981 . 1 1 90 90 LEU HB2 H 1 0.820 0.008 . 2 . 923 . A 90 LEU HB2 . 26053 1
982 . 1 1 90 90 LEU HB3 H 1 0.287 0.004 . 2 . 924 . A 90 LEU HB3 . 26053 1
983 . 1 1 90 90 LEU HG H 1 1.245 0.01 . 1 . 927 . A 90 LEU HG . 26053 1
984 . 1 1 90 90 LEU HD11 H 1 0.374 0.009 . 2 . 886 . A 90 LEU HD11 . 26053 1
985 . 1 1 90 90 LEU HD12 H 1 0.374 0.009 . 2 . 886 . A 90 LEU HD12 . 26053 1
986 . 1 1 90 90 LEU HD13 H 1 0.374 0.009 . 2 . 886 . A 90 LEU HD13 . 26053 1
987 . 1 1 90 90 LEU HD21 H 1 0.367 0.01 . 2 . 925 . A 90 LEU HD21 . 26053 1
988 . 1 1 90 90 LEU HD22 H 1 0.367 0.01 . 2 . 925 . A 90 LEU HD22 . 26053 1
989 . 1 1 90 90 LEU HD23 H 1 0.367 0.01 . 2 . 925 . A 90 LEU HD23 . 26053 1
990 . 1 1 90 90 LEU C C 13 174.682 0.005 . 1 . 383 . A 90 LEU C . 26053 1
991 . 1 1 90 90 LEU CA C 13 55.343 0.027 . 1 . 379 . A 90 LEU CA . 26053 1
992 . 1 1 90 90 LEU CB C 13 42.484 0.041 . 1 . 380 . A 90 LEU CB . 26053 1
993 . 1 1 90 90 LEU CG C 13 26.006 0.096 . 1 . 926 . A 90 LEU CG . 26053 1
994 . 1 1 90 90 LEU CD1 C 13 26.182 0.005 . 2 . 564 . A 90 LEU CD1 . 26053 1
995 . 1 1 90 90 LEU CD2 C 13 22.797 0.012 . 2 . 565 . A 90 LEU CD2 . 26053 1
996 . 1 1 90 90 LEU N N 15 127.915 0.065 . 1 . 106 . A 90 LEU N . 26053 1
997 . 1 1 91 91 PHE H H 1 6.149 0.003 . 1 . 93 . A 91 PHE H . 26053 1
998 . 1 1 91 91 PHE HA H 1 4.453 0.004 . 1 . 929 . A 91 PHE HA . 26053 1
999 . 1 1 91 91 PHE HB2 H 1 3.224 0.014 . 2 . 930 . A 91 PHE HB2 . 26053 1
1000 . 1 1 91 91 PHE HB3 H 1 2.691 0.009 . 2 . 931 . A 91 PHE HB3 . 26053 1
1001 . 1 1 91 91 PHE HD1 H 1 6.589 0.006 . 1 . 1109 . A 91 PHE HD1 . 26053 1
1002 . 1 1 91 91 PHE HD2 H 1 6.589 0.006 . 1 . 1109 . A 91 PHE HD2 . 26053 1
1003 . 1 1 91 91 PHE HE1 H 1 6.754 0.008 . 1 . 1111 . A 91 PHE HE1 . 26053 1
1004 . 1 1 91 91 PHE HE2 H 1 6.754 0.008 . 1 . 1111 . A 91 PHE HE2 . 26053 1
1005 . 1 1 91 91 PHE C C 13 174.028 0.02 . 1 . 384 . A 91 PHE C . 26053 1
1006 . 1 1 91 91 PHE CA C 13 55.718 0.03 . 1 . 382 . A 91 PHE CA . 26053 1
1007 . 1 1 91 91 PHE CB C 13 40.683 0.101 . 1 . 381 . A 91 PHE CB . 26053 1
1008 . 1 1 91 91 PHE CD1 C 13 131.953 0.046 . 1 . 1112 . A 91 PHE CD1 . 26053 1
1009 . 1 1 91 91 PHE CD2 C 13 131.953 0.046 . 1 . 1112 . A 91 PHE CD2 . 26053 1
1010 . 1 1 91 91 PHE N N 15 109.026 0.059 . 1 . 94 . A 91 PHE N . 26053 1
1011 . 1 1 92 92 THR H H 1 9.135 0.005 . 1 . 91 . A 92 THR H . 26053 1
1012 . 1 1 92 92 THR HA H 1 5.916 0.017 . 1 . 932 . A 92 THR HA . 26053 1
1013 . 1 1 92 92 THR HB H 1 4.024 0.01 . 1 . 933 . A 92 THR HB . 26053 1
1014 . 1 1 92 92 THR HG21 H 1 1.570 0.012 . 1 . 935 . A 92 THR HG21 . 26053 1
1015 . 1 1 92 92 THR HG22 H 1 1.570 0.012 . 1 . 935 . A 92 THR HG22 . 26053 1
1016 . 1 1 92 92 THR HG23 H 1 1.570 0.012 . 1 . 935 . A 92 THR HG23 . 26053 1
1017 . 1 1 92 92 THR C C 13 174.005 0.1 . 1 . 385 . A 92 THR C . 26053 1
1018 . 1 1 92 92 THR CA C 13 61.587 0.037 . 1 . 386 . A 92 THR CA . 26053 1
1019 . 1 1 92 92 THR CB C 13 71.620 0.026 . 1 . 387 . A 92 THR CB . 26053 1
1020 . 1 1 92 92 THR CG2 C 13 22.742 0.026 . 1 . 934 . A 92 THR CG2 . 26053 1
1021 . 1 1 92 92 THR N N 15 117.537 0.057 . 1 . 92 . A 92 THR N . 26053 1
1022 . 1 1 93 93 LEU H H 1 10.614 0.008 . 1 . 107 . A 93 LEU H . 26053 1
1023 . 1 1 93 93 LEU HA H 1 5.633 0.008 . 1 . 938 . A 93 LEU HA . 26053 1
1024 . 1 1 93 93 LEU HB2 H 1 1.641 0.015 . 2 . 936 . A 93 LEU HB2 . 26053 1
1025 . 1 1 93 93 LEU HB3 H 1 1.599 0.013 . 2 . 937 . A 93 LEU HB3 . 26053 1
1026 . 1 1 93 93 LEU HG H 1 2.332 0.006 . 1 . 943 . A 93 LEU HG . 26053 1
1027 . 1 1 93 93 LEU HD11 H 1 0.821 0.013 . 2 . 939 . A 93 LEU HD11 . 26053 1
1028 . 1 1 93 93 LEU HD12 H 1 0.821 0.013 . 2 . 939 . A 93 LEU HD12 . 26053 1
1029 . 1 1 93 93 LEU HD13 H 1 0.821 0.013 . 2 . 939 . A 93 LEU HD13 . 26053 1
1030 . 1 1 93 93 LEU HD21 H 1 0.896 0.012 . 2 . 940 . A 93 LEU HD21 . 26053 1
1031 . 1 1 93 93 LEU HD22 H 1 0.896 0.012 . 2 . 940 . A 93 LEU HD22 . 26053 1
1032 . 1 1 93 93 LEU HD23 H 1 0.896 0.012 . 2 . 940 . A 93 LEU HD23 . 26053 1
1033 . 1 1 93 93 LEU C C 13 173.465 0.005 . 1 . 589 . A 93 LEU C . 26053 1
1034 . 1 1 93 93 LEU CA C 13 53.090 0.035 . 1 . 485 . A 93 LEU CA . 26053 1
1035 . 1 1 93 93 LEU CB C 13 46.391 0.027 . 1 . 486 . A 93 LEU CB . 26053 1
1036 . 1 1 93 93 LEU CG C 13 25.311 0.032 . 1 . 944 . A 93 LEU CG . 26053 1
1037 . 1 1 93 93 LEU CD1 C 13 26.321 0.026 . 2 . 566 . A 93 LEU CD1 . 26053 1
1038 . 1 1 93 93 LEU CD2 C 13 27.566 0.031 . 2 . 941 . A 93 LEU CD2 . 26053 1
1039 . 1 1 93 93 LEU N N 15 125.534 0.031 . 1 . 108 . A 93 LEU N . 26053 1
1040 . 1 1 94 94 ASN H H 1 8.642 0.005 . 1 . 179 . A 94 ASN H . 26053 1
1041 . 1 1 94 94 ASN HA H 1 4.407 0.01 . 1 . 947 . A 94 ASN HA . 26053 1
1042 . 1 1 94 94 ASN HB2 H 1 2.521 0.005 . 2 . 945 . A 94 ASN HB2 . 26053 1
1043 . 1 1 94 94 ASN HB3 H 1 3.210 0.007 . 2 . 946 . A 94 ASN HB3 . 26053 1
1044 . 1 1 94 94 ASN HD21 H 1 7.977 0.011 . 1 . 1025 . A 94 ASN HD21 . 26053 1
1045 . 1 1 94 94 ASN HD22 H 1 6.339 0.007 . 1 . 1027 . A 94 ASN HD22 . 26053 1
1046 . 1 1 94 94 ASN C C 13 176.869 0.008 . 1 . 487 . A 94 ASN C . 26053 1
1047 . 1 1 94 94 ASN CA C 13 51.810 0.058 . 1 . 483 . A 94 ASN CA . 26053 1
1048 . 1 1 94 94 ASN CB C 13 40.121 0.054 . 1 . 484 . A 94 ASN CB . 26053 1
1049 . 1 1 94 94 ASN N N 15 121.483 0.067 . 1 . 180 . A 94 ASN N . 26053 1
1050 . 1 1 94 94 ASN ND2 N 15 113.885 0.029 . 1 . 1026 . A 94 ASN ND2 . 26053 1
1051 . 1 1 95 95 CYS H H 1 8.955 0.005 . 1 . 87 . A 95 CYS H . 26053 1
1052 . 1 1 95 95 CYS HA H 1 4.030 0.003 . 1 . 948 . A 95 CYS HA . 26053 1
1053 . 1 1 95 95 CYS HB2 H 1 1.819 0.008 . 2 . 949 . A 95 CYS HB2 . 26053 1
1054 . 1 1 95 95 CYS HB3 H 1 1.664 0.01 . 2 . 950 . A 95 CYS HB3 . 26053 1
1055 . 1 1 95 95 CYS C C 13 173.054 0.004 . 1 . 274 . A 95 CYS C . 26053 1
1056 . 1 1 95 95 CYS CA C 13 59.858 0.04 . 1 . 272 . A 95 CYS CA . 26053 1
1057 . 1 1 95 95 CYS CB C 13 26.607 0.069 . 1 . 273 . A 95 CYS CB . 26053 1
1058 . 1 1 95 95 CYS N N 15 124.571 0.076 . 1 . 88 . A 95 CYS N . 26053 1
1059 . 1 1 96 96 LYS H H 1 8.851 0.004 . 1 . 199 . A 96 LYS H . 26053 1
1060 . 1 1 96 96 LYS HA H 1 4.592 0.011 . 1 . 951 . A 96 LYS HA . 26053 1
1061 . 1 1 96 96 LYS HB2 H 1 1.833 0.008 . 2 . 952 . A 96 LYS HB2 . 26053 1
1062 . 1 1 96 96 LYS HB3 H 1 2.179 0.013 . 2 . 953 . A 96 LYS HB3 . 26053 1
1063 . 1 1 96 96 LYS HG2 H 1 1.641 0.012 . 2 . 954 . A 96 LYS HG2 . 26053 1
1064 . 1 1 96 96 LYS HG3 H 1 1.842 0.014 . 2 . 955 . A 96 LYS HG3 . 26053 1
1065 . 1 1 96 96 LYS HD2 H 1 1.785 0.022 . 2 . 958 . A 96 LYS HD2 . 26053 1
1066 . 1 1 96 96 LYS HD3 H 1 1.586 0.021 . 2 . 959 . A 96 LYS HD3 . 26053 1
1067 . 1 1 96 96 LYS HE2 H 1 3.092 0.005 . 2 . 956 . A 96 LYS HE2 . 26053 1
1068 . 1 1 96 96 LYS HE3 H 1 3.281 0.009 . 2 . 957 . A 96 LYS HE3 . 26053 1
1069 . 1 1 96 96 LYS C C 13 178.538 0.009 . 1 . 271 . A 96 LYS C . 26053 1
1070 . 1 1 96 96 LYS CA C 13 54.931 0.032 . 1 . 270 . A 96 LYS CA . 26053 1
1071 . 1 1 96 96 LYS CB C 13 32.442 0.048 . 1 . 269 . A 96 LYS CB . 26053 1
1072 . 1 1 96 96 LYS CG C 13 24.946 0.043 . 1 . 569 . A 96 LYS CG . 26053 1
1073 . 1 1 96 96 LYS CD C 13 27.542 0.084 . 1 . 568 . A 96 LYS CD . 26053 1
1074 . 1 1 96 96 LYS CE C 13 42.637 0.028 . 1 . 567 . A 96 LYS CE . 26053 1
1075 . 1 1 96 96 LYS N N 15 118.687 0.059 . 1 . 200 . A 96 LYS N . 26053 1
1076 . 1 1 97 97 THR H H 1 7.318 0.004 . 1 . 155 . A 97 THR H . 26053 1
1077 . 1 1 97 97 THR HA H 1 4.454 0.004 . 1 . 961 . A 97 THR HA . 26053 1
1078 . 1 1 97 97 THR HB H 1 4.298 0.005 . 1 . 960 . A 97 THR HB . 26053 1
1079 . 1 1 97 97 THR HG21 H 1 1.088 0.004 . 1 . 962 . A 97 THR HG21 . 26053 1
1080 . 1 1 97 97 THR HG22 H 1 1.088 0.004 . 1 . 962 . A 97 THR HG22 . 26053 1
1081 . 1 1 97 97 THR HG23 H 1 1.088 0.004 . 1 . 962 . A 97 THR HG23 . 26053 1
1082 . 1 1 97 97 THR C C 13 176.543 0.035 . 1 . 264 . A 97 THR C . 26053 1
1083 . 1 1 97 97 THR CA C 13 61.032 0.031 . 1 . 262 . A 97 THR CA . 26053 1
1084 . 1 1 97 97 THR CB C 13 71.051 0.055 . 1 . 261 . A 97 THR CB . 26053 1
1085 . 1 1 97 97 THR CG2 C 13 20.817 0.013 . 1 . 570 . A 97 THR CG2 . 26053 1
1086 . 1 1 97 97 THR N N 15 106.280 0.061 . 1 . 156 . A 97 THR N . 26053 1
1087 . 1 1 98 98 GLY H H 1 8.508 0.005 . 1 . 101 . A 98 GLY H . 26053 1
1088 . 1 1 98 98 GLY HA2 H 1 4.323 0.006 . 2 . 963 . A 98 GLY HA2 . 26053 1
1089 . 1 1 98 98 GLY HA3 H 1 3.572 0.006 . 2 . 964 . A 98 GLY HA3 . 26053 1
1090 . 1 1 98 98 GLY C C 13 172.572 0.014 . 1 . 265 . A 98 GLY C . 26053 1
1091 . 1 1 98 98 GLY CA C 13 46.252 0.063 . 1 . 260 . A 98 GLY CA . 26053 1
1092 . 1 1 98 98 GLY N N 15 110.885 0.061 . 1 . 102 . A 98 GLY N . 26053 1
1093 . 1 1 99 99 TYR H H 1 7.780 0.004 . 1 . 181 . A 99 TYR H . 26053 1
1094 . 1 1 99 99 TYR HA H 1 4.295 0.013 . 1 . 967 . A 99 TYR HA . 26053 1
1095 . 1 1 99 99 TYR HB2 H 1 2.729 0.005 . 2 . 965 . A 99 TYR HB2 . 26053 1
1096 . 1 1 99 99 TYR HB3 H 1 3.030 0.003 . 2 . 966 . A 99 TYR HB3 . 26053 1
1097 . 1 1 99 99 TYR HD1 H 1 7.008 0.007 . 1 . 1113 . A 99 TYR HD1 . 26053 1
1098 . 1 1 99 99 TYR HD2 H 1 7.008 0.007 . 1 . 1113 . A 99 TYR HD2 . 26053 1
1099 . 1 1 99 99 TYR C C 13 174.737 0.012 . 1 . 266 . A 99 TYR C . 26053 1
1100 . 1 1 99 99 TYR CA C 13 59.019 0.033 . 1 . 258 . A 99 TYR CA . 26053 1
1101 . 1 1 99 99 TYR CB C 13 39.335 0.02 . 1 . 259 . A 99 TYR CB . 26053 1
1102 . 1 1 99 99 TYR N N 15 120.732 0.063 . 1 . 182 . A 99 TYR N . 26053 1
1103 . 1 1 100 100 PHE H H 1 7.148 0.005 . 1 . 121 . A 100 PHE H . 26053 1
1104 . 1 1 100 100 PHE HA H 1 5.571 0.012 . 1 . 970 . A 100 PHE HA . 26053 1
1105 . 1 1 100 100 PHE HB2 H 1 2.443 0.007 . 2 . 968 . A 100 PHE HB2 . 26053 1
1106 . 1 1 100 100 PHE HB3 H 1 2.575 0.005 . 2 . 969 . A 100 PHE HB3 . 26053 1
1107 . 1 1 100 100 PHE HD1 H 1 6.519 0.005 . 1 . 1107 . A 100 PHE HD1 . 26053 1
1108 . 1 1 100 100 PHE HD2 H 1 6.519 0.005 . 1 . 1107 . A 100 PHE HD2 . 26053 1
1109 . 1 1 100 100 PHE C C 13 173.037 0.005 . 1 . 267 . A 100 PHE C . 26053 1
1110 . 1 1 100 100 PHE CA C 13 55.197 0.044 . 1 . 257 . A 100 PHE CA . 26053 1
1111 . 1 1 100 100 PHE CB C 13 41.950 0.066 . 1 . 256 . A 100 PHE CB . 26053 1
1112 . 1 1 100 100 PHE CD1 C 13 132.005 0.0 . 1 . 1108 . A 100 PHE CD1 . 26053 1
1113 . 1 1 100 100 PHE CD2 C 13 132.005 0.0 . 1 . 1108 . A 100 PHE CD2 . 26053 1
1114 . 1 1 100 100 PHE N N 15 121.867 0.097 . 1 . 122 . A 100 PHE N . 26053 1
1115 . 1 1 101 101 VAL H H 1 8.715 0.003 . 1 . 109 . A 101 VAL H . 26053 1
1116 . 1 1 101 101 VAL HA H 1 4.342 0.011 . 1 . 972 . A 101 VAL HA . 26053 1
1117 . 1 1 101 101 VAL HB H 1 2.038 0.004 . 1 . 971 . A 101 VAL HB . 26053 1
1118 . 1 1 101 101 VAL HG11 H 1 0.905 0.011 . 2 . 973 . A 101 VAL HG11 . 26053 1
1119 . 1 1 101 101 VAL HG12 H 1 0.905 0.011 . 2 . 973 . A 101 VAL HG12 . 26053 1
1120 . 1 1 101 101 VAL HG13 H 1 0.905 0.011 . 2 . 973 . A 101 VAL HG13 . 26053 1
1121 . 1 1 101 101 VAL HG21 H 1 0.928 0.012 . 2 . 974 . A 101 VAL HG21 . 26053 1
1122 . 1 1 101 101 VAL HG22 H 1 0.928 0.012 . 2 . 974 . A 101 VAL HG22 . 26053 1
1123 . 1 1 101 101 VAL HG23 H 1 0.928 0.012 . 2 . 974 . A 101 VAL HG23 . 26053 1
1124 . 1 1 101 101 VAL C C 13 173.853 0.009 . 1 . 268 . A 101 VAL C . 26053 1
1125 . 1 1 101 101 VAL CA C 13 60.644 0.031 . 1 . 254 . A 101 VAL CA . 26053 1
1126 . 1 1 101 101 VAL CB C 13 34.846 0.054 . 1 . 255 . A 101 VAL CB . 26053 1
1127 . 1 1 101 101 VAL CG1 C 13 20.819 0.031 . 2 . 571 . A 101 VAL CG1 . 26053 1
1128 . 1 1 101 101 VAL CG2 C 13 20.696 0.131 . 2 . 572 . A 101 VAL CG2 . 26053 1
1129 . 1 1 101 101 VAL N N 15 116.734 0.075 . 1 . 110 . A 101 VAL N . 26053 1
1130 . 1 1 102 102 GLY H H 1 8.369 0.005 . 1 . 5 . A 102 GLY H . 26053 1
1131 . 1 1 102 102 GLY HA2 H 1 4.000 0.006 . 2 . 975 . A 102 GLY HA2 . 26053 1
1132 . 1 1 102 102 GLY HA3 H 1 4.738 0.004 . 2 . 976 . A 102 GLY HA3 . 26053 1
1133 . 1 1 102 102 GLY C C 13 173.334 0.006 . 1 . 263 . A 102 GLY C . 26053 1
1134 . 1 1 102 102 GLY CA C 13 44.655 0.061 . 1 . 275 . A 102 GLY CA . 26053 1
1135 . 1 1 102 102 GLY N N 15 113.200 0.084 . 1 . 6 . A 102 GLY N . 26053 1
1136 . 1 1 103 103 ASN H H 1 8.885 0.006 . 1 . 473 . A 103 ASN H . 26053 1
1137 . 1 1 103 103 ASN HA H 1 5.018 0.006 . 1 . 977 . A 103 ASN HA . 26053 1
1138 . 1 1 103 103 ASN HB2 H 1 2.806 0.006 . 2 . 978 . A 103 ASN HB2 . 26053 1
1139 . 1 1 103 103 ASN HB3 H 1 2.905 0.012 . 2 . 979 . A 103 ASN HB3 . 26053 1
1140 . 1 1 103 103 ASN HD21 H 1 7.286 0.008 . 1 . 1039 . A 103 ASN HD21 . 26053 1
1141 . 1 1 103 103 ASN HD22 H 1 7.826 0.003 . 1 . 1041 . A 103 ASN HD22 . 26053 1
1142 . 1 1 103 103 ASN C C 13 175.932 0.1 . 1 . 494 . A 103 ASN C . 26053 1
1143 . 1 1 103 103 ASN CA C 13 53.165 0.027 . 1 . 496 . A 103 ASN CA . 26053 1
1144 . 1 1 103 103 ASN CB C 13 39.388 0.031 . 1 . 495 . A 103 ASN CB . 26053 1
1145 . 1 1 103 103 ASN N N 15 119.961 0.071 . 1 . 474 . A 103 ASN N . 26053 1
1146 . 1 1 103 103 ASN ND2 N 15 113.470 0.041 . 1 . 1040 . A 103 ASN ND2 . 26053 1
1147 . 1 1 104 104 GLY C C 13 174.223 0.011 . 1 . 590 . A 104 GLY C . 26053 1
1148 . 1 1 104 104 GLY CA C 13 45.629 0.023 . 1 . 492 . A 104 GLY CA . 26053 1
1149 . 1 1 105 105 ALA H H 1 8.342 0.003 . 1 . 211 . A 105 ALA H . 26053 1
1150 . 1 1 105 105 ALA C C 13 178.022 0.015 . 1 . 490 . A 105 ALA C . 26053 1
1151 . 1 1 105 105 ALA CA C 13 52.534 0.112 . 1 . 488 . A 105 ALA CA . 26053 1
1152 . 1 1 105 105 ALA CB C 13 19.349 0.08 . 1 . 489 . A 105 ALA CB . 26053 1
1153 . 1 1 105 105 ALA N N 15 123.471 0.102 . 1 . 212 . A 105 ALA N . 26053 1
1154 . 1 1 106 106 GLY H H 1 8.250 0.004 . 1 . 471 . A 106 GLY H . 26053 1
1155 . 1 1 106 106 GLY C C 13 173.443 0.1 . 1 . 491 . A 106 GLY C . 26053 1
1156 . 1 1 106 106 GLY CA C 13 45.317 0.1 . 1 . 493 . A 106 GLY CA . 26053 1
1157 . 1 1 106 106 GLY N N 15 107.698 0.115 . 1 . 472 . A 106 GLY N . 26053 1
1158 . 1 1 108 108 ALA HA H 1 4.319 0.003 . 1 . 981 . A 108 ALA HA . 26053 1
1159 . 1 1 108 108 ALA HB1 H 1 1.340 0.008 . 1 . 980 . A 108 ALA HB1 . 26053 1
1160 . 1 1 108 108 ALA HB2 H 1 1.340 0.008 . 1 . 980 . A 108 ALA HB2 . 26053 1
1161 . 1 1 108 108 ALA HB3 H 1 1.340 0.008 . 1 . 980 . A 108 ALA HB3 . 26053 1
1162 . 1 1 108 108 ALA C C 13 177.267 0.003 . 1 . 591 . A 108 ALA C . 26053 1
1163 . 1 1 108 108 ALA CA C 13 52.616 0.025 . 1 . 573 . A 108 ALA CA . 26053 1
1164 . 1 1 108 108 ALA CB C 13 19.188 0.012 . 1 . 574 . A 108 ALA CB . 26053 1
1165 . 1 1 109 109 ASP H H 1 8.476 0.006 . 1 . 145 . A 109 ASP H . 26053 1
1166 . 1 1 109 109 ASP HA H 1 4.616 0.017 . 1 . 982 . A 109 ASP HA . 26053 1
1167 . 1 1 109 109 ASP HB2 H 1 2.579 0.008 . 2 . 1119 . A 109 ASP HB2 . 26053 1
1168 . 1 1 109 109 ASP HB3 H 1 2.719 0.004 . 2 . 1120 . A 109 ASP HB3 . 26053 1
1169 . 1 1 109 109 ASP C C 13 175.945 0.019 . 1 . 436 . A 109 ASP C . 26053 1
1170 . 1 1 109 109 ASP CA C 13 54.465 0.088 . 1 . 435 . A 109 ASP CA . 26053 1
1171 . 1 1 109 109 ASP CB C 13 41.470 0.076 . 1 . 434 . A 109 ASP CB . 26053 1
1172 . 1 1 109 109 ASP N N 15 119.584 0.092 . 1 . 146 . A 109 ASP N . 26053 1
1173 . 1 1 110 110 ASP H H 1 8.198 0.006 . 1 . 151 . A 110 ASP H . 26053 1
1174 . 1 1 110 110 ASP HA H 1 4.589 0.006 . 1 . 987 . A 110 ASP HA . 26053 1
1175 . 1 1 110 110 ASP HB2 H 1 2.575 0.012 . 2 . 983 . A 110 ASP HB2 . 26053 1
1176 . 1 1 110 110 ASP HB3 H 1 2.712 0.014 . 2 . 984 . A 110 ASP HB3 . 26053 1
1177 . 1 1 110 110 ASP C C 13 176.192 0.023 . 1 . 437 . A 110 ASP C . 26053 1
1178 . 1 1 110 110 ASP CA C 13 54.380 0.051 . 1 . 439 . A 110 ASP CA . 26053 1
1179 . 1 1 110 110 ASP CB C 13 41.277 0.122 . 1 . 438 . A 110 ASP CB . 26053 1
1180 . 1 1 110 110 ASP N N 15 119.472 0.078 . 1 . 152 . A 110 ASP N . 26053 1
1181 . 1 1 111 111 LEU H H 1 8.032 0.002 . 1 . 49 . A 111 LEU H . 26053 1
1182 . 1 1 111 111 LEU HA H 1 4.314 0.003 . 1 . 989 . A 111 LEU HA . 26053 1
1183 . 1 1 111 111 LEU HB2 H 1 1.196 0.007 . 2 . 996 . A 111 LEU HB2 . 26053 1
1184 . 1 1 111 111 LEU HB3 H 1 1.541 0.012 . 2 . 997 . A 111 LEU HB3 . 26053 1
1185 . 1 1 111 111 LEU HG H 1 1.565 0.012 . 1 . 1001 . A 111 LEU HG . 26053 1
1186 . 1 1 111 111 LEU HD11 H 1 0.741 0.019 . 2 . 998 . A 111 LEU HD11 . 26053 1
1187 . 1 1 111 111 LEU HD12 H 1 0.741 0.019 . 2 . 998 . A 111 LEU HD12 . 26053 1
1188 . 1 1 111 111 LEU HD13 H 1 0.741 0.019 . 2 . 998 . A 111 LEU HD13 . 26053 1
1189 . 1 1 111 111 LEU HD21 H 1 0.750 0.014 . 2 . 999 . A 111 LEU HD21 . 26053 1
1190 . 1 1 111 111 LEU HD22 H 1 0.750 0.014 . 2 . 999 . A 111 LEU HD22 . 26053 1
1191 . 1 1 111 111 LEU HD23 H 1 0.750 0.014 . 2 . 999 . A 111 LEU HD23 . 26053 1
1192 . 1 1 111 111 LEU C C 13 176.440 0.009 . 1 . 991 . A 111 LEU C . 26053 1
1193 . 1 1 111 111 LEU CA C 13 55.024 0.072 . 1 . 988 . A 111 LEU CA . 26053 1
1194 . 1 1 111 111 LEU CB C 13 42.495 0.057 . 1 . 993 . A 111 LEU CB . 26053 1
1195 . 1 1 111 111 LEU CG C 13 27.151 0.025 . 1 . 1000 . A 111 LEU CG . 26053 1
1196 . 1 1 111 111 LEU CD1 C 13 23.282 0.033 . 2 . 994 . A 111 LEU CD1 . 26053 1
1197 . 1 1 111 111 LEU CD2 C 13 25.028 0.062 . 2 . 995 . A 111 LEU CD2 . 26053 1
1198 . 1 1 111 111 LEU N N 15 121.178 0.071 . 1 . 50 . A 111 LEU N . 26053 1
1199 . 1 1 112 112 ASP H H 1 8.110 0.002 . 1 . 37 . A 112 ASP H . 26053 1
1200 . 1 1 112 112 ASP HA H 1 4.420 0.003 . 1 . 1006 . A 112 ASP HA . 26053 1
1201 . 1 1 112 112 ASP HB2 H 1 2.540 0.009 . 2 . 1004 . A 112 ASP HB2 . 26053 1
1202 . 1 1 112 112 ASP HB3 H 1 2.092 0.007 . 2 . 1005 . A 112 ASP HB3 . 26053 1
1203 . 1 1 112 112 ASP C C 13 174.539 0.037 . 1 . 990 . A 112 ASP C . 26053 1
1204 . 1 1 112 112 ASP CA C 13 53.591 0.052 . 1 . 463 . A 112 ASP CA . 26053 1
1205 . 1 1 112 112 ASP CB C 13 39.971 0.036 . 1 . 462 . A 112 ASP CB . 26053 1
1206 . 1 1 112 112 ASP N N 15 119.858 0.098 . 1 . 38 . A 112 ASP N . 26053 1
1207 . 1 1 113 113 TYR H H 1 7.186 0.003 . 1 . 111 . A 113 TYR H . 26053 1
1208 . 1 1 113 113 TYR HA H 1 4.333 0.005 . 1 . 1007 . A 113 TYR HA . 26053 1
1209 . 1 1 113 113 TYR HB2 H 1 2.861 0.008 . 2 . 1008 . A 113 TYR HB2 . 26053 1
1210 . 1 1 113 113 TYR HB3 H 1 2.896 0.006 . 2 . 1009 . A 113 TYR HB3 . 26053 1
1211 . 1 1 113 113 TYR HD1 H 1 7.029 0.013 . 1 . 1114 . A 113 TYR HD1 . 26053 1
1212 . 1 1 113 113 TYR HD2 H 1 7.029 0.013 . 1 . 1114 . A 113 TYR HD2 . 26053 1
1213 . 1 1 113 113 TYR C C 13 179.611 0.1 . 1 . 992 . A 113 TYR C . 26053 1
1214 . 1 1 113 113 TYR CA C 13 58.572 0.008 . 1 . 1002 . A 113 TYR CA . 26053 1
1215 . 1 1 113 113 TYR CB C 13 39.382 0.073 . 1 . 1003 . A 113 TYR CB . 26053 1
1216 . 1 1 113 113 TYR N N 15 123.520 0.096 . 1 . 112 . A 113 TYR N . 26053 1
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