Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 50745
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'reduced SelW1 chemical shifts'
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '3D HNCACB' . . . 50745 1
2 '3D HNCO' . . . 50745 1
3 '3D HNCA' . . . 50745 1
4 '3D HBHA(CO)NH' . . . 50745 1
5 '3D HN(CA)CO' . . . 50745 1
6 '3D 1H-15N TOCSY' . . . 50745 1
7 '3D 1H-15N NOESY' . . . 50745 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $software_1 . . 50745 1
2 $software_2 . . 50745 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 1 1 MET HA H 1 4.142 0.014 . 1 . . 762 . . 1 MET HA . 50745 1
2 . 1 . 1 1 1 MET HB2 H 1 2.164 0.005 . 1 . . 764 . . 1 MET HB2 . 50745 1
3 . 1 . 1 1 1 MET HB3 H 1 2.164 0.005 . 1 . . 765 . . 1 MET HB3 . 50745 1
4 . 1 . 1 1 1 MET C C 13 171.132 0.01 . 1 . . 610 . . 1 MET C . 50745 1
5 . 1 . 1 1 1 MET CA C 13 55.023 0.034 . 1 . . 609 . . 1 MET CA . 50745 1
6 . 1 . 1 1 1 MET CB C 13 32.427 0.076 . 1 . . 611 . . 1 MET CB . 50745 1
7 . 1 . 1 2 2 ALA H H 1 8.466 0.003 . 1 . . 64 . . 2 ALA H . 50745 1
8 . 1 . 1 2 2 ALA HA H 1 4.442 . . 1 . . 763 . . 2 ALA HA . 50745 1
9 . 1 . 1 2 2 ALA HB1 H 1 1.524 0.007 . 1 . . 766 . . 2 ALA HB1 . 50745 1
10 . 1 . 1 2 2 ALA HB2 H 1 1.524 0.007 . 1 . . 766 . . 2 ALA HB2 . 50745 1
11 . 1 . 1 2 2 ALA HB3 H 1 1.524 0.007 . 1 . . 766 . . 2 ALA HB3 . 50745 1
12 . 1 . 1 2 2 ALA C C 13 174.797 . . 1 . . 431 . . 2 ALA C . 50745 1
13 . 1 . 1 2 2 ALA CA C 13 50.495 0.029 . 1 . . 432 . . 2 ALA CA . 50745 1
14 . 1 . 1 2 2 ALA CB C 13 20.644 . . 1 . . 228 . . 2 ALA CB . 50745 1
15 . 1 . 1 2 2 ALA N N 15 123.788 0.04 . 1 . . 65 . . 2 ALA N . 50745 1
16 . 1 . 1 3 3 PRO HA H 1 4.603 0.004 . 1 . . 767 . . 3 PRO HA . 50745 1
17 . 1 . 1 3 3 PRO HB3 H 1 1.711 . . 1 . . 772 . . 3 PRO HB3 . 50745 1
18 . 1 . 1 3 3 PRO C C 13 177.236 . . 1 . . 574 . . 3 PRO C . 50745 1
19 . 1 . 1 3 3 PRO CA C 13 62.716 0.063 . 1 . . 573 . . 3 PRO CA . 50745 1
20 . 1 . 1 3 3 PRO CB C 13 32.082 0.045 . 1 . . 576 . . 3 PRO CB . 50745 1
21 . 1 . 1 4 4 VAL H H 1 8.218 0.002 . 1 . . 474 . . 4 VAL H . 50745 1
22 . 1 . 1 4 4 VAL HA H 1 4.390 0.006 . 1 . . 778 . . 4 VAL HA . 50745 1
23 . 1 . 1 4 4 VAL HB H 1 1.706 . . 1 . . 779 . . 4 VAL HB . 50745 1
24 . 1 . 1 4 4 VAL C C 13 174.099 0.009 . 1 . . 560 . . 4 VAL C . 50745 1
25 . 1 . 1 4 4 VAL CA C 13 61.634 0.019 . 1 . . 570 . . 4 VAL CA . 50745 1
26 . 1 . 1 4 4 VAL CB C 13 34.431 0.016 . 1 . . 575 . . 4 VAL CB . 50745 1
27 . 1 . 1 4 4 VAL N N 15 122.037 0.015 . 1 . . 473 . . 4 VAL N . 50745 1
28 . 1 . 1 5 5 GLN H H 1 8.649 0.004 . 1 . . 1 . . 5 GLN H . 50745 1
29 . 1 . 1 5 5 GLN HA H 1 4.898 0.014 . 1 . . 776 . . 5 GLN HA . 50745 1
30 . 1 . 1 5 5 GLN HB2 H 1 2.048 0.009 . 2 . . 780 . . 5 GLN HB2 . 50745 1
31 . 1 . 1 5 5 GLN HB3 H 1 2.053 0.008 . 2 . . 781 . . 5 GLN HB3 . 50745 1
32 . 1 . 1 5 5 GLN HE21 H 1 6.713 0.001 . 1 . . 138 . . 5 GLN HE21 . 50745 1
33 . 1 . 1 5 5 GLN HE22 H 1 7.356 0.001 . 1 . . 618 . . 5 GLN HE22 . 50745 1
34 . 1 . 1 5 5 GLN C C 13 175.155 0.033 . 1 . . 368 . . 5 GLN C . 50745 1
35 . 1 . 1 5 5 GLN CA C 13 54.197 0.072 . 1 . . 434 . . 5 GLN CA . 50745 1
36 . 1 . 1 5 5 GLN CB C 13 30.038 0.068 . 1 . . 284 . . 5 GLN CB . 50745 1
37 . 1 . 1 5 5 GLN CG C 13 33.572 0.069 . 1 . . 620 . . 5 GLN CG . 50745 1
38 . 1 . 1 5 5 GLN N N 15 126.568 0.047 . 1 . . 2 . . 5 GLN N . 50745 1
39 . 1 . 1 5 5 GLN NE2 N 15 111.143 0.121 . 1 . . 619 . . 5 GLN NE2 . 50745 1
40 . 1 . 1 6 6 VAL H H 1 8.911 0.003 . 1 . . 70 . . 6 VAL H . 50745 1
41 . 1 . 1 6 6 VAL HA H 1 4.913 0.008 . 1 . . 785 . . 6 VAL HA . 50745 1
42 . 1 . 1 6 6 VAL HB H 1 1.774 0.008 . 1 . . 789 . . 6 VAL HB . 50745 1
43 . 1 . 1 6 6 VAL HG11 H 1 0.708 0.015 . 1 . . 784 . . 6 VAL HG11 . 50745 1
44 . 1 . 1 6 6 VAL HG12 H 1 0.708 0.015 . 1 . . 784 . . 6 VAL HG12 . 50745 1
45 . 1 . 1 6 6 VAL HG13 H 1 0.708 0.015 . 1 . . 784 . . 6 VAL HG13 . 50745 1
46 . 1 . 1 6 6 VAL HG21 H 1 0.708 0.015 . 1 . . 790 . . 6 VAL HG21 . 50745 1
47 . 1 . 1 6 6 VAL HG22 H 1 0.708 0.015 . 1 . . 790 . . 6 VAL HG22 . 50745 1
48 . 1 . 1 6 6 VAL HG23 H 1 0.708 0.015 . 1 . . 790 . . 6 VAL HG23 . 50745 1
49 . 1 . 1 6 6 VAL C C 13 173.732 0.017 . 1 . . 428 . . 6 VAL C . 50745 1
50 . 1 . 1 6 6 VAL CA C 13 61.455 0.043 . 1 . . 430 . . 6 VAL CA . 50745 1
51 . 1 . 1 6 6 VAL CB C 13 32.901 0.096 . 1 . . 259 . . 6 VAL CB . 50745 1
52 . 1 . 1 6 6 VAL N N 15 128.442 0.062 . 1 . . 71 . . 6 VAL N . 50745 1
53 . 1 . 1 7 7 HIS H H 1 9.092 0.002 . 1 . . 132 . . 7 HIS H . 50745 1
54 . 1 . 1 7 7 HIS HA H 1 5.963 0.009 . 1 . . 786 . . 7 HIS HA . 50745 1
55 . 1 . 1 7 7 HIS HB2 H 1 2.758 0.002 . 2 . . 787 . . 7 HIS HB2 . 50745 1
56 . 1 . 1 7 7 HIS HB3 H 1 3.003 0.007 . 2 . . 788 . . 7 HIS HB3 . 50745 1
57 . 1 . 1 7 7 HIS C C 13 174.554 0.019 . 1 . . 424 . . 7 HIS C . 50745 1
58 . 1 . 1 7 7 HIS CA C 13 54.308 0.026 . 1 . . 425 . . 7 HIS CA . 50745 1
59 . 1 . 1 7 7 HIS CB C 13 34.674 0.084 . 1 . . 266 . . 7 HIS CB . 50745 1
60 . 1 . 1 7 7 HIS N N 15 127.484 0.032 . 1 . . 133 . . 7 HIS N . 50745 1
61 . 1 . 1 8 8 VAL H H 1 7.951 0.007 . 1 . . 32 . . 8 VAL H . 50745 1
62 . 1 . 1 8 8 VAL HA H 1 5.312 0.005 . 1 . . 791 . . 8 VAL HA . 50745 1
63 . 1 . 1 8 8 VAL HB H 1 2.030 0.015 . 1 . . 792 . . 8 VAL HB . 50745 1
64 . 1 . 1 8 8 VAL HG11 H 1 1.185 0.006 . 2 . . 793 . . 8 VAL HG11 . 50745 1
65 . 1 . 1 8 8 VAL HG12 H 1 1.185 0.006 . 2 . . 793 . . 8 VAL HG12 . 50745 1
66 . 1 . 1 8 8 VAL HG13 H 1 1.185 0.006 . 2 . . 793 . . 8 VAL HG13 . 50745 1
67 . 1 . 1 8 8 VAL HG21 H 1 0.400 . . 2 . . 794 . . 8 VAL HG21 . 50745 1
68 . 1 . 1 8 8 VAL HG22 H 1 0.400 . . 2 . . 794 . . 8 VAL HG22 . 50745 1
69 . 1 . 1 8 8 VAL HG23 H 1 0.400 . . 2 . . 794 . . 8 VAL HG23 . 50745 1
70 . 1 . 1 8 8 VAL C C 13 173.386 0.004 . 1 . . 427 . . 8 VAL C . 50745 1
71 . 1 . 1 8 8 VAL CA C 13 59.721 0.044 . 1 . . 374 . . 8 VAL CA . 50745 1
72 . 1 . 1 8 8 VAL CB C 13 34.495 0.028 . 1 . . 271 . . 8 VAL CB . 50745 1
73 . 1 . 1 8 8 VAL N N 15 125.355 0.035 . 1 . . 33 . . 8 VAL N . 50745 1
74 . 1 . 1 9 9 LEU H H 1 8.350 0.003 . 1 . . 40 . . 9 LEU H . 50745 1
75 . 1 . 1 9 9 LEU HA H 1 5.154 0.004 . 1 . . 795 . . 9 LEU HA . 50745 1
76 . 1 . 1 9 9 LEU HB2 H 1 1.501 0.004 . 2 . . 796 . . 9 LEU HB2 . 50745 1
77 . 1 . 1 9 9 LEU HB3 H 1 1.752 0.008 . 2 . . 797 . . 9 LEU HB3 . 50745 1
78 . 1 . 1 9 9 LEU C C 13 175.415 0.012 . 1 . . 426 . . 9 LEU C . 50745 1
79 . 1 . 1 9 9 LEU CA C 13 53.066 0.041 . 1 . . 429 . . 9 LEU CA . 50745 1
80 . 1 . 1 9 9 LEU CB C 13 44.369 0.044 . 1 . . 233 . . 9 LEU CB . 50745 1
81 . 1 . 1 9 9 LEU N N 15 129.897 0.032 . 1 . . 41 . . 9 LEU N . 50745 1
82 . 1 . 1 10 10 TYR H H 1 9.099 0.003 . 1 . . 109 . . 10 TYR H . 50745 1
83 . 1 . 1 10 10 TYR HA H 1 5.608 0.009 . 1 . . 798 . . 10 TYR HA . 50745 1
84 . 1 . 1 10 10 TYR HB2 H 1 3.550 0.01 . 2 . . 799 . . 10 TYR HB2 . 50745 1
85 . 1 . 1 10 10 TYR HB3 H 1 2.486 0.012 . 2 . . 800 . . 10 TYR HB3 . 50745 1
86 . 1 . 1 10 10 TYR C C 13 173.383 0.009 . 1 . . 435 . . 10 TYR C . 50745 1
87 . 1 . 1 10 10 TYR CA C 13 54.238 0.035 . 1 . . 436 . . 10 TYR CA . 50745 1
88 . 1 . 1 10 10 TYR CB C 13 43.033 0.035 . 1 . . 220 . . 10 TYR CB . 50745 1
89 . 1 . 1 10 10 TYR N N 15 123.059 0.027 . 1 . . 110 . . 10 TYR N . 50745 1
90 . 1 . 1 11 11 CYS H H 1 7.924 0.003 . 1 . . 695 . . 11 CYS H . 50745 1
91 . 1 . 1 11 11 CYS HA H 1 4.627 . . 1 . . 803 . . 11 CYS HA . 50745 1
92 . 1 . 1 11 11 CYS HB2 H 1 2.273 0.011 . 2 . . 804 . . 11 CYS HB2 . 50745 1
93 . 1 . 1 11 11 CYS HB3 H 1 2.604 0.004 . 2 . . 805 . . 11 CYS HB3 . 50745 1
94 . 1 . 1 11 11 CYS C C 13 176.589 0.027 . 1 . . 712 . . 11 CYS C . 50745 1
95 . 1 . 1 11 11 CYS CA C 13 60.783 0.061 . 1 . . 713 . . 11 CYS CA . 50745 1
96 . 1 . 1 11 11 CYS CB C 13 30.130 0.075 . 1 . . 714 . . 11 CYS CB . 50745 1
97 . 1 . 1 11 11 CYS N N 15 122.112 0.053 . 1 . . 696 . . 11 CYS N . 50745 1
98 . 1 . 1 12 12 GLY H H 1 8.248 0.002 . 1 . . 685 . . 12 GLY H . 50745 1
99 . 1 . 1 12 12 GLY HA2 H 1 4.333 0.019 . 2 . . 801 . . 12 GLY HA2 . 50745 1
100 . 1 . 1 12 12 GLY HA3 H 1 4.074 0.015 . 2 . . 802 . . 12 GLY HA3 . 50745 1
101 . 1 . 1 12 12 GLY C C 13 176.093 0.018 . 1 . . 715 . . 12 GLY C . 50745 1
102 . 1 . 1 12 12 GLY CA C 13 46.292 0.027 . 1 . . 716 . . 12 GLY CA . 50745 1
103 . 1 . 1 12 12 GLY N N 15 117.732 0.044 . 1 . . 686 . . 12 GLY N . 50745 1
104 . 1 . 1 13 13 GLY H H 1 9.184 0.003 . 1 . . 683 . . 13 GLY H . 50745 1
105 . 1 . 1 13 13 GLY HA2 H 1 4.131 0.016 . 2 . . 806 . . 13 GLY HA2 . 50745 1
106 . 1 . 1 13 13 GLY HA3 H 1 3.533 0.006 . 2 . . 807 . . 13 GLY HA3 . 50745 1
107 . 1 . 1 13 13 GLY C C 13 175.544 0.005 . 1 . . 718 . . 13 GLY C . 50745 1
108 . 1 . 1 13 13 GLY CA C 13 45.751 0.046 . 1 . . 717 . . 13 GLY CA . 50745 1
109 . 1 . 1 13 13 GLY N N 15 114.864 0.053 . 1 . . 684 . . 13 GLY N . 50745 1
110 . 1 . 1 14 14 CYS H H 1 9.530 0.002 . 1 . . 697 . . 14 CYS H . 50745 1
111 . 1 . 1 14 14 CYS HA H 1 4.501 . . 1 . . 810 . . 14 CYS HA . 50745 1
112 . 1 . 1 14 14 CYS HB2 H 1 2.508 . . 2 . . 808 . . 14 CYS HB2 . 50745 1
113 . 1 . 1 14 14 CYS HB3 H 1 3.045 . . 2 . . 809 . . 14 CYS HB3 . 50745 1
114 . 1 . 1 14 14 CYS C C 13 175.902 . . 1 . . 719 . . 14 CYS C . 50745 1
115 . 1 . 1 14 14 CYS CA C 13 59.959 0.055 . 1 . . 614 . . 14 CYS CA . 50745 1
116 . 1 . 1 14 14 CYS CB C 13 28.064 . . 1 . . 720 . . 14 CYS CB . 50745 1
117 . 1 . 1 14 14 CYS N N 15 121.332 0.057 . 1 . . 698 . . 14 CYS N . 50745 1
118 . 1 . 1 15 15 GLY H H 1 8.129 . . 1 . . 185 . . 15 GLY H . 50745 1
119 . 1 . 1 15 15 GLY CA C 13 47.355 0.054 . 1 . . 749 . . 15 GLY CA . 50745 1
120 . 1 . 1 15 15 GLY N N 15 105.619 . . 1 . . 186 . . 15 GLY N . 50745 1
121 . 1 . 1 16 16 TYR H H 1 8.379 0.002 . 1 . . 60 . . 16 TYR H . 50745 1
122 . 1 . 1 16 16 TYR HA H 1 4.770 . . 1 . . 811 . . 16 TYR HA . 50745 1
123 . 1 . 1 16 16 TYR HB2 H 1 3.712 . . 2 . . 812 . . 16 TYR HB2 . 50745 1
124 . 1 . 1 16 16 TYR HB3 H 1 3.651 . . 2 . . 813 . . 16 TYR HB3 . 50745 1
125 . 1 . 1 16 16 TYR C C 13 176.920 0.025 . 1 . . 752 . . 16 TYR C . 50745 1
126 . 1 . 1 16 16 TYR CA C 13 57.000 0.068 . 1 . . 748 . . 16 TYR CA . 50745 1
127 . 1 . 1 16 16 TYR CB C 13 37.200 0.065 . 1 . . 600 . . 16 TYR CB . 50745 1
128 . 1 . 1 16 16 TYR N N 15 119.048 0.005 . 1 . . 61 . . 16 TYR N . 50745 1
129 . 1 . 1 17 17 GLY H H 1 9.149 0.003 . 1 . . 612 . . 17 GLY H . 50745 1
130 . 1 . 1 17 17 GLY C C 13 176.484 . . 1 . . 751 . . 17 GLY C . 50745 1
131 . 1 . 1 17 17 GLY CA C 13 47.763 0.01 . 1 . . 747 . . 17 GLY CA . 50745 1
132 . 1 . 1 17 17 GLY N N 15 112.453 0.027 . 1 . . 613 . . 17 GLY N . 50745 1
133 . 1 . 1 18 18 SER HA H 1 3.884 . . 1 . . 814 . . 18 SER HA . 50745 1
134 . 1 . 1 18 18 SER C C 13 177.249 . . 1 . . 721 . . 18 SER C . 50745 1
135 . 1 . 1 18 18 SER CA C 13 61.513 0.013 . 1 . . 397 . . 18 SER CA . 50745 1
136 . 1 . 1 19 19 ARG H H 1 7.260 0.006 . 1 . . 14 . . 19 ARG H . 50745 1
137 . 1 . 1 19 19 ARG HA H 1 4.015 0.008 . 1 . . 815 . . 19 ARG HA . 50745 1
138 . 1 . 1 19 19 ARG HB2 H 1 1.784 0.011 . 2 . . 817 . . 19 ARG HB2 . 50745 1
139 . 1 . 1 19 19 ARG HB3 H 1 1.350 0.005 . 2 . . 818 . . 19 ARG HB3 . 50745 1
140 . 1 . 1 19 19 ARG C C 13 179.903 0.011 . 1 . . 394 . . 19 ARG C . 50745 1
141 . 1 . 1 19 19 ARG CA C 13 58.287 0.023 . 1 . . 395 . . 19 ARG CA . 50745 1
142 . 1 . 1 19 19 ARG CB C 13 29.633 0.073 . 1 . . 232 . . 19 ARG CB . 50745 1
143 . 1 . 1 19 19 ARG N N 15 122.924 0.035 . 1 . . 15 . . 19 ARG N . 50745 1
144 . 1 . 1 20 20 TYR H H 1 7.958 0.003 . 1 . . 144 . . 20 TYR H . 50745 1
145 . 1 . 1 20 20 TYR HA H 1 4.140 0.016 . 1 . . 816 . . 20 TYR HA . 50745 1
146 . 1 . 1 20 20 TYR HB2 H 1 2.550 0.01 . 2 . . 819 . . 20 TYR HB2 . 50745 1
147 . 1 . 1 20 20 TYR HB3 H 1 2.778 0.007 . 2 . . 820 . . 20 TYR HB3 . 50745 1
148 . 1 . 1 20 20 TYR C C 13 175.760 0.017 . 1 . . 398 . . 20 TYR C . 50745 1
149 . 1 . 1 20 20 TYR CA C 13 62.457 0.053 . 1 . . 399 . . 20 TYR CA . 50745 1
150 . 1 . 1 20 20 TYR CB C 13 38.078 0.06 . 1 . . 215 . . 20 TYR CB . 50745 1
151 . 1 . 1 20 20 TYR N N 15 121.510 0.028 . 1 . . 145 . . 20 TYR N . 50745 1
152 . 1 . 1 21 21 ARG H H 1 8.152 0.003 . 1 . . 212 . . 21 ARG H . 50745 1
153 . 1 . 1 21 21 ARG HA H 1 3.527 0.013 . 1 . . 823 . . 21 ARG HA . 50745 1
154 . 1 . 1 21 21 ARG HB2 H 1 1.779 0.009 . 1 . . 821 . . 21 ARG HB2 . 50745 1
155 . 1 . 1 21 21 ARG HB3 H 1 1.779 0.009 . 1 . . 822 . . 21 ARG HB3 . 50745 1
156 . 1 . 1 21 21 ARG C C 13 179.172 0.01 . 1 . . 401 . . 21 ARG C . 50745 1
157 . 1 . 1 21 21 ARG CA C 13 59.133 0.033 . 1 . . 400 . . 21 ARG CA . 50745 1
158 . 1 . 1 21 21 ARG CB C 13 29.524 0.094 . 1 . . 254 . . 21 ARG CB . 50745 1
159 . 1 . 1 21 21 ARG N N 15 118.807 0.028 . 1 . . 213 . . 21 ARG N . 50745 1
160 . 1 . 1 22 22 SER H H 1 7.871 0.006 . 1 . . 90 . . 22 SER H . 50745 1
161 . 1 . 1 22 22 SER HA H 1 4.155 0.003 . 1 . . 824 . . 22 SER HA . 50745 1
162 . 1 . 1 22 22 SER HB2 H 1 3.877 0.013 . 2 . . 825 . . 22 SER HB2 . 50745 1
163 . 1 . 1 22 22 SER HB3 H 1 3.877 0.013 . 2 . . 826 . . 22 SER HB3 . 50745 1
164 . 1 . 1 22 22 SER C C 13 176.826 . . 1 . . 709 . . 22 SER C . 50745 1
165 . 1 . 1 22 22 SER CA C 13 61.543 0.057 . 1 . . 402 . . 22 SER CA . 50745 1
166 . 1 . 1 22 22 SER CB C 13 62.536 0.089 . 1 . . 253 . . 22 SER CB . 50745 1
167 . 1 . 1 22 22 SER N N 15 113.920 0.033 . 1 . . 91 . . 22 SER N . 50745 1
168 . 1 . 1 23 23 LEU H H 1 7.509 0.004 . 1 . . 26 . . 23 LEU H . 50745 1
169 . 1 . 1 23 23 LEU HA H 1 4.230 0.012 . 1 . . 827 . . 23 LEU HA . 50745 1
170 . 1 . 1 23 23 LEU HB2 H 1 2.127 0.006 . 2 . . 828 . . 23 LEU HB2 . 50745 1
171 . 1 . 1 23 23 LEU HB3 H 1 1.655 0.013 . 2 . . 830 . . 23 LEU HB3 . 50745 1
172 . 1 . 1 23 23 LEU C C 13 177.591 0.023 . 1 . . 369 . . 23 LEU C . 50745 1
173 . 1 . 1 23 23 LEU CA C 13 57.923 0.046 . 1 . . 370 . . 23 LEU CA . 50745 1
174 . 1 . 1 23 23 LEU CB C 13 41.321 0.019 . 1 . . 273 . . 23 LEU CB . 50745 1
175 . 1 . 1 23 23 LEU N N 15 125.223 0.028 . 1 . . 27 . . 23 LEU N . 50745 1
176 . 1 . 1 24 24 GLU H H 1 8.390 0.006 . 1 . . 163 . . 24 GLU H . 50745 1
177 . 1 . 1 24 24 GLU HA H 1 3.463 0.011 . 1 . . 829 . . 24 GLU HA . 50745 1
178 . 1 . 1 24 24 GLU HB2 H 1 1.119 0.012 . 2 . . 831 . . 24 GLU HB2 . 50745 1
179 . 1 . 1 24 24 GLU HB3 H 1 1.507 0.001 . 2 . . 832 . . 24 GLU HB3 . 50745 1
180 . 1 . 1 24 24 GLU C C 13 178.162 0.01 . 1 . . 371 . . 24 GLU C . 50745 1
181 . 1 . 1 24 24 GLU CA C 13 59.849 0.088 . 1 . . 372 . . 24 GLU CA . 50745 1
182 . 1 . 1 24 24 GLU CB C 13 28.698 0.056 . 1 . . 241 . . 24 GLU CB . 50745 1
183 . 1 . 1 24 24 GLU N N 15 120.598 0.048 . 1 . . 164 . . 24 GLU N . 50745 1
184 . 1 . 1 25 25 ASN H H 1 7.908 0.004 . 1 . . 68 . . 25 ASN H . 50745 1
185 . 1 . 1 25 25 ASN HA H 1 4.246 0.01 . 1 . . 835 . . 25 ASN HA . 50745 1
186 . 1 . 1 25 25 ASN HB2 H 1 2.745 0.011 . 1 . . 833 . . 25 ASN HB2 . 50745 1
187 . 1 . 1 25 25 ASN HB3 H 1 2.745 0.011 . 1 . . 834 . . 25 ASN HB3 . 50745 1
188 . 1 . 1 25 25 ASN HD21 H 1 6.810 0.0 . 1 . . 606 . . 25 ASN HD21 . 50745 1
189 . 1 . 1 25 25 ASN HD22 H 1 7.674 0.001 . 1 . . 607 . . 25 ASN HD22 . 50745 1
190 . 1 . 1 25 25 ASN C C 13 176.897 0.022 . 1 . . 336 . . 25 ASN C . 50745 1
191 . 1 . 1 25 25 ASN CA C 13 56.568 0.057 . 1 . . 335 . . 25 ASN CA . 50745 1
192 . 1 . 1 25 25 ASN CB C 13 38.560 0.085 . 1 . . 267 . . 25 ASN CB . 50745 1
193 . 1 . 1 25 25 ASN N N 15 115.168 0.031 . 1 . . 69 . . 25 ASN N . 50745 1
194 . 1 . 1 25 25 ASN ND2 N 15 112.964 0.128 . 1 . . 9 . . 25 ASN ND2 . 50745 1
195 . 1 . 1 26 26 ALA H H 1 8.133 0.003 . 1 . . 130 . . 26 ALA H . 50745 1
196 . 1 . 1 26 26 ALA HA H 1 4.142 0.003 . 1 . . 836 . . 26 ALA HA . 50745 1
197 . 1 . 1 26 26 ALA HB1 H 1 1.714 0.008 . 1 . . 837 . . 26 ALA HB1 . 50745 1
198 . 1 . 1 26 26 ALA HB2 H 1 1.714 0.008 . 1 . . 837 . . 26 ALA HB2 . 50745 1
199 . 1 . 1 26 26 ALA HB3 H 1 1.714 0.008 . 1 . . 837 . . 26 ALA HB3 . 50745 1
200 . 1 . 1 26 26 ALA C C 13 181.149 0.018 . 1 . . 297 . . 26 ALA C . 50745 1
201 . 1 . 1 26 26 ALA CA C 13 55.371 0.039 . 1 . . 300 . . 26 ALA CA . 50745 1
202 . 1 . 1 26 26 ALA CB C 13 17.763 0.076 . 1 . . 272 . . 26 ALA CB . 50745 1
203 . 1 . 1 26 26 ALA N N 15 121.929 0.029 . 1 . . 131 . . 26 ALA N . 50745 1
204 . 1 . 1 27 27 ILE H H 1 8.558 0.003 . 1 . . 210 . . 27 ILE H . 50745 1
205 . 1 . 1 27 27 ILE HA H 1 3.868 0.006 . 1 . . 838 . . 27 ILE HA . 50745 1
206 . 1 . 1 27 27 ILE HB H 1 2.326 0.008 . 1 . . 839 . . 27 ILE HB . 50745 1
207 . 1 . 1 27 27 ILE C C 13 177.326 0.013 . 1 . . 338 . . 27 ILE C . 50745 1
208 . 1 . 1 27 27 ILE CA C 13 66.270 0.058 . 1 . . 337 . . 27 ILE CA . 50745 1
209 . 1 . 1 27 27 ILE CB C 13 38.394 0.067 . 1 . . 262 . . 27 ILE CB . 50745 1
210 . 1 . 1 27 27 ILE N N 15 118.737 0.047 . 1 . . 211 . . 27 ILE N . 50745 1
211 . 1 . 1 28 28 ARG H H 1 8.571 0.002 . 1 . . 194 . . 28 ARG H . 50745 1
212 . 1 . 1 28 28 ARG HA H 1 4.101 0.01 . 1 . . 840 . . 28 ARG HA . 50745 1
213 . 1 . 1 28 28 ARG HB2 H 1 1.890 0.012 . 1 . . 841 . . 28 ARG HB2 . 50745 1
214 . 1 . 1 28 28 ARG HB3 H 1 1.890 0.012 . 1 . . 842 . . 28 ARG HB3 . 50745 1
215 . 1 . 1 28 28 ARG C C 13 178.923 0.029 . 1 . . 341 . . 28 ARG C . 50745 1
216 . 1 . 1 28 28 ARG CA C 13 60.104 0.089 . 1 . . 340 . . 28 ARG CA . 50745 1
217 . 1 . 1 28 28 ARG CB C 13 30.077 0.009 . 1 . . 339 . . 28 ARG CB . 50745 1
218 . 1 . 1 28 28 ARG N N 15 119.360 0.042 . 1 . . 195 . . 28 ARG N . 50745 1
219 . 1 . 1 29 29 MET H H 1 8.004 0.004 . 1 . . 196 . . 29 MET H . 50745 1
220 . 1 . 1 29 29 MET HA H 1 4.183 0.005 . 1 . . 847 . . 29 MET HA . 50745 1
221 . 1 . 1 29 29 MET HB2 H 1 2.061 0.022 . 2 . . 850 . . 29 MET HB2 . 50745 1
222 . 1 . 1 29 29 MET HB3 H 1 2.630 0.006 . 2 . . 852 . . 29 MET HB3 . 50745 1
223 . 1 . 1 29 29 MET C C 13 177.800 0.016 . 1 . . 342 . . 29 MET C . 50745 1
224 . 1 . 1 29 29 MET CA C 13 57.121 0.046 . 1 . . 343 . . 29 MET CA . 50745 1
225 . 1 . 1 29 29 MET CB C 13 32.618 0.059 . 1 . . 250 . . 29 MET CB . 50745 1
226 . 1 . 1 29 29 MET N N 15 114.486 0.022 . 1 . . 197 . . 29 MET N . 50745 1
227 . 1 . 1 30 30 LYS H H 1 7.407 0.003 . 1 . . 159 . . 30 LYS H . 50745 1
228 . 1 . 1 30 30 LYS HA H 1 3.805 0.012 . 1 . . 851 . . 30 LYS HA . 50745 1
229 . 1 . 1 30 30 LYS HB2 H 1 0.950 0.005 . 2 . . 853 . . 30 LYS HB2 . 50745 1
230 . 1 . 1 30 30 LYS HB3 H 1 1.147 0.003 . 2 . . 854 . . 30 LYS HB3 . 50745 1
231 . 1 . 1 30 30 LYS C C 13 175.618 0.021 . 1 . . 345 . . 30 LYS C . 50745 1
232 . 1 . 1 30 30 LYS CA C 13 56.050 0.039 . 1 . . 344 . . 30 LYS CA . 50745 1
233 . 1 . 1 30 30 LYS CB C 13 32.507 0.025 . 1 . . 279 . . 30 LYS CB . 50745 1
234 . 1 . 1 30 30 LYS N N 15 120.836 0.027 . 1 . . 160 . . 30 LYS N . 50745 1
235 . 1 . 1 31 31 PHE H H 1 7.719 0.004 . 1 . . 46 . . 31 PHE H . 50745 1
236 . 1 . 1 31 31 PHE HA H 1 4.949 . . 1 . . 855 . . 31 PHE HA . 50745 1
237 . 1 . 1 31 31 PHE HB2 H 1 2.856 . . 1 . . 856 . . 31 PHE HB2 . 50745 1
238 . 1 . 1 31 31 PHE HB3 H 1 2.856 . . 1 . . 857 . . 31 PHE HB3 . 50745 1
239 . 1 . 1 31 31 PHE C C 13 173.395 . . 1 . . 347 . . 31 PHE C . 50745 1
240 . 1 . 1 31 31 PHE CA C 13 54.504 0.035 . 1 . . 346 . . 31 PHE CA . 50745 1
241 . 1 . 1 31 31 PHE CB C 13 39.575 . . 1 . . 278 . . 31 PHE CB . 50745 1
242 . 1 . 1 31 31 PHE N N 15 115.823 0.042 . 1 . . 47 . . 31 PHE N . 50745 1
243 . 1 . 1 32 32 PRO HA H 1 4.640 . . 1 . . 860 . . 32 PRO HA . 50745 1
244 . 1 . 1 32 32 PRO HB2 H 1 1.926 0.005 . 2 . . 858 . . 32 PRO HB2 . 50745 1
245 . 1 . 1 32 32 PRO HB3 H 1 2.324 . . 2 . . 859 . . 32 PRO HB3 . 50745 1
246 . 1 . 1 32 32 PRO C C 13 178.293 0.029 . 1 . . 523 . . 32 PRO C . 50745 1
247 . 1 . 1 32 32 PRO CA C 13 64.976 0.083 . 1 . . 524 . . 32 PRO CA . 50745 1
248 . 1 . 1 32 32 PRO CB C 13 32.054 0.057 . 1 . . 526 . . 32 PRO CB . 50745 1
249 . 1 . 1 33 33 ASN H H 1 8.801 0.006 . 1 . . 54 . . 33 ASN H . 50745 1
250 . 1 . 1 33 33 ASN HA H 1 4.872 0.002 . 1 . . 861 . . 33 ASN HA . 50745 1
251 . 1 . 1 33 33 ASN HB2 H 1 2.790 0.001 . 2 . . 863 . . 33 ASN HB2 . 50745 1
252 . 1 . 1 33 33 ASN HB3 H 1 3.020 0.002 . 2 . . 864 . . 33 ASN HB3 . 50745 1
253 . 1 . 1 33 33 ASN HD21 H 1 7.663 0.001 . 1 . . 593 . . 33 ASN HD21 . 50745 1
254 . 1 . 1 33 33 ASN HD22 H 1 7.014 0.001 . 1 . . 595 . . 33 ASN HD22 . 50745 1
255 . 1 . 1 33 33 ASN C C 13 174.358 0.01 . 1 . . 510 . . 33 ASN C . 50745 1
256 . 1 . 1 33 33 ASN CA C 13 53.119 0.095 . 1 . . 442 . . 33 ASN CA . 50745 1
257 . 1 . 1 33 33 ASN CB C 13 38.882 0.022 . 1 . . 443 . . 33 ASN CB . 50745 1
258 . 1 . 1 33 33 ASN N N 15 115.509 0.019 . 1 . . 55 . . 33 ASN N . 50745 1
259 . 1 . 1 33 33 ASN ND2 N 15 113.609 0.127 . 1 . . 594 . . 33 ASN ND2 . 50745 1
260 . 1 . 1 34 34 ALA H H 1 7.293 0.003 . 1 . . 100 . . 34 ALA H . 50745 1
261 . 1 . 1 34 34 ALA HA H 1 4.482 0.015 . 1 . . 862 . . 34 ALA HA . 50745 1
262 . 1 . 1 34 34 ALA HB1 H 1 1.425 0.012 . 1 . . 759 . . 34 ALA HB1 . 50745 1
263 . 1 . 1 34 34 ALA HB2 H 1 1.425 0.012 . 1 . . 759 . . 34 ALA HB2 . 50745 1
264 . 1 . 1 34 34 ALA HB3 H 1 1.425 0.012 . 1 . . 759 . . 34 ALA HB3 . 50745 1
265 . 1 . 1 34 34 ALA C C 13 176.641 0.029 . 1 . . 392 . . 34 ALA C . 50745 1
266 . 1 . 1 34 34 ALA CA C 13 51.461 0.096 . 1 . . 391 . . 34 ALA CA . 50745 1
267 . 1 . 1 34 34 ALA CB C 13 22.268 0.087 . 1 . . 393 . . 34 ALA CB . 50745 1
268 . 1 . 1 34 34 ALA N N 15 122.241 0.003 . 1 . . 101 . . 34 ALA N . 50745 1
269 . 1 . 1 35 35 ASP H H 1 8.757 0.003 . 1 . . 58 . . 35 ASP H . 50745 1
270 . 1 . 1 35 35 ASP HA H 1 4.712 0.002 . 1 . . 865 . . 35 ASP HA . 50745 1
271 . 1 . 1 35 35 ASP HB2 H 1 2.476 0.013 . 2 . . 760 . . 35 ASP HB2 . 50745 1
272 . 1 . 1 35 35 ASP HB3 H 1 2.867 0.011 . 2 . . 761 . . 35 ASP HB3 . 50745 1
273 . 1 . 1 35 35 ASP C C 13 173.944 0.032 . 1 . . 389 . . 35 ASP C . 50745 1
274 . 1 . 1 35 35 ASP CA C 13 53.454 0.033 . 1 . . 390 . . 35 ASP CA . 50745 1
275 . 1 . 1 35 35 ASP CB C 13 39.613 0.037 . 1 . . 264 . . 35 ASP CB . 50745 1
276 . 1 . 1 35 35 ASP N N 15 123.371 0.033 . 1 . . 59 . . 35 ASP N . 50745 1
277 . 1 . 1 36 36 ILE H H 1 7.571 0.003 . 1 . . 187 . . 36 ILE H . 50745 1
278 . 1 . 1 36 36 ILE HA H 1 4.490 0.01 . 1 . . 866 . . 36 ILE HA . 50745 1
279 . 1 . 1 36 36 ILE HB H 1 1.434 0.015 . 1 . . 867 . . 36 ILE HB . 50745 1
280 . 1 . 1 36 36 ILE C C 13 175.046 0.009 . 1 . . 386 . . 36 ILE C . 50745 1
281 . 1 . 1 36 36 ILE CA C 13 59.842 0.049 . 1 . . 385 . . 36 ILE CA . 50745 1
282 . 1 . 1 36 36 ILE CB C 13 40.210 0.079 . 1 . . 248 . . 36 ILE CB . 50745 1
283 . 1 . 1 36 36 ILE N N 15 123.654 0.028 . 1 . . 188 . . 36 ILE N . 50745 1
284 . 1 . 1 37 37 LYS H H 1 8.773 0.002 . 1 . . 111 . . 37 LYS H . 50745 1
285 . 1 . 1 37 37 LYS HA H 1 4.679 0.01 . 1 . . 870 . . 37 LYS HA . 50745 1
286 . 1 . 1 37 37 LYS HB2 H 1 1.754 0.012 . 1 . . 871 . . 37 LYS HB2 . 50745 1
287 . 1 . 1 37 37 LYS HB3 H 1 1.754 0.012 . 1 . . 872 . . 37 LYS HB3 . 50745 1
288 . 1 . 1 37 37 LYS C C 13 174.805 0.024 . 1 . . 490 . . 37 LYS C . 50745 1
289 . 1 . 1 37 37 LYS CA C 13 54.346 0.012 . 1 . . 437 . . 37 LYS CA . 50745 1
290 . 1 . 1 37 37 LYS CB C 13 34.034 0.033 . 1 . . 249 . . 37 LYS CB . 50745 1
291 . 1 . 1 37 37 LYS N N 15 127.979 0.032 . 1 . . 112 . . 37 LYS N . 50745 1
292 . 1 . 1 38 38 PHE H H 1 8.981 0.002 . 1 . . 82 . . 38 PHE H . 50745 1
293 . 1 . 1 38 38 PHE HA H 1 5.649 0.006 . 1 . . 873 . . 38 PHE HA . 50745 1
294 . 1 . 1 38 38 PHE HB2 H 1 3.551 0.009 . 2 . . 874 . . 38 PHE HB2 . 50745 1
295 . 1 . 1 38 38 PHE HB3 H 1 2.952 0.009 . 2 . . 875 . . 38 PHE HB3 . 50745 1
296 . 1 . 1 38 38 PHE C C 13 176.481 0.027 . 1 . . 308 . . 38 PHE C . 50745 1
297 . 1 . 1 38 38 PHE CA C 13 57.831 0.059 . 1 . . 309 . . 38 PHE CA . 50745 1
298 . 1 . 1 38 38 PHE CB C 13 41.555 0.018 . 1 . . 486 . . 38 PHE CB . 50745 1
299 . 1 . 1 38 38 PHE N N 15 124.257 0.041 . 1 . . 83 . . 38 PHE N . 50745 1
300 . 1 . 1 39 39 SER H H 1 9.492 0.003 . 1 . . 30 . . 39 SER H . 50745 1
301 . 1 . 1 39 39 SER HA H 1 4.842 0.01 . 1 . . 843 . . 39 SER HA . 50745 1
302 . 1 . 1 39 39 SER HB2 H 1 3.868 0.008 . 2 . . 844 . . 39 SER HB2 . 50745 1
303 . 1 . 1 39 39 SER HB3 H 1 4.169 0.014 . 2 . . 845 . . 39 SER HB3 . 50745 1
304 . 1 . 1 39 39 SER C C 13 172.111 0.001 . 1 . . 301 . . 39 SER C . 50745 1
305 . 1 . 1 39 39 SER CA C 13 57.649 0.045 . 1 . . 304 . . 39 SER CA . 50745 1
306 . 1 . 1 39 39 SER CB C 13 65.881 0.033 . 1 . . 263 . . 39 SER CB . 50745 1
307 . 1 . 1 39 39 SER N N 15 117.652 0.041 . 1 . . 31 . . 39 SER N . 50745 1
308 . 1 . 1 40 40 PHE H H 1 8.041 0.006 . 1 . . 96 . . 40 PHE H . 50745 1
309 . 1 . 1 40 40 PHE HA H 1 5.301 0.009 . 1 . . 846 . . 40 PHE HA . 50745 1
310 . 1 . 1 40 40 PHE HB2 H 1 2.512 0.013 . 1 . . 848 . . 40 PHE HB2 . 50745 1
311 . 1 . 1 40 40 PHE HB3 H 1 2.512 0.013 . 1 . . 849 . . 40 PHE HB3 . 50745 1
312 . 1 . 1 40 40 PHE C C 13 173.994 0.015 . 1 . . 302 . . 40 PHE C . 50745 1
313 . 1 . 1 40 40 PHE CA C 13 55.508 0.043 . 1 . . 303 . . 40 PHE CA . 50745 1
314 . 1 . 1 40 40 PHE CB C 13 41.684 0.038 . 1 . . 236 . . 40 PHE CB . 50745 1
315 . 1 . 1 40 40 PHE N N 15 114.494 0.044 . 1 . . 97 . . 40 PHE N . 50745 1
316 . 1 . 1 41 41 GLU H H 1 8.483 0.003 . 1 . . 121 . . 41 GLU H . 50745 1
317 . 1 . 1 41 41 GLU HA H 1 4.178 0.006 . 1 . . 876 . . 41 GLU HA . 50745 1
318 . 1 . 1 41 41 GLU HB2 H 1 1.903 0.016 . 1 . . 877 . . 41 GLU HB2 . 50745 1
319 . 1 . 1 41 41 GLU HB3 H 1 1.903 0.016 . 1 . . 878 . . 41 GLU HB3 . 50745 1
320 . 1 . 1 41 41 GLU HG2 H 1 2.168 . . 1 . . 879 . . 41 GLU HG2 . 50745 1
321 . 1 . 1 41 41 GLU HG3 H 1 2.168 . . 1 . . 880 . . 41 GLU HG3 . 50745 1
322 . 1 . 1 41 41 GLU C C 13 171.938 0.009 . 1 . . 305 . . 41 GLU C . 50745 1
323 . 1 . 1 41 41 GLU CA C 13 55.477 0.034 . 1 . . 306 . . 41 GLU CA . 50745 1
324 . 1 . 1 41 41 GLU CB C 13 33.505 0.096 . 1 . . 247 . . 41 GLU CB . 50745 1
325 . 1 . 1 41 41 GLU N N 15 121.371 0.043 . 1 . . 122 . . 41 GLU N . 50745 1
326 . 1 . 1 42 42 ALA H H 1 8.424 0.002 . 1 . . 94 . . 42 ALA H . 50745 1
327 . 1 . 1 42 42 ALA HA H 1 4.937 0.005 . 1 . . 882 . . 42 ALA HA . 50745 1
328 . 1 . 1 42 42 ALA HB1 H 1 1.017 0.013 . 1 . . 881 . . 42 ALA HB1 . 50745 1
329 . 1 . 1 42 42 ALA HB2 H 1 1.017 0.013 . 1 . . 881 . . 42 ALA HB2 . 50745 1
330 . 1 . 1 42 42 ALA HB3 H 1 1.017 0.013 . 1 . . 881 . . 42 ALA HB3 . 50745 1
331 . 1 . 1 42 42 ALA C C 13 178.875 0.033 . 1 . . 723 . . 42 ALA C . 50745 1
332 . 1 . 1 42 42 ALA CA C 13 48.544 0.042 . 1 . . 307 . . 42 ALA CA . 50745 1
333 . 1 . 1 42 42 ALA CB C 13 20.362 0.044 . 1 . . 722 . . 42 ALA CB . 50745 1
334 . 1 . 1 42 42 ALA N N 15 127.501 0.02 . 1 . . 95 . . 42 ALA N . 50745 1
335 . 1 . 1 43 43 THR H H 1 9.037 0.004 . 1 . . 701 . . 43 THR H . 50745 1
336 . 1 . 1 43 43 THR HA H 1 4.621 0.014 . 1 . . 883 . . 43 THR HA . 50745 1
337 . 1 . 1 43 43 THR HB H 1 4.621 0.014 . 1 . . 884 . . 43 THR HB . 50745 1
338 . 1 . 1 43 43 THR C C 13 174.213 . . 1 . . 724 . . 43 THR C . 50745 1
339 . 1 . 1 43 43 THR CA C 13 59.783 0.063 . 1 . . 725 . . 43 THR CA . 50745 1
340 . 1 . 1 43 43 THR CB C 13 68.206 . . 1 . . 726 . . 43 THR CB . 50745 1
341 . 1 . 1 43 43 THR N N 15 117.835 0.037 . 1 . . 702 . . 43 THR N . 50745 1
342 . 1 . 1 44 44 PRO HA H 1 4.398 . . 1 . . 885 . . 44 PRO HA . 50745 1
343 . 1 . 1 44 44 PRO HB2 H 1 2.334 . . 2 . . 887 . . 44 PRO HB2 . 50745 1
344 . 1 . 1 44 44 PRO HB3 H 1 1.986 0.0 . 2 . . 888 . . 44 PRO HB3 . 50745 1
345 . 1 . 1 44 44 PRO C C 13 177.616 0.01 . 1 . . 741 . . 44 PRO C . 50745 1
346 . 1 . 1 44 44 PRO CA C 13 64.321 0.033 . 1 . . 743 . . 44 PRO CA . 50745 1
347 . 1 . 1 44 44 PRO CB C 13 32.120 0.001 . 1 . . 742 . . 44 PRO CB . 50745 1
348 . 1 . 1 45 45 GLN H H 1 7.774 0.005 . 1 . . 705 . . 45 GLN H . 50745 1
349 . 1 . 1 45 45 GLN HA H 1 4.478 0.009 . 1 . . 886 . . 45 GLN HA . 50745 1
350 . 1 . 1 45 45 GLN HB2 H 1 1.979 0.009 . 2 . . 889 . . 45 GLN HB2 . 50745 1
351 . 1 . 1 45 45 GLN HB3 H 1 2.063 0.009 . 2 . . 890 . . 45 GLN HB3 . 50745 1
352 . 1 . 1 45 45 GLN HE21 H 1 7.502 0.002 . 1 . . 634 . . 45 GLN HE21 . 50745 1
353 . 1 . 1 45 45 GLN HE22 H 1 6.867 0.001 . 1 . . 635 . . 45 GLN HE22 . 50745 1
354 . 1 . 1 45 45 GLN C C 13 174.838 0.022 . 1 . . 734 . . 45 GLN C . 50745 1
355 . 1 . 1 45 45 GLN CA C 13 53.856 0.037 . 1 . . 736 . . 45 GLN CA . 50745 1
356 . 1 . 1 45 45 GLN CB C 13 29.937 0.073 . 1 . . 636 . . 45 GLN CB . 50745 1
357 . 1 . 1 45 45 GLN CG C 13 33.920 0.08 . 1 . . 637 . . 45 GLN CG . 50745 1
358 . 1 . 1 45 45 GLN N N 15 115.721 0.025 . 1 . . 706 . . 45 GLN N . 50745 1
359 . 1 . 1 45 45 GLN NE2 N 15 112.004 0.155 . 1 . . 633 . . 45 GLN NE2 . 50745 1
360 . 1 . 1 46 46 ALA H H 1 8.445 0.005 . 1 . . 703 . . 46 ALA H . 50745 1
361 . 1 . 1 46 46 ALA C C 13 177.446 . . 1 . . 738 . . 46 ALA C . 50745 1
362 . 1 . 1 46 46 ALA CA C 13 52.981 0.086 . 1 . . 737 . . 46 ALA CA . 50745 1
363 . 1 . 1 46 46 ALA CB C 13 17.521 . . 1 . . 739 . . 46 ALA CB . 50745 1
364 . 1 . 1 46 46 ALA N N 15 123.508 0.026 . 1 . . 704 . . 46 ALA N . 50745 1
365 . 1 . 1 47 47 THR HA H 1 4.045 . . 1 . . 891 . . 47 THR HA . 50745 1
366 . 1 . 1 47 47 THR C C 13 176.534 0.026 . 1 . . 745 . . 47 THR C . 50745 1
367 . 1 . 1 47 47 THR CA C 13 62.552 0.058 . 1 . . 746 . . 47 THR CA . 50745 1
368 . 1 . 1 48 48 GLY H H 1 9.948 0.005 . 1 . . 693 . . 48 GLY H . 50745 1
369 . 1 . 1 48 48 GLY HA2 H 1 4.192 . . 2 . . 892 . . 48 GLY HA2 . 50745 1
370 . 1 . 1 48 48 GLY HA3 H 1 3.902 . . 2 . . 893 . . 48 GLY HA3 . 50745 1
371 . 1 . 1 48 48 GLY C C 13 174.636 0.033 . 1 . . 733 . . 48 GLY C . 50745 1
372 . 1 . 1 48 48 GLY CA C 13 45.688 0.033 . 1 . . 732 . . 48 GLY CA . 50745 1
373 . 1 . 1 48 48 GLY N N 15 115.477 0.046 . 1 . . 694 . . 48 GLY N . 50745 1
374 . 1 . 1 49 49 PHE H H 1 7.554 0.004 . 1 . . 691 . . 49 PHE H . 50745 1
375 . 1 . 1 49 49 PHE HA H 1 4.710 0.017 . 1 . . 894 . . 49 PHE HA . 50745 1
376 . 1 . 1 49 49 PHE HB2 H 1 2.927 0.011 . 2 . . 895 . . 49 PHE HB2 . 50745 1
377 . 1 . 1 49 49 PHE HB3 H 1 3.467 0.006 . 2 . . 896 . . 49 PHE HB3 . 50745 1
378 . 1 . 1 49 49 PHE C C 13 176.859 0.018 . 1 . . 729 . . 49 PHE C . 50745 1
379 . 1 . 1 49 49 PHE CA C 13 55.546 0.058 . 1 . . 727 . . 49 PHE CA . 50745 1
380 . 1 . 1 49 49 PHE CB C 13 38.334 0.028 . 1 . . 728 . . 49 PHE CB . 50745 1
381 . 1 . 1 49 49 PHE N N 15 118.501 0.03 . 1 . . 692 . . 49 PHE N . 50745 1
382 . 1 . 1 50 50 PHE H H 1 9.850 0.002 . 1 . . 699 . . 50 PHE H . 50745 1
383 . 1 . 1 50 50 PHE HA H 1 4.811 0.021 . 1 . . 899 . . 50 PHE HA . 50745 1
384 . 1 . 1 50 50 PHE HB2 H 1 3.579 0.01 . 2 . . 897 . . 50 PHE HB2 . 50745 1
385 . 1 . 1 50 50 PHE HB3 H 1 3.169 . . 2 . . 898 . . 50 PHE HB3 . 50745 1
386 . 1 . 1 50 50 PHE C C 13 172.810 0.019 . 1 . . 366 . . 50 PHE C . 50745 1
387 . 1 . 1 50 50 PHE CA C 13 62.374 0.035 . 1 . . 367 . . 50 PHE CA . 50745 1
388 . 1 . 1 50 50 PHE CB C 13 38.980 0.059 . 1 . . 257 . . 50 PHE CB . 50745 1
389 . 1 . 1 50 50 PHE N N 15 121.927 0.039 . 1 . . 700 . . 50 PHE N . 50745 1
390 . 1 . 1 51 51 GLU H H 1 9.529 0.002 . 1 . . 86 . . 51 GLU H . 50745 1
391 . 1 . 1 51 51 GLU HA H 1 5.424 0.014 . 1 . . 900 . . 51 GLU HA . 50745 1
392 . 1 . 1 51 51 GLU HB2 H 1 2.377 0.019 . 1 . . 902 . . 51 GLU HB2 . 50745 1
393 . 1 . 1 51 51 GLU HB3 H 1 2.377 0.019 . 1 . . 903 . . 51 GLU HB3 . 50745 1
394 . 1 . 1 51 51 GLU C C 13 175.378 0.005 . 1 . . 359 . . 51 GLU C . 50745 1
395 . 1 . 1 51 51 GLU CA C 13 53.736 0.06 . 1 . . 360 . . 51 GLU CA . 50745 1
396 . 1 . 1 51 51 GLU CB C 13 31.965 0.078 . 1 . . 258 . . 51 GLU CB . 50745 1
397 . 1 . 1 51 51 GLU N N 15 128.767 0.037 . 1 . . 87 . . 51 GLU N . 50745 1
398 . 1 . 1 52 52 VAL H H 1 9.657 0.005 . 1 . . 36 . . 52 VAL H . 50745 1
399 . 1 . 1 52 52 VAL HA H 1 4.765 0.012 . 1 . . 901 . . 52 VAL HA . 50745 1
400 . 1 . 1 52 52 VAL HB H 1 2.352 0.01 . 1 . . 904 . . 52 VAL HB . 50745 1
401 . 1 . 1 52 52 VAL HG11 H 1 1.028 0.019 . 1 . . 905 . . 52 VAL HG11 . 50745 1
402 . 1 . 1 52 52 VAL HG12 H 1 1.028 0.019 . 1 . . 905 . . 52 VAL HG12 . 50745 1
403 . 1 . 1 52 52 VAL HG13 H 1 1.028 0.019 . 1 . . 905 . . 52 VAL HG13 . 50745 1
404 . 1 . 1 52 52 VAL HG21 H 1 1.028 0.019 . 1 . . 906 . . 52 VAL HG21 . 50745 1
405 . 1 . 1 52 52 VAL HG22 H 1 1.028 0.019 . 1 . . 906 . . 52 VAL HG22 . 50745 1
406 . 1 . 1 52 52 VAL HG23 H 1 1.028 0.019 . 1 . . 906 . . 52 VAL HG23 . 50745 1
407 . 1 . 1 52 52 VAL C C 13 174.527 0.025 . 1 . . 362 . . 52 VAL C . 50745 1
408 . 1 . 1 52 52 VAL CA C 13 61.749 0.059 . 1 . . 363 . . 52 VAL CA . 50745 1
409 . 1 . 1 52 52 VAL CB C 13 33.808 0.012 . 1 . . 243 . . 52 VAL CB . 50745 1
410 . 1 . 1 52 52 VAL N N 15 123.958 0.042 . 1 . . 37 . . 52 VAL N . 50745 1
411 . 1 . 1 53 53 GLU H H 1 9.845 0.003 . 1 . . 20 . . 53 GLU H . 50745 1
412 . 1 . 1 53 53 GLU HA H 1 5.568 0.006 . 1 . . 907 . . 53 GLU HA . 50745 1
413 . 1 . 1 53 53 GLU HB2 H 1 2.249 0.02 . 2 . . 908 . . 53 GLU HB2 . 50745 1
414 . 1 . 1 53 53 GLU HB3 H 1 1.647 0.003 . 2 . . 910 . . 53 GLU HB3 . 50745 1
415 . 1 . 1 53 53 GLU HG2 H 1 1.745 . . 1 . . 909 . . 53 GLU HG2 . 50745 1
416 . 1 . 1 53 53 GLU C C 13 176.261 0.013 . 1 . . 364 . . 53 GLU C . 50745 1
417 . 1 . 1 53 53 GLU CA C 13 54.026 0.021 . 1 . . 361 . . 53 GLU CA . 50745 1
418 . 1 . 1 53 53 GLU CB C 13 33.904 0.01 . 1 . . 231 . . 53 GLU CB . 50745 1
419 . 1 . 1 53 53 GLU N N 15 128.641 0.038 . 1 . . 21 . . 53 GLU N . 50745 1
420 . 1 . 1 54 54 VAL H H 1 8.783 0.004 . 1 . . 155 . . 54 VAL H . 50745 1
421 . 1 . 1 54 54 VAL HA H 1 4.746 0.014 . 1 . . 911 . . 54 VAL HA . 50745 1
422 . 1 . 1 54 54 VAL HB H 1 1.982 0.007 . 1 . . 913 . . 54 VAL HB . 50745 1
423 . 1 . 1 54 54 VAL HG11 H 1 0.708 . . 2 . . 914 . . 54 VAL HG11 . 50745 1
424 . 1 . 1 54 54 VAL HG12 H 1 0.708 . . 2 . . 914 . . 54 VAL HG12 . 50745 1
425 . 1 . 1 54 54 VAL HG13 H 1 0.708 . . 2 . . 914 . . 54 VAL HG13 . 50745 1
426 . 1 . 1 54 54 VAL HG21 H 1 0.916 . . 2 . . 915 . . 54 VAL HG21 . 50745 1
427 . 1 . 1 54 54 VAL HG22 H 1 0.916 . . 2 . . 915 . . 54 VAL HG22 . 50745 1
428 . 1 . 1 54 54 VAL HG23 H 1 0.916 . . 2 . . 915 . . 54 VAL HG23 . 50745 1
429 . 1 . 1 54 54 VAL C C 13 176.191 0.05 . 1 . . 365 . . 54 VAL C . 50745 1
430 . 1 . 1 54 54 VAL CA C 13 61.000 0.02 . 1 . . 536 . . 54 VAL CA . 50745 1
431 . 1 . 1 54 54 VAL CB C 13 33.666 0.052 . 1 . . 242 . . 54 VAL CB . 50745 1
432 . 1 . 1 54 54 VAL N N 15 120.860 0.022 . 1 . . 156 . . 54 VAL N . 50745 1
433 . 1 . 1 55 55 ASN H H 1 10.003 0.003 . 1 . . 80 . . 55 ASN H . 50745 1
434 . 1 . 1 55 55 ASN HA H 1 4.523 0.009 . 1 . . 916 . . 55 ASN HA . 50745 1
435 . 1 . 1 55 55 ASN HB2 H 1 3.309 0.015 . 2 . . 917 . . 55 ASN HB2 . 50745 1
436 . 1 . 1 55 55 ASN HB3 H 1 2.859 0.009 . 2 . . 922 . . 55 ASN HB3 . 50745 1
437 . 1 . 1 55 55 ASN HD21 H 1 7.834 0.0 . 1 . . 119 . . 55 ASN HD21 . 50745 1
438 . 1 . 1 55 55 ASN HD22 H 1 7.033 0.0 . 1 . . 127 . . 55 ASN HD22 . 50745 1
439 . 1 . 1 55 55 ASN C C 13 175.734 0.004 . 1 . . 446 . . 55 ASN C . 50745 1
440 . 1 . 1 55 55 ASN CA C 13 53.902 0.038 . 1 . . 448 . . 55 ASN CA . 50745 1
441 . 1 . 1 55 55 ASN CB C 13 36.661 0.057 . 1 . . 282 . . 55 ASN CB . 50745 1
442 . 1 . 1 55 55 ASN N N 15 130.574 0.034 . 1 . . 81 . . 55 ASN N . 50745 1
443 . 1 . 1 55 55 ASN ND2 N 15 110.707 0.002 . 1 . . 120 . . 55 ASN ND2 . 50745 1
444 . 1 . 1 56 56 GLY H H 1 9.092 0.005 . 1 . . 198 . . 56 GLY H . 50745 1
445 . 1 . 1 56 56 GLY HA2 H 1 3.678 0.009 . 2 . . 923 . . 56 GLY HA2 . 50745 1
446 . 1 . 1 56 56 GLY HA3 H 1 4.091 0.008 . 2 . . 924 . . 56 GLY HA3 . 50745 1
447 . 1 . 1 56 56 GLY C C 13 173.015 0.012 . 1 . . 358 . . 56 GLY C . 50745 1
448 . 1 . 1 56 56 GLY CA C 13 45.487 0.053 . 1 . . 444 . . 56 GLY CA . 50745 1
449 . 1 . 1 56 56 GLY N N 15 103.389 0.027 . 1 . . 199 . . 56 GLY N . 50745 1
450 . 1 . 1 57 57 GLU H H 1 7.800 0.002 . 1 . . 134 . . 57 GLU H . 50745 1
451 . 1 . 1 57 57 GLU HA H 1 4.517 0.007 . 1 . . 925 . . 57 GLU HA . 50745 1
452 . 1 . 1 57 57 GLU HB2 H 1 2.004 0.019 . 1 . . 926 . . 57 GLU HB2 . 50745 1
453 . 1 . 1 57 57 GLU HB3 H 1 2.004 0.019 . 1 . . 927 . . 57 GLU HB3 . 50745 1
454 . 1 . 1 57 57 GLU HG2 H 1 2.265 . . 1 . . 928 . . 57 GLU HG2 . 50745 1
455 . 1 . 1 57 57 GLU HG3 H 1 2.265 . . 1 . . 929 . . 57 GLU HG3 . 50745 1
456 . 1 . 1 57 57 GLU C C 13 175.585 0.009 . 1 . . 356 . . 57 GLU C . 50745 1
457 . 1 . 1 57 57 GLU CA C 13 54.469 0.019 . 1 . . 357 . . 57 GLU CA . 50745 1
458 . 1 . 1 57 57 GLU CB C 13 31.237 0.028 . 1 . . 270 . . 57 GLU CB . 50745 1
459 . 1 . 1 57 57 GLU N N 15 121.690 0.03 . 1 . . 135 . . 57 GLU N . 50745 1
460 . 1 . 1 58 58 LEU H H 1 8.932 0.003 . 1 . . 123 . . 58 LEU H . 50745 1
461 . 1 . 1 58 58 LEU HA H 1 4.425 0.004 . 1 . . 935 . . 58 LEU HA . 50745 1
462 . 1 . 1 58 58 LEU HB2 H 1 1.545 . . 2 . . 930 . . 58 LEU HB2 . 50745 1
463 . 1 . 1 58 58 LEU HB3 H 1 1.981 . . 2 . . 931 . . 58 LEU HB3 . 50745 1
464 . 1 . 1 58 58 LEU C C 13 176.293 0.014 . 1 . . 354 . . 58 LEU C . 50745 1
465 . 1 . 1 58 58 LEU CA C 13 56.017 0.066 . 1 . . 355 . . 58 LEU CA . 50745 1
466 . 1 . 1 58 58 LEU CB C 13 41.621 0.034 . 1 . . 275 . . 58 LEU CB . 50745 1
467 . 1 . 1 58 58 LEU N N 15 129.221 0.029 . 1 . . 124 . . 58 LEU N . 50745 1
468 . 1 . 1 59 59 VAL H H 1 9.237 0.003 . 1 . . 12 . . 59 VAL H . 50745 1
469 . 1 . 1 59 59 VAL HA H 1 4.478 0.013 . 1 . . 936 . . 59 VAL HA . 50745 1
470 . 1 . 1 59 59 VAL HB H 1 2.106 0.008 . 1 . . 932 . . 59 VAL HB . 50745 1
471 . 1 . 1 59 59 VAL HG11 H 1 1.050 0.013 . 1 . . 933 . . 59 VAL HG11 . 50745 1
472 . 1 . 1 59 59 VAL HG12 H 1 1.050 0.013 . 1 . . 933 . . 59 VAL HG12 . 50745 1
473 . 1 . 1 59 59 VAL HG13 H 1 1.050 0.013 . 1 . . 933 . . 59 VAL HG13 . 50745 1
474 . 1 . 1 59 59 VAL HG21 H 1 1.050 0.013 . 1 . . 934 . . 59 VAL HG21 . 50745 1
475 . 1 . 1 59 59 VAL HG22 H 1 1.050 0.013 . 1 . . 934 . . 59 VAL HG22 . 50745 1
476 . 1 . 1 59 59 VAL HG23 H 1 1.050 0.013 . 1 . . 934 . . 59 VAL HG23 . 50745 1
477 . 1 . 1 59 59 VAL C C 13 174.861 0.035 . 1 . . 348 . . 59 VAL C . 50745 1
478 . 1 . 1 59 59 VAL CA C 13 62.391 0.05 . 1 . . 349 . . 59 VAL CA . 50745 1
479 . 1 . 1 59 59 VAL CB C 13 33.717 0.045 . 1 . . 276 . . 59 VAL CB . 50745 1
480 . 1 . 1 59 59 VAL N N 15 126.400 0.024 . 1 . . 13 . . 59 VAL N . 50745 1
481 . 1 . 1 60 60 HIS H H 1 7.633 0.003 . 1 . . 208 . . 60 HIS H . 50745 1
482 . 1 . 1 60 60 HIS HA H 1 4.598 0.008 . 1 . . 938 . . 60 HIS HA . 50745 1
483 . 1 . 1 60 60 HIS HB2 H 1 2.942 0.001 . 1 . . 944 . . 60 HIS HB2 . 50745 1
484 . 1 . 1 60 60 HIS HB3 H 1 2.942 0.001 . 1 . . 945 . . 60 HIS HB3 . 50745 1
485 . 1 . 1 60 60 HIS C C 13 173.265 0.003 . 1 . . 350 . . 60 HIS C . 50745 1
486 . 1 . 1 60 60 HIS CA C 13 57.048 0.025 . 1 . . 351 . . 60 HIS CA . 50745 1
487 . 1 . 1 60 60 HIS CB C 13 35.201 0.027 . 1 . . 224 . . 60 HIS CB . 50745 1
488 . 1 . 1 60 60 HIS N N 15 118.917 0.029 . 1 . . 209 . . 60 HIS N . 50745 1
489 . 1 . 1 61 61 SER H H 1 8.553 0.003 . 1 . . 74 . . 61 SER H . 50745 1
490 . 1 . 1 61 61 SER HA H 1 5.132 0.01 . 1 . . 939 . . 61 SER HA . 50745 1
491 . 1 . 1 61 61 SER HB2 H 1 3.604 0.009 . 1 . . 940 . . 61 SER HB2 . 50745 1
492 . 1 . 1 61 61 SER HB3 H 1 3.604 0.009 . 1 . . 941 . . 61 SER HB3 . 50745 1
493 . 1 . 1 61 61 SER C C 13 174.740 0.027 . 1 . . 353 . . 61 SER C . 50745 1
494 . 1 . 1 61 61 SER CA C 13 55.300 0.039 . 1 . . 352 . . 61 SER CA . 50745 1
495 . 1 . 1 61 61 SER CB C 13 64.552 0.067 . 1 . . 255 . . 61 SER CB . 50745 1
496 . 1 . 1 61 61 SER N N 15 122.090 0.033 . 1 . . 75 . . 61 SER N . 50745 1
497 . 1 . 1 62 62 LYS H H 1 8.548 0.002 . 1 . . 88 . . 62 LYS H . 50745 1
498 . 1 . 1 62 62 LYS HA H 1 4.211 0.007 . 1 . . 937 . . 62 LYS HA . 50745 1
499 . 1 . 1 62 62 LYS HB2 H 1 2.109 0.012 . 1 . . 942 . . 62 LYS HB2 . 50745 1
500 . 1 . 1 62 62 LYS HB3 H 1 2.109 0.012 . 1 . . 943 . . 62 LYS HB3 . 50745 1
501 . 1 . 1 62 62 LYS C C 13 180.890 0.035 . 1 . . 310 . . 62 LYS C . 50745 1
502 . 1 . 1 62 62 LYS CA C 13 60.045 0.086 . 1 . . 311 . . 62 LYS CA . 50745 1
503 . 1 . 1 62 62 LYS CB C 13 35.584 0.057 . 1 . . 256 . . 62 LYS CB . 50745 1
504 . 1 . 1 62 62 LYS N N 15 134.753 0.034 . 1 . . 89 . . 62 LYS N . 50745 1
505 . 1 . 1 63 63 LYS H H 1 10.618 0.003 . 1 . . 707 . . 63 LYS H . 50745 1
506 . 1 . 1 63 63 LYS HA H 1 4.031 0.011 . 1 . . 949 . . 63 LYS HA . 50745 1
507 . 1 . 1 63 63 LYS HB2 H 1 1.471 0.005 . 1 . . 952 . . 63 LYS HB2 . 50745 1
508 . 1 . 1 63 63 LYS HB3 H 1 1.471 0.005 . 1 . . 953 . . 63 LYS HB3 . 50745 1
509 . 1 . 1 63 63 LYS C C 13 178.150 0.007 . 1 . . 414 . . 63 LYS C . 50745 1
510 . 1 . 1 63 63 LYS CA C 13 59.961 0.052 . 1 . . 415 . . 63 LYS CA . 50745 1
511 . 1 . 1 63 63 LYS CB C 13 32.005 0.064 . 1 . . 214 . . 63 LYS CB . 50745 1
512 . 1 . 1 63 63 LYS N N 15 126.167 0.027 . 1 . . 708 . . 63 LYS N . 50745 1
513 . 1 . 1 64 64 ASN H H 1 8.276 0.003 . 1 . . 167 . . 64 ASN H . 50745 1
514 . 1 . 1 64 64 ASN HA H 1 4.815 0.009 . 1 . . 946 . . 64 ASN HA . 50745 1
515 . 1 . 1 64 64 ASN HB2 H 1 3.059 0.012 . 2 . . 950 . . 64 ASN HB2 . 50745 1
516 . 1 . 1 64 64 ASN HB3 H 1 2.485 0.006 . 2 . . 951 . . 64 ASN HB3 . 50745 1
517 . 1 . 1 64 64 ASN HD21 H 1 7.537 0.001 . 1 . . 150 . . 64 ASN HD21 . 50745 1
518 . 1 . 1 64 64 ASN HD22 H 1 6.938 0.001 . 1 . . 599 . . 64 ASN HD22 . 50745 1
519 . 1 . 1 64 64 ASN C C 13 175.787 0.022 . 1 . . 412 . . 64 ASN C . 50745 1
520 . 1 . 1 64 64 ASN CA C 13 52.720 0.057 . 1 . . 413 . . 64 ASN CA . 50745 1
521 . 1 . 1 64 64 ASN CB C 13 38.095 0.05 . 1 . . 222 . . 64 ASN CB . 50745 1
522 . 1 . 1 64 64 ASN CG C 13 177.332 0.009 . 1 . . 754 . . 64 ASN CG . 50745 1
523 . 1 . 1 64 64 ASN N N 15 114.544 0.028 . 1 . . 168 . . 64 ASN N . 50745 1
524 . 1 . 1 64 64 ASN ND2 N 15 112.404 0.103 . 1 . . 598 . . 64 ASN ND2 . 50745 1
525 . 1 . 1 65 65 GLY H H 1 7.543 0.003 . 1 . . 181 . . 65 GLY H . 50745 1
526 . 1 . 1 65 65 GLY HA2 H 1 4.475 0.009 . 2 . . 947 . . 65 GLY HA2 . 50745 1
527 . 1 . 1 65 65 GLY HA3 H 1 3.952 0.011 . 2 . . 948 . . 65 GLY HA3 . 50745 1
528 . 1 . 1 65 65 GLY C C 13 176.192 0.011 . 1 . . 287 . . 65 GLY C . 50745 1
529 . 1 . 1 65 65 GLY CA C 13 46.103 0.025 . 1 . . 286 . . 65 GLY CA . 50745 1
530 . 1 . 1 65 65 GLY N N 15 105.873 0.032 . 1 . . 182 . . 65 GLY N . 50745 1
531 . 1 . 1 66 66 GLY H H 1 8.700 0.003 . 1 . . 157 . . 66 GLY H . 50745 1
532 . 1 . 1 66 66 GLY HA2 H 1 3.229 0.008 . 2 . . 957 . . 66 GLY HA2 . 50745 1
533 . 1 . 1 66 66 GLY HA3 H 1 4.046 0.015 . 2 . . 958 . . 66 GLY HA3 . 50745 1
534 . 1 . 1 66 66 GLY C C 13 173.843 0.028 . 1 . . 411 . . 66 GLY C . 50745 1
535 . 1 . 1 66 66 GLY CA C 13 45.739 0.038 . 1 . . 416 . . 66 GLY CA . 50745 1
536 . 1 . 1 66 66 GLY N N 15 109.415 0.037 . 1 . . 158 . . 66 GLY N . 50745 1
537 . 1 . 1 67 67 GLY H H 1 8.674 0.002 . 1 . . 173 . . 67 GLY H . 50745 1
538 . 1 . 1 67 67 GLY HA2 H 1 4.177 0.014 . 2 . . 954 . . 67 GLY HA2 . 50745 1
539 . 1 . 1 67 67 GLY HA3 H 1 3.852 0.012 . 2 . . 955 . . 67 GLY HA3 . 50745 1
540 . 1 . 1 67 67 GLY C C 13 174.027 0.029 . 1 . . 417 . . 67 GLY C . 50745 1
541 . 1 . 1 67 67 GLY CA C 13 44.654 0.07 . 1 . . 290 . . 67 GLY CA . 50745 1
542 . 1 . 1 67 67 GLY N N 15 106.985 0.033 . 1 . . 174 . . 67 GLY N . 50745 1
543 . 1 . 1 68 68 HIS H H 1 8.494 0.003 . 1 . . 34 . . 68 HIS H . 50745 1
544 . 1 . 1 68 68 HIS HA H 1 4.370 0.004 . 1 . . 956 . . 68 HIS HA . 50745 1
545 . 1 . 1 68 68 HIS HB2 H 1 2.533 0.021 . 2 . . 959 . . 68 HIS HB2 . 50745 1
546 . 1 . 1 68 68 HIS HB3 H 1 2.533 0.021 . 2 . . 960 . . 68 HIS HB3 . 50745 1
547 . 1 . 1 68 68 HIS C C 13 176.449 0.023 . 1 . . 418 . . 68 HIS C . 50745 1
548 . 1 . 1 68 68 HIS CA C 13 56.700 0.039 . 1 . . 419 . . 68 HIS CA . 50745 1
549 . 1 . 1 68 68 HIS CB C 13 33.109 0.052 . 1 . . 260 . . 68 HIS CB . 50745 1
550 . 1 . 1 68 68 HIS N N 15 117.696 0.026 . 1 . . 35 . . 68 HIS N . 50745 1
551 . 1 . 1 69 69 VAL H H 1 8.415 0.002 . 1 . . 204 . . 69 VAL H . 50745 1
552 . 1 . 1 69 69 VAL HA H 1 3.462 0.009 . 1 . . 969 . . 69 VAL HA . 50745 1
553 . 1 . 1 69 69 VAL HB H 1 1.792 0.015 . 1 . . 968 . . 69 VAL HB . 50745 1
554 . 1 . 1 69 69 VAL HG11 H 1 0.582 . . 2 . . 970 . . 69 VAL HG11 . 50745 1
555 . 1 . 1 69 69 VAL HG12 H 1 0.582 . . 2 . . 970 . . 69 VAL HG12 . 50745 1
556 . 1 . 1 69 69 VAL HG13 H 1 0.582 . . 2 . . 970 . . 69 VAL HG13 . 50745 1
557 . 1 . 1 69 69 VAL HG21 H 1 0.014 0.009 . 2 . . 971 . . 69 VAL HG21 . 50745 1
558 . 1 . 1 69 69 VAL HG22 H 1 0.014 0.009 . 2 . . 971 . . 69 VAL HG22 . 50745 1
559 . 1 . 1 69 69 VAL HG23 H 1 0.014 0.009 . 2 . . 971 . . 69 VAL HG23 . 50745 1
560 . 1 . 1 69 69 VAL C C 13 175.655 0.014 . 1 . . 334 . . 69 VAL C . 50745 1
561 . 1 . 1 69 69 VAL CA C 13 62.190 0.084 . 1 . . 333 . . 69 VAL CA . 50745 1
562 . 1 . 1 69 69 VAL CB C 13 28.136 0.017 . 1 . . 239 . . 69 VAL CB . 50745 1
563 . 1 . 1 69 69 VAL N N 15 119.192 0.033 . 1 . . 205 . . 69 VAL N . 50745 1
564 . 1 . 1 70 70 ASP H H 1 7.639 0.003 . 1 . . 62 . . 70 ASP H . 50745 1
565 . 1 . 1 70 70 ASP HA H 1 4.527 0.004 . 1 . . 965 . . 70 ASP HA . 50745 1
566 . 1 . 1 70 70 ASP HB2 H 1 2.005 0.014 . 2 . . 976 . . 70 ASP HB2 . 50745 1
567 . 1 . 1 70 70 ASP HB3 H 1 3.027 0.012 . 2 . . 977 . . 70 ASP HB3 . 50745 1
568 . 1 . 1 70 70 ASP C C 13 175.637 0.022 . 1 . . 331 . . 70 ASP C . 50745 1
569 . 1 . 1 70 70 ASP CA C 13 52.798 0.04 . 1 . . 332 . . 70 ASP CA . 50745 1
570 . 1 . 1 70 70 ASP CB C 13 40.844 0.011 . 1 . . 223 . . 70 ASP CB . 50745 1
571 . 1 . 1 70 70 ASP N N 15 122.543 0.028 . 1 . . 63 . . 70 ASP N . 50745 1
572 . 1 . 1 71 71 ASN H H 1 7.408 0.002 . 1 . . 143 . . 71 ASN H . 50745 1
573 . 1 . 1 71 71 ASN HA H 1 4.634 0.016 . 1 . . 975 . . 71 ASN HA . 50745 1
574 . 1 . 1 71 71 ASN HB2 H 1 3.148 0.008 . 2 . . 978 . . 71 ASN HB2 . 50745 1
575 . 1 . 1 71 71 ASN HB3 H 1 3.007 . . 2 . . 979 . . 71 ASN HB3 . 50745 1
576 . 1 . 1 71 71 ASN HD21 H 1 7.141 0.0 . 1 . . 146 . . 71 ASN HD21 . 50745 1
577 . 1 . 1 71 71 ASN HD22 H 1 7.409 0.001 . 1 . . 597 . . 71 ASN HD22 . 50745 1
578 . 1 . 1 71 71 ASN C C 13 175.103 0.019 . 1 . . 329 . . 71 ASN C . 50745 1
579 . 1 . 1 71 71 ASN CA C 13 52.232 0.091 . 1 . . 330 . . 71 ASN CA . 50745 1
580 . 1 . 1 71 71 ASN CB C 13 39.575 0.092 . 1 . . 219 . . 71 ASN CB . 50745 1
581 . 1 . 1 71 71 ASN N N 15 112.864 0.029 . 1 . . 3 . . 71 ASN N . 50745 1
582 . 1 . 1 71 71 ASN ND2 N 15 110.958 0.129 . 1 . . 147 . . 71 ASN ND2 . 50745 1
583 . 1 . 1 72 72 GLN H H 1 8.627 0.003 . 1 . . 206 . . 72 GLN H . 50745 1
584 . 1 . 1 72 72 GLN HA H 1 3.922 . . 1 . . 980 . . 72 GLN HA . 50745 1
585 . 1 . 1 72 72 GLN HE21 H 1 7.989 0.002 . 1 . . 52 . . 72 GLN HE21 . 50745 1
586 . 1 . 1 72 72 GLN HE22 H 1 6.736 0.001 . 1 . . 108 . . 72 GLN HE22 . 50745 1
587 . 1 . 1 72 72 GLN C C 13 177.165 0.021 . 1 . . 327 . . 72 GLN C . 50745 1
588 . 1 . 1 72 72 GLN CA C 13 58.340 0.044 . 1 . . 328 . . 72 GLN CA . 50745 1
589 . 1 . 1 72 72 GLN CB C 13 28.284 0.073 . 1 . . 229 . . 72 GLN CB . 50745 1
590 . 1 . 1 72 72 GLN CG C 13 33.164 0.048 . 1 . . 438 . . 72 GLN CG . 50745 1
591 . 1 . 1 72 72 GLN N N 15 118.998 0.047 . 1 . . 207 . . 72 GLN N . 50745 1
592 . 1 . 1 72 72 GLN NE2 N 15 112.092 0.156 . 1 . . 53 . . 72 GLN NE2 . 50745 1
593 . 1 . 1 73 73 GLU H H 1 8.371 0.003 . 1 . . 148 . . 73 GLU H . 50745 1
594 . 1 . 1 73 73 GLU HA H 1 3.984 0.006 . 1 . . 755 . . 73 GLU HA . 50745 1
595 . 1 . 1 73 73 GLU HB2 H 1 2.060 0.006 . 2 . . 756 . . 73 GLU HB2 . 50745 1
596 . 1 . 1 73 73 GLU HB3 H 1 1.745 . . 2 . . 757 . . 73 GLU HB3 . 50745 1
597 . 1 . 1 73 73 GLU HG2 H 1 2.242 . . 1 . . 981 . . 73 GLU HG2 . 50745 1
598 . 1 . 1 73 73 GLU HG3 H 1 2.242 . . 1 . . 982 . . 73 GLU HG3 . 50745 1
599 . 1 . 1 73 73 GLU C C 13 179.822 0.016 . 1 . . 326 . . 73 GLU C . 50745 1
600 . 1 . 1 73 73 GLU CA C 13 60.040 0.091 . 1 . . 325 . . 73 GLU CA . 50745 1
601 . 1 . 1 73 73 GLU CB C 13 29.031 0.039 . 1 . . 283 . . 73 GLU CB . 50745 1
602 . 1 . 1 73 73 GLU N N 15 120.936 0.029 . 1 . . 149 . . 73 GLU N . 50745 1
603 . 1 . 1 74 74 LYS H H 1 8.582 0.003 . 1 . . 10 . . 74 LYS H . 50745 1
604 . 1 . 1 74 74 LYS HA H 1 4.107 0.014 . 1 . . 758 . . 74 LYS HA . 50745 1
605 . 1 . 1 74 74 LYS HB2 H 1 1.752 0.001 . 1 . . 984 . . 74 LYS HB2 . 50745 1
606 . 1 . 1 74 74 LYS HB3 H 1 1.752 0.001 . 1 . . 985 . . 74 LYS HB3 . 50745 1
607 . 1 . 1 74 74 LYS C C 13 179.848 0.01 . 1 . . 322 . . 74 LYS C . 50745 1
608 . 1 . 1 74 74 LYS CA C 13 59.345 0.055 . 1 . . 323 . . 74 LYS CA . 50745 1
609 . 1 . 1 74 74 LYS CB C 13 35.375 0.014 . 1 . . 324 . . 74 LYS CB . 50745 1
610 . 1 . 1 74 74 LYS N N 15 118.076 0.022 . 1 . . 11 . . 74 LYS N . 50745 1
611 . 1 . 1 75 75 VAL H H 1 7.470 0.003 . 1 . . 200 . . 75 VAL H . 50745 1
612 . 1 . 1 75 75 VAL HA H 1 3.272 0.013 . 1 . . 983 . . 75 VAL HA . 50745 1
613 . 1 . 1 75 75 VAL HB H 1 1.639 0.006 . 1 . . 986 . . 75 VAL HB . 50745 1
614 . 1 . 1 75 75 VAL HG11 H 1 0.551 0.008 . 2 . . 987 . . 75 VAL HG11 . 50745 1
615 . 1 . 1 75 75 VAL HG12 H 1 0.551 0.008 . 2 . . 987 . . 75 VAL HG12 . 50745 1
616 . 1 . 1 75 75 VAL HG13 H 1 0.551 0.008 . 2 . . 987 . . 75 VAL HG13 . 50745 1
617 . 1 . 1 75 75 VAL HG21 H 1 0.268 . . 2 . . 988 . . 75 VAL HG21 . 50745 1
618 . 1 . 1 75 75 VAL HG22 H 1 0.268 . . 2 . . 988 . . 75 VAL HG22 . 50745 1
619 . 1 . 1 75 75 VAL HG23 H 1 0.268 . . 2 . . 988 . . 75 VAL HG23 . 50745 1
620 . 1 . 1 75 75 VAL C C 13 177.305 0.024 . 1 . . 320 . . 75 VAL C . 50745 1
621 . 1 . 1 75 75 VAL CA C 13 66.077 0.027 . 1 . . 321 . . 75 VAL CA . 50745 1
622 . 1 . 1 75 75 VAL CB C 13 31.454 0.068 . 1 . . 246 . . 75 VAL CB . 50745 1
623 . 1 . 1 75 75 VAL N N 15 119.209 0.029 . 1 . . 201 . . 75 VAL N . 50745 1
624 . 1 . 1 76 76 GLU H H 1 8.576 0.003 . 1 . . 171 . . 76 GLU H . 50745 1
625 . 1 . 1 76 76 GLU HA H 1 3.897 0.019 . 1 . . 989 . . 76 GLU HA . 50745 1
626 . 1 . 1 76 76 GLU HB2 H 1 2.152 0.002 . 1 . . 990 . . 76 GLU HB2 . 50745 1
627 . 1 . 1 76 76 GLU HB3 H 1 2.152 0.002 . 1 . . 991 . . 76 GLU HB3 . 50745 1
628 . 1 . 1 76 76 GLU C C 13 179.711 0.004 . 1 . . 315 . . 76 GLU C . 50745 1
629 . 1 . 1 76 76 GLU CA C 13 59.475 0.048 . 1 . . 317 . . 76 GLU CA . 50745 1
630 . 1 . 1 76 76 GLU CB C 13 28.606 0.035 . 1 . . 319 . . 76 GLU CB . 50745 1
631 . 1 . 1 76 76 GLU N N 15 119.994 0.045 . 1 . . 172 . . 76 GLU N . 50745 1
632 . 1 . 1 77 77 ARG H H 1 7.602 0.003 . 1 . . 179 . . 77 ARG H . 50745 1
633 . 1 . 1 77 77 ARG HA H 1 4.224 0.009 . 1 . . 992 . . 77 ARG HA . 50745 1
634 . 1 . 1 77 77 ARG HB2 H 1 2.011 0.005 . 2 . . 993 . . 77 ARG HB2 . 50745 1
635 . 1 . 1 77 77 ARG HB3 H 1 2.011 0.005 . 2 . . 994 . . 77 ARG HB3 . 50745 1
636 . 1 . 1 77 77 ARG C C 13 179.278 0.023 . 1 . . 314 . . 77 ARG C . 50745 1
637 . 1 . 1 77 77 ARG CA C 13 59.855 0.052 . 1 . . 318 . . 77 ARG CA . 50745 1
638 . 1 . 1 77 77 ARG CB C 13 30.332 0.066 . 1 . . 237 . . 77 ARG CB . 50745 1
639 . 1 . 1 77 77 ARG N N 15 119.729 0.027 . 1 . . 180 . . 77 ARG N . 50745 1
640 . 1 . 1 78 78 ILE H H 1 7.087 0.006 . 1 . . 183 . . 78 ILE H . 50745 1
641 . 1 . 1 78 78 ILE HA H 1 3.684 0.014 . 1 . . 995 . . 78 ILE HA . 50745 1
642 . 1 . 1 78 78 ILE HB H 1 2.105 0.012 . 1 . . 996 . . 78 ILE HB . 50745 1
643 . 1 . 1 78 78 ILE HG12 H 1 2.181 . . 1 . . 999 . . 78 ILE HG12 . 50745 1
644 . 1 . 1 78 78 ILE HG13 H 1 2.181 . . 1 . . 1000 . . 78 ILE HG13 . 50745 1
645 . 1 . 1 78 78 ILE HG21 H 1 0.961 0.004 . 1 . . 997 . . 78 ILE HG21 . 50745 1
646 . 1 . 1 78 78 ILE HG22 H 1 0.961 0.004 . 1 . . 997 . . 78 ILE HG22 . 50745 1
647 . 1 . 1 78 78 ILE HG23 H 1 0.961 0.004 . 1 . . 997 . . 78 ILE HG23 . 50745 1
648 . 1 . 1 78 78 ILE HD11 H 1 0.961 0.004 . 1 . . 998 . . 78 ILE HD11 . 50745 1
649 . 1 . 1 78 78 ILE HD12 H 1 0.961 0.004 . 1 . . 998 . . 78 ILE HD12 . 50745 1
650 . 1 . 1 78 78 ILE HD13 H 1 0.961 0.004 . 1 . . 998 . . 78 ILE HD13 . 50745 1
651 . 1 . 1 78 78 ILE C C 13 178.320 0.037 . 1 . . 313 . . 78 ILE C . 50745 1
652 . 1 . 1 78 78 ILE CA C 13 65.844 0.02 . 1 . . 316 . . 78 ILE CA . 50745 1
653 . 1 . 1 78 78 ILE CB C 13 38.131 0.053 . 1 . . 235 . . 78 ILE CB . 50745 1
654 . 1 . 1 78 78 ILE N N 15 119.736 0.025 . 1 . . 184 . . 78 ILE N . 50745 1
655 . 1 . 1 79 79 PHE H H 1 8.847 0.003 . 1 . . 4 . . 79 PHE H . 50745 1
656 . 1 . 1 79 79 PHE HA H 1 4.789 0.014 . 1 . . 1001 . . 79 PHE HA . 50745 1
657 . 1 . 1 79 79 PHE HB2 H 1 3.647 0.002 . 2 . . 1003 . . 79 PHE HB2 . 50745 1
658 . 1 . 1 79 79 PHE HB3 H 1 3.486 . . 2 . . 1004 . . 79 PHE HB3 . 50745 1
659 . 1 . 1 79 79 PHE C C 13 178.918 0.02 . 1 . . 296 . . 79 PHE C . 50745 1
660 . 1 . 1 79 79 PHE CA C 13 57.476 0.036 . 1 . . 312 . . 79 PHE CA . 50745 1
661 . 1 . 1 79 79 PHE CB C 13 37.157 0.048 . 1 . . 251 . . 79 PHE CB . 50745 1
662 . 1 . 1 79 79 PHE N N 15 118.292 0.038 . 1 . . 5 . . 79 PHE N . 50745 1
663 . 1 . 1 80 80 ALA H H 1 8.926 0.003 . 1 . . 113 . . 80 ALA H . 50745 1
664 . 1 . 1 80 80 ALA HA H 1 4.335 0.011 . 1 . . 1002 . . 80 ALA HA . 50745 1
665 . 1 . 1 80 80 ALA HB1 H 1 1.683 0.012 . 1 . . 1005 . . 80 ALA HB1 . 50745 1
666 . 1 . 1 80 80 ALA HB2 H 1 1.683 0.012 . 1 . . 1005 . . 80 ALA HB2 . 50745 1
667 . 1 . 1 80 80 ALA HB3 H 1 1.683 0.012 . 1 . . 1005 . . 80 ALA HB3 . 50745 1
668 . 1 . 1 80 80 ALA C C 13 180.892 0.027 . 1 . . 295 . . 80 ALA C . 50745 1
669 . 1 . 1 80 80 ALA CA C 13 55.406 0.047 . 1 . . 294 . . 80 ALA CA . 50745 1
670 . 1 . 1 80 80 ALA CB C 13 17.946 0.072 . 1 . . 252 . . 80 ALA CB . 50745 1
671 . 1 . 1 80 80 ALA N N 15 121.927 0.03 . 1 . . 114 . . 80 ALA N . 50745 1
672 . 1 . 1 81 81 LYS H H 1 7.462 0.003 . 1 . . 22 . . 81 LYS H . 50745 1
673 . 1 . 1 81 81 LYS HA H 1 4.277 0.005 . 1 . . 1006 . . 81 LYS HA . 50745 1
674 . 1 . 1 81 81 LYS HB2 H 1 1.808 0.011 . 2 . . 1007 . . 81 LYS HB2 . 50745 1
675 . 1 . 1 81 81 LYS HB3 H 1 2.206 0.014 . 2 . . 1012 . . 81 LYS HB3 . 50745 1
676 . 1 . 1 81 81 LYS C C 13 179.809 0.0 . 1 . . 298 . . 81 LYS C . 50745 1
677 . 1 . 1 81 81 LYS CA C 13 57.395 0.059 . 1 . . 299 . . 81 LYS CA . 50745 1
678 . 1 . 1 81 81 LYS CB C 13 31.653 0.033 . 1 . . 268 . . 81 LYS CB . 50745 1
679 . 1 . 1 81 81 LYS N N 15 117.855 0.042 . 1 . . 23 . . 81 LYS N . 50745 1
680 . 1 . 1 82 82 ILE H H 1 8.254 0.003 . 1 . . 106 . . 82 ILE H . 50745 1
681 . 1 . 1 82 82 ILE HA H 1 3.438 0.008 . 1 . . 1011 . . 82 ILE HA . 50745 1
682 . 1 . 1 82 82 ILE HB H 1 1.875 0.009 . 1 . . 1010 . . 82 ILE HB . 50745 1
683 . 1 . 1 82 82 ILE C C 13 177.053 0.04 . 1 . . 467 . . 82 ILE C . 50745 1
684 . 1 . 1 82 82 ILE CA C 13 66.065 0.037 . 1 . . 469 . . 82 ILE CA . 50745 1
685 . 1 . 1 82 82 ILE CB C 13 37.839 0.027 . 1 . . 218 . . 82 ILE CB . 50745 1
686 . 1 . 1 82 82 ILE N N 15 122.239 0.041 . 1 . . 107 . . 82 ILE N . 50745 1
687 . 1 . 1 83 83 GLY H H 1 8.980 0.003 . 1 . . 177 . . 83 GLY H . 50745 1
688 . 1 . 1 83 83 GLY HA2 H 1 3.634 0.017 . 2 . . 1008 . . 83 GLY HA2 . 50745 1
689 . 1 . 1 83 83 GLY HA3 H 1 4.162 0.013 . 2 . . 1009 . . 83 GLY HA3 . 50745 1
690 . 1 . 1 83 83 GLY C C 13 177.088 0.061 . 1 . . 466 . . 83 GLY C . 50745 1
691 . 1 . 1 83 83 GLY CA C 13 47.299 0.023 . 1 . . 289 . . 83 GLY CA . 50745 1
692 . 1 . 1 83 83 GLY N N 15 106.670 0.029 . 1 . . 178 . . 83 GLY N . 50745 1
693 . 1 . 1 84 84 GLU H H 1 8.199 0.002 . 1 . . 450 . . 84 GLU H . 50745 1
694 . 1 . 1 84 84 GLU HA H 1 4.063 0.002 . 1 . . 1016 . . 84 GLU HA . 50745 1
695 . 1 . 1 84 84 GLU HB2 H 1 2.149 0.006 . 1 . . 1014 . . 84 GLU HB2 . 50745 1
696 . 1 . 1 84 84 GLU HB3 H 1 2.149 0.006 . 1 . . 1015 . . 84 GLU HB3 . 50745 1
697 . 1 . 1 84 84 GLU C C 13 178.763 0.027 . 1 . . 459 . . 84 GLU C . 50745 1
698 . 1 . 1 84 84 GLU CA C 13 59.301 0.069 . 1 . . 451 . . 84 GLU CA . 50745 1
699 . 1 . 1 84 84 GLU CB C 13 30.158 0.046 . 1 . . 269 . . 84 GLU CB . 50745 1
700 . 1 . 1 84 84 GLU N N 15 121.881 0.008 . 1 . . 449 . . 84 GLU N . 50745 1
701 . 1 . 1 85 85 ALA H H 1 7.591 0.003 . 1 . . 92 . . 85 ALA H . 50745 1
702 . 1 . 1 85 85 ALA HA H 1 4.124 0.001 . 1 . . 1017 . . 85 ALA HA . 50745 1
703 . 1 . 1 85 85 ALA HB1 H 1 1.476 0.007 . 1 . . 1013 . . 85 ALA HB1 . 50745 1
704 . 1 . 1 85 85 ALA HB2 H 1 1.476 0.007 . 1 . . 1013 . . 85 ALA HB2 . 50745 1
705 . 1 . 1 85 85 ALA HB3 H 1 1.476 0.007 . 1 . . 1013 . . 85 ALA HB3 . 50745 1
706 . 1 . 1 85 85 ALA C C 13 179.975 0.013 . 1 . . 381 . . 85 ALA C . 50745 1
707 . 1 . 1 85 85 ALA CA C 13 54.658 0.081 . 1 . . 382 . . 85 ALA CA . 50745 1
708 . 1 . 1 85 85 ALA CB C 13 18.585 0.028 . 1 . . 277 . . 85 ALA CB . 50745 1
709 . 1 . 1 85 85 ALA N N 15 122.176 0.041 . 1 . . 93 . . 85 ALA N . 50745 1
710 . 1 . 1 86 86 LEU H H 1 8.055 0.004 . 1 . . 115 . . 86 LEU H . 50745 1
711 . 1 . 1 86 86 LEU HA H 1 4.144 0.01 . 1 . . 1020 . . 86 LEU HA . 50745 1
712 . 1 . 1 86 86 LEU HB2 H 1 1.797 0.009 . 2 . . 1022 . . 86 LEU HB2 . 50745 1
713 . 1 . 1 86 86 LEU HB3 H 1 1.459 0.002 . 2 . . 1023 . . 86 LEU HB3 . 50745 1
714 . 1 . 1 86 86 LEU C C 13 177.734 0.007 . 1 . . 378 . . 86 LEU C . 50745 1
715 . 1 . 1 86 86 LEU CA C 13 56.367 0.064 . 1 . . 379 . . 86 LEU CA . 50745 1
716 . 1 . 1 86 86 LEU CB C 13 42.788 0.096 . 1 . . 380 . . 86 LEU CB . 50745 1
717 . 1 . 1 86 86 LEU N N 15 117.988 0.028 . 1 . . 116 . . 86 LEU N . 50745 1
718 . 1 . 1 87 87 ALA H H 1 7.238 0.003 . 1 . . 165 . . 87 ALA H . 50745 1
719 . 1 . 1 87 87 ALA HA H 1 4.416 0.006 . 1 . . 1018 . . 87 ALA HA . 50745 1
720 . 1 . 1 87 87 ALA HB1 H 1 1.494 0.007 . 1 . . 1021 . . 87 ALA HB1 . 50745 1
721 . 1 . 1 87 87 ALA HB2 H 1 1.494 0.007 . 1 . . 1021 . . 87 ALA HB2 . 50745 1
722 . 1 . 1 87 87 ALA HB3 H 1 1.494 0.007 . 1 . . 1021 . . 87 ALA HB3 . 50745 1
723 . 1 . 1 87 87 ALA C C 13 176.765 0.026 . 1 . . 377 . . 87 ALA C . 50745 1
724 . 1 . 1 87 87 ALA CA C 13 52.260 0.052 . 1 . . 376 . . 87 ALA CA . 50745 1
725 . 1 . 1 87 87 ALA CB C 13 19.193 0.077 . 1 . . 227 . . 87 ALA CB . 50745 1
726 . 1 . 1 87 87 ALA N N 15 120.288 0.02 . 1 . . 166 . . 87 ALA N . 50745 1
727 . 1 . 1 88 88 LYS H H 1 7.192 0.003 . 1 . . 38 . . 88 LYS H . 50745 1
728 . 1 . 1 88 88 LYS HA H 1 4.081 0.01 . 1 . . 1019 . . 88 LYS HA . 50745 1
729 . 1 . 1 88 88 LYS C C 13 181.200 . . 1 . . 373 . . 88 LYS C . 50745 1
730 . 1 . 1 88 88 LYS CA C 13 58.317 0.019 . 1 . . 375 . . 88 LYS CA . 50745 1
731 . 1 . 1 88 88 LYS CB C 13 33.454 . . 1 . . 226 . . 88 LYS CB . 50745 1
732 . 1 . 1 88 88 LYS N N 15 124.999 0.022 . 1 . . 39 . . 88 LYS N . 50745 1
stop_
save_