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 51025
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name assigned_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
2 '3D HNCO' . . . 51025 1
3 '3D HNCA' . . . 51025 1
4 '3D HNCOCA' . . . 51025 1
5 '3D HNCACO' . . . 51025 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 . . 51025 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 H H 1 8.117766504 0.00649991349 . . . . . . . 1 MET H . 51025 1
2 . 1 . 1 1 1 MET C C 13 175.0469882 0.01904770845 . . . . . . . 1 MET C . 51025 1
3 . 1 . 1 1 1 MET CA C 13 54.68456231 0.03284120868 . . . . . . . 1 MET CA . 51025 1
4 . 1 . 1 1 1 MET N N 15 120.6928108 0.09501704801 . . . . . . . 1 MET N . 51025 1
5 . 1 . 1 2 2 ASN H H 1 8.235506673 0.003253869834 . . . . . . . 2 ASN H . 51025 1
6 . 1 . 1 2 2 ASN C C 13 174.6046052 0 . . . . . . . 2 ASN C . 51025 1
7 . 1 . 1 2 2 ASN N N 15 122.2260546 0.06499126232 . . . . . . . 2 ASN N . 51025 1
8 . 1 . 1 3 3 PRO C C 13 177.6929349 0 . . . . . . . 3 PRO C . 51025 1
9 . 1 . 1 3 3 PRO CA C 13 64.37363417 0 . . . . . . . 3 PRO CA . 51025 1
10 . 1 . 1 4 4 TYR H H 1 8.12446293 0.01601094416 . . . . . . . 4 TYR H . 51025 1
11 . 1 . 1 4 4 TYR C C 13 178.2561065 0 . . . . . . . 4 TYR C . 51025 1
12 . 1 . 1 4 4 TYR CA C 13 61.02835416 0.07784697509 . . . . . . . 4 TYR CA . 51025 1
13 . 1 . 1 4 4 TYR N N 15 116.32289 0.04340775556 . . . . . . . 4 TYR N . 51025 1
14 . 1 . 1 5 5 ILE H H 1 7.791282421 0.005430908585 . . . . . . . 5 ILE H . 51025 1
15 . 1 . 1 5 5 ILE C C 13 177.979759 0.0702805594 . . . . . . . 5 ILE C . 51025 1
16 . 1 . 1 5 5 ILE CA C 13 64.25808497 0.007233629434 . . . . . . . 5 ILE CA . 51025 1
17 . 1 . 1 5 5 ILE N N 15 120.4462412 0.06183591586 . . . . . . . 5 ILE N . 51025 1
18 . 1 . 1 6 6 TYR H H 1 6.948187597 0.005777393641 . . . . . . . 6 TYR H . 51025 1
19 . 1 . 1 6 6 TYR C C 13 177.8993206 0.01314801918 . . . . . . . 6 TYR C . 51025 1
20 . 1 . 1 6 6 TYR CA C 13 60.81494522 0.03374196186 . . . . . . . 6 TYR CA . 51025 1
21 . 1 . 1 6 6 TYR N N 15 118.8341189 0.09189801248 . . . . . . . 6 TYR N . 51025 1
22 . 1 . 1 7 7 LEU H H 1 7.668231189 0.005572210847 . . . . . . . 7 LEU H . 51025 1
23 . 1 . 1 7 7 LEU C C 13 178.5821124 0 . . . . . . . 7 LEU C . 51025 1
24 . 1 . 1 7 7 LEU CA C 13 57.22542675 0.02834664815 . . . . . . . 7 LEU CA . 51025 1
25 . 1 . 1 7 7 LEU N N 15 119.5913459 0.06730492901 . . . . . . . 7 LEU N . 51025 1
26 . 1 . 1 8 8 GLY H H 1 8.568011358 0.002889946467 . . . . . . . 8 GLY H . 51025 1
27 . 1 . 1 8 8 GLY C C 13 175.3366745 0.05139795851 . . . . . . . 8 GLY C . 51025 1
28 . 1 . 1 8 8 GLY CA C 13 47.12339688 0.009906909995 . . . . . . . 8 GLY CA . 51025 1
29 . 1 . 1 8 8 GLY N N 15 105.729403 0.07109535011 . . . . . . . 8 GLY N . 51025 1
30 . 1 . 1 9 9 GLY H H 1 8.594410643 0.008804793295 . . . . . . . 9 GLY H . 51025 1
31 . 1 . 1 9 9 GLY C C 13 173.9445498 0.02107686771 . . . . . . . 9 GLY C . 51025 1
32 . 1 . 1 9 9 GLY CA C 13 47.48833766 0.004748172033 . . . . . . . 9 GLY CA . 51025 1
33 . 1 . 1 9 9 GLY N N 15 108.8655739 0.05660976933 . . . . . . . 9 GLY N . 51025 1
34 . 1 . 1 10 10 ALA H H 1 8.680703886 0.01046509444 . . . . . . . 10 ALA H . 51025 1
35 . 1 . 1 10 10 ALA C C 13 180.9197835 0 . . . . . . . 10 ALA C . 51025 1
36 . 1 . 1 10 10 ALA CA C 13 55.42619875 0 . . . . . . . 10 ALA CA . 51025 1
37 . 1 . 1 10 10 ALA N N 15 125.8473835 0.06564088928 . . . . . . . 10 ALA N . 51025 1
38 . 1 . 1 15 15 VAL C C 13 179.2150344 0 . . . . . . . 15 VAL C . 51025 1
39 . 1 . 1 15 15 VAL CA C 13 65.49406027 0 . . . . . . . 15 VAL CA . 51025 1
40 . 1 . 1 16 16 ILE H H 1 8.901562814 0.004479975752 . . . . . . . 16 ILE H . 51025 1
41 . 1 . 1 16 16 ILE C C 13 178.2243893 0.04133404066 . . . . . . . 16 ILE C . 51025 1
42 . 1 . 1 16 16 ILE CA C 13 64.53617624 0.008525166602 . . . . . . . 16 ILE CA . 51025 1
43 . 1 . 1 16 16 ILE N N 15 122.7761375 0.06034861532 . . . . . . . 16 ILE N . 51025 1
44 . 1 . 1 17 17 GLY H H 1 8.850024525 0.006575432464 . . . . . . . 17 GLY H . 51025 1
45 . 1 . 1 17 17 GLY C C 13 174.3839985 0.06646956889 . . . . . . . 17 GLY C . 51025 1
46 . 1 . 1 17 17 GLY CA C 13 47.49281737 0 . . . . . . . 17 GLY CA . 51025 1
47 . 1 . 1 17 17 GLY N N 15 109.3476857 0.06422280769 . . . . . . . 17 GLY N . 51025 1
48 . 1 . 1 18 18 THR H H 1 8.532583025 0.004537397698 . . . . . . . 18 THR H . 51025 1
49 . 1 . 1 18 18 THR C C 13 178.3681606 0.02495449951 . . . . . . . 18 THR C . 51025 1
50 . 1 . 1 18 18 THR CA C 13 66.06621533 0.002924287682 . . . . . . . 18 THR CA . 51025 1
51 . 1 . 1 18 18 THR N N 15 118.3685842 0.07639959369 . . . . . . . 18 THR N . 51025 1
52 . 1 . 1 19 19 THR H H 1 7.644429859 0.006405928326 . . . . . . . 19 THR H . 51025 1
53 . 1 . 1 19 19 THR C C 13 177.1774807 0 . . . . . . . 19 THR C . 51025 1
54 . 1 . 1 19 19 THR CA C 13 67.09159007 0.01266398136 . . . . . . . 19 THR CA . 51025 1
55 . 1 . 1 19 19 THR N N 15 118.0531309 0.004679223612 . . . . . . . 19 THR N . 51025 1
56 . 1 . 1 20 20 LEU H H 1 8.672467106 0.005171067221 . . . . . . . 20 LEU H . 51025 1
57 . 1 . 1 20 20 LEU C C 13 178.5964643 0.09538080108 . . . . . . . 20 LEU C . 51025 1
58 . 1 . 1 20 20 LEU CA C 13 57.75086408 0.04656532662 . . . . . . . 20 LEU CA . 51025 1
59 . 1 . 1 20 20 LEU N N 15 122.1377025 0.04908625958 . . . . . . . 20 LEU N . 51025 1
60 . 1 . 1 21 21 MET H H 1 8.272997627 0.006556759898 . . . . . . . 21 MET H . 51025 1
61 . 1 . 1 21 21 MET C C 13 181.6940169 0.08989508287 . . . . . . . 21 MET C . 51025 1
62 . 1 . 1 21 21 MET CA C 13 59.25107163 0.00002362149444 . . . . . . . 21 MET CA . 51025 1
63 . 1 . 1 21 21 MET N N 15 121.699481 0.09136928433 . . . . . . . 21 MET N . 51025 1
64 . 1 . 1 22 22 LYS H H 1 7.620418879 0.003850668214 . . . . . . . 22 LYS H . 51025 1
65 . 1 . 1 22 22 LYS C C 13 178.3725835 0.05145779343 . . . . . . . 22 LYS C . 51025 1
66 . 1 . 1 22 22 LYS CA C 13 59.54541937 0.02063633901 . . . . . . . 22 LYS CA . 51025 1
67 . 1 . 1 22 22 LYS N N 15 125.1207902 0.06065746982 . . . . . . . 22 LYS N . 51025 1
68 . 1 . 1 23 23 PHE H H 1 7.489841993 0.003195346531 . . . . . . . 23 PHE H . 51025 1
69 . 1 . 1 23 23 PHE C C 13 176.1331884 0.04333969295 . . . . . . . 23 PHE C . 51025 1
70 . 1 . 1 23 23 PHE CA C 13 60.04471512 0.01275552208 . . . . . . . 23 PHE CA . 51025 1
71 . 1 . 1 23 23 PHE N N 15 119.2792788 0.0706843563 . . . . . . . 23 PHE N . 51025 1
72 . 1 . 1 24 24 SER H H 1 8.017137399 0.004028030486 . . . . . . . 24 SER H . 51025 1
73 . 1 . 1 24 24 SER C C 13 173.5217613 0 . . . . . . . 24 SER C . 51025 1
74 . 1 . 1 24 24 SER CA C 13 60.5269774 0.00003853245516 . . . . . . . 24 SER CA . 51025 1
75 . 1 . 1 24 24 SER N N 15 113.7991445 0.07328651782 . . . . . . . 24 SER N . 51025 1
76 . 1 . 1 25 25 GLU H H 1 7.726691405 0.003779194204 . . . . . . . 25 GLU H . 51025 1
77 . 1 . 1 25 25 GLU C C 13 177.8917791 0.04484136444 . . . . . . . 25 GLU C . 51025 1
78 . 1 . 1 25 25 GLU CA C 13 55.9415134 0.01273684177 . . . . . . . 25 GLU CA . 51025 1
79 . 1 . 1 25 25 GLU N N 15 121.3928672 0.0577627054 . . . . . . . 25 GLU N . 51025 1
80 . 1 . 1 26 26 GLY H H 1 9.390507834 0.003431382325 . . . . . . . 26 GLY H . 51025 1
81 . 1 . 1 26 26 GLY C C 13 174.9405241 0.0194133763 . . . . . . . 26 GLY C . 51025 1
82 . 1 . 1 26 26 GLY CA C 13 45.94696878 0.01848716738 . . . . . . . 26 GLY CA . 51025 1
83 . 1 . 1 26 26 GLY N N 15 112.2847461 0.06981029746 . . . . . . . 26 GLY N . 51025 1
84 . 1 . 1 27 27 PHE H H 1 7.919425209 0.009521947968 . . . . . . . 27 PHE H . 51025 1
85 . 1 . 1 27 27 PHE C C 13 174.1672519 0.003301221029 . . . . . . . 27 PHE C . 51025 1
86 . 1 . 1 27 27 PHE CA C 13 59.73179855 0.03393422061 . . . . . . . 27 PHE CA . 51025 1
87 . 1 . 1 27 27 PHE N N 15 113.4311859 0.1135462105 . . . . . . . 27 PHE N . 51025 1
88 . 1 . 1 28 28 THR H H 1 7.57598158 0.01464501988 . . . . . . . 28 THR H . 51025 1
89 . 1 . 1 28 28 THR C C 13 175.0720845 0 . . . . . . . 28 THR C . 51025 1
90 . 1 . 1 28 28 THR CA C 13 62.01931084 0.004824120029 . . . . . . . 28 THR CA . 51025 1
91 . 1 . 1 28 28 THR N N 15 102.7651599 0.100470326 . . . . . . . 28 THR N . 51025 1
92 . 1 . 1 29 29 ARG H H 1 7.437644131 0.006389950313 . . . . . . . 29 ARG H . 51025 1
93 . 1 . 1 29 29 ARG C C 13 178.1705467 0.05402194739 . . . . . . . 29 ARG C . 51025 1
94 . 1 . 1 29 29 ARG CA C 13 53.99173496 0.001889763713 . . . . . . . 29 ARG CA . 51025 1
95 . 1 . 1 29 29 ARG N N 15 120.0790151 0.07639557735 . . . . . . . 29 ARG N . 51025 1
96 . 1 . 1 30 30 LEU H H 1 9.099432257 0.003504394406 . . . . . . . 30 LEU H . 51025 1
97 . 1 . 1 30 30 LEU C C 13 177.3895361 0 . . . . . . . 30 LEU C . 51025 1
98 . 1 . 1 30 30 LEU CA C 13 59.9159897 0.003462092795 . . . . . . . 30 LEU CA . 51025 1
99 . 1 . 1 30 30 LEU N N 15 131.4113984 0.09740371479 . . . . . . . 30 LEU N . 51025 1
100 . 1 . 1 31 31 TRP H H 1 9.330241134 0.003138969315 . . . . . . . 31 TRP H . 51025 1
101 . 1 . 1 31 31 TRP C C 13 177.2439117 0 . . . . . . . 31 TRP C . 51025 1
102 . 1 . 1 31 31 TRP CA C 13 61.63248385 0 . . . . . . . 31 TRP CA . 51025 1
103 . 1 . 1 31 31 TRP N N 15 119.3958367 0.06037557311 . . . . . . . 31 TRP N . 51025 1
104 . 1 . 1 32 32 PRO C C 13 179.5754432 0 . . . . . . . 32 PRO C . 51025 1
105 . 1 . 1 33 33 SER H H 1 7.470017357 0.004281809501 . . . . . . . 33 SER H . 51025 1
106 . 1 . 1 33 33 SER C C 13 174.9373819 0 . . . . . . . 33 SER C . 51025 1
107 . 1 . 1 33 33 SER CA C 13 63.90970073 0.03820317888 . . . . . . . 33 SER CA . 51025 1
108 . 1 . 1 33 33 SER N N 15 116.1336337 0.07766524165 . . . . . . . 33 SER N . 51025 1
109 . 1 . 1 34 34 VAL H H 1 8.398081366 0.007144330797 . . . . . . . 34 VAL H . 51025 1
110 . 1 . 1 34 34 VAL C C 13 178.3935291 0.02760971799 . . . . . . . 34 VAL C . 51025 1
111 . 1 . 1 34 34 VAL CA C 13 66.55615049 0.03088854602 . . . . . . . 34 VAL CA . 51025 1
112 . 1 . 1 34 34 VAL N N 15 122.1646614 0.2076815069 . . . . . . . 34 VAL N . 51025 1
113 . 1 . 1 35 35 GLY H H 1 8.788665567 0.008600814811 . . . . . . . 35 GLY H . 51025 1
114 . 1 . 1 35 35 GLY C C 13 174.5143188 0.01925854684 . . . . . . . 35 GLY C . 51025 1
115 . 1 . 1 35 35 GLY CA C 13 47.76451613 0.04075151452 . . . . . . . 35 GLY CA . 51025 1
116 . 1 . 1 35 35 GLY N N 15 105.0697707 0.1103142008 . . . . . . . 35 GLY N . 51025 1
117 . 1 . 1 36 36 THR H H 1 8.278839837 0.003859712579 . . . . . . . 36 THR H . 51025 1
118 . 1 . 1 36 36 THR C C 13 175.0728104 0 . . . . . . . 36 THR C . 51025 1
119 . 1 . 1 36 36 THR CA C 13 68.40296131 0.05782842689 . . . . . . . 36 THR CA . 51025 1
120 . 1 . 1 36 36 THR N N 15 121.1536177 0.07648919053 . . . . . . . 36 THR N . 51025 1
121 . 1 . 1 37 37 ILE H H 1 7.541713718 0.00681289891 . . . . . . . 37 ILE H . 51025 1
122 . 1 . 1 37 37 ILE C C 13 178.2106684 0.002244844815 . . . . . . . 37 ILE C . 51025 1
123 . 1 . 1 37 37 ILE CA C 13 65.19934196 0.01035298226 . . . . . . . 37 ILE CA . 51025 1
124 . 1 . 1 37 37 ILE N N 15 119.4390897 0.04713774746 . . . . . . . 37 ILE N . 51025 1
125 . 1 . 1 38 38 ILE H H 1 8.293858004 0.00347107753 . . . . . . . 38 ILE H . 51025 1
126 . 1 . 1 38 38 ILE C C 13 177.8444795 0.07882947948 . . . . . . . 38 ILE C . 51025 1
127 . 1 . 1 38 38 ILE CA C 13 65.56593131 0.03693492156 . . . . . . . 38 ILE CA . 51025 1
128 . 1 . 1 38 38 ILE N N 15 118.8941963 0.04502039924 . . . . . . . 38 ILE N . 51025 1
129 . 1 . 1 39 39 CYS H H 1 8.202455328 0.005192967594 . . . . . . . 39 CYS H . 51025 1
130 . 1 . 1 39 39 CYS C C 13 177.4163234 0.05333506107 . . . . . . . 39 CYS C . 51025 1
131 . 1 . 1 39 39 CYS CA C 13 65.38950337 0.02368032362 . . . . . . . 39 CYS CA . 51025 1
132 . 1 . 1 39 39 CYS N N 15 116.7302687 0.08239030384 . . . . . . . 39 CYS N . 51025 1
133 . 1 . 1 40 40 TYR H H 1 8.521218142 0.003283145193 . . . . . . . 40 TYR H . 51025 1
134 . 1 . 1 40 40 TYR CA C 13 60.11109263 0 . . . . . . . 40 TYR CA . 51025 1
135 . 1 . 1 40 40 TYR N N 15 119.3007416 0.07154851182 . . . . . . . 40 TYR N . 51025 1
136 . 1 . 1 42 42 ALA C C 13 178.4675243 0 . . . . . . . 42 ALA C . 51025 1
137 . 1 . 1 43 43 SER H H 1 8.708133991 0.003405014089 . . . . . . . 43 SER H . 51025 1
138 . 1 . 1 43 43 SER C C 13 176.1754668 0 . . . . . . . 43 SER C . 51025 1
139 . 1 . 1 43 43 SER CA C 13 62.17415437 0.02134623438 . . . . . . . 43 SER CA . 51025 1
140 . 1 . 1 43 43 SER N N 15 113.264362 0.05744433779 . . . . . . . 43 SER N . 51025 1
141 . 1 . 1 44 44 PHE H H 1 8.108217571 0.005475987747 . . . . . . . 44 PHE H . 51025 1
142 . 1 . 1 44 44 PHE C C 13 177.2011238 0.04735512954 . . . . . . . 44 PHE C . 51025 1
143 . 1 . 1 44 44 PHE CA C 13 60.76003644 0.02232884021 . . . . . . . 44 PHE CA . 51025 1
144 . 1 . 1 44 44 PHE N N 15 117.3673899 0.09005375348 . . . . . . . 44 PHE N . 51025 1
145 . 1 . 1 45 45 TRP H H 1 8.391442859 0.009062395881 . . . . . . . 45 TRP H . 51025 1
146 . 1 . 1 45 45 TRP C C 13 178.4402879 0.06968574427 . . . . . . . 45 TRP C . 51025 1
147 . 1 . 1 45 45 TRP CA C 13 62.04294764 0.09896927289 . . . . . . . 45 TRP CA . 51025 1
148 . 1 . 1 45 45 TRP N N 15 119.9222915 0.07829572746 . . . . . . . 45 TRP N . 51025 1
149 . 1 . 1 46 46 LEU H H 1 8.924842608 0.005217497574 . . . . . . . 46 LEU H . 51025 1
150 . 1 . 1 46 46 LEU CA C 13 57.87194129 0 . . . . . . . 46 LEU CA . 51025 1
151 . 1 . 1 46 46 LEU N N 15 118.7518657 0.07784218107 . . . . . . . 46 LEU N . 51025 1
152 . 1 . 1 47 47 LEU C C 13 179.3847931 0 . . . . . . . 47 LEU C . 51025 1
153 . 1 . 1 48 48 ALA H H 1 8.120641801 0.003877084027 . . . . . . . 48 ALA H . 51025 1
154 . 1 . 1 48 48 ALA C C 13 179.7770312 0.08189407665 . . . . . . . 48 ALA C . 51025 1
155 . 1 . 1 48 48 ALA CA C 13 54.66420158 0.02381060792 . . . . . . . 48 ALA CA . 51025 1
156 . 1 . 1 48 48 ALA N N 15 121.6280094 0.03155647109 . . . . . . . 48 ALA N . 51025 1
157 . 1 . 1 49 49 GLN H H 1 7.280611719 0.004234963132 . . . . . . . 49 GLN H . 51025 1
158 . 1 . 1 49 49 GLN C C 13 178.0046431 0.05777799423 . . . . . . . 49 GLN C . 51025 1
159 . 1 . 1 49 49 GLN CA C 13 56.34699707 0 . . . . . . . 49 GLN CA . 51025 1
160 . 1 . 1 49 49 GLN N N 15 114.3124625 0.03796521986 . . . . . . . 49 GLN N . 51025 1
161 . 1 . 1 50 50 THR H H 1 7.657039281 0.005347577871 . . . . . . . 50 THR H . 51025 1
162 . 1 . 1 50 50 THR C C 13 176.8285925 0 . . . . . . . 50 THR C . 51025 1
163 . 1 . 1 50 50 THR CA C 13 65.64300162 0.008773137202 . . . . . . . 50 THR CA . 51025 1
164 . 1 . 1 50 50 THR N N 15 112.140141 0.06917188614 . . . . . . . 50 THR N . 51025 1
165 . 1 . 1 51 51 LEU H H 1 7.288675141 0.005286600363 . . . . . . . 51 LEU H . 51025 1
166 . 1 . 1 51 51 LEU C C 13 177.2832952 0 . . . . . . . 51 LEU C . 51025 1
167 . 1 . 1 51 51 LEU CA C 13 56.02485755 0.01629912374 . . . . . . . 51 LEU CA . 51025 1
168 . 1 . 1 51 51 LEU N N 15 120.1385172 0.0692637698 . . . . . . . 51 LEU N . 51025 1
169 . 1 . 1 52 52 ALA H H 1 7.216758338 0.004817408908 . . . . . . . 52 ALA H . 51025 1
170 . 1 . 1 52 52 ALA C C 13 177.5478908 0.04430294676 . . . . . . . 52 ALA C . 51025 1
171 . 1 . 1 52 52 ALA CA C 13 52.85370719 0.03193450551 . . . . . . . 52 ALA CA . 51025 1
172 . 1 . 1 52 52 ALA N N 15 119.064471 0.07406818779 . . . . . . . 52 ALA N . 51025 1
173 . 1 . 1 53 53 TYR H H 1 7.717831786 0.005505034843 . . . . . . . 53 TYR H . 51025 1
174 . 1 . 1 53 53 TYR C C 13 174.9866738 0.02747476982 . . . . . . . 53 TYR C . 51025 1
175 . 1 . 1 53 53 TYR CA C 13 58.21870051 0.009082498339 . . . . . . . 53 TYR CA . 51025 1
176 . 1 . 1 53 53 TYR N N 15 113.8648565 0.06381254019 . . . . . . . 53 TYR N . 51025 1
177 . 1 . 1 54 54 ILE H H 1 7.831627955 0.003257406833 . . . . . . . 54 ILE H . 51025 1
178 . 1 . 1 54 54 ILE C C 13 172.8718142 0 . . . . . . . 54 ILE C . 51025 1
179 . 1 . 1 54 54 ILE CA C 13 57.41355266 0 . . . . . . . 54 ILE CA . 51025 1
180 . 1 . 1 54 54 ILE N N 15 119.6941516 0.04714565696 . . . . . . . 54 ILE N . 51025 1
181 . 1 . 1 55 55 PRO C C 13 177.7166819 0 . . . . . . . 55 PRO C . 51025 1
182 . 1 . 1 55 55 PRO CA C 13 62.67870141 0 . . . . . . . 55 PRO CA . 51025 1
183 . 1 . 1 56 56 THR H H 1 8.24429876 0.005927942754 . . . . . . . 56 THR H . 51025 1
184 . 1 . 1 56 56 THR C C 13 175.7510157 0.01268861753 . . . . . . . 56 THR C . 51025 1
185 . 1 . 1 56 56 THR CA C 13 65.88310224 0.00365991974 . . . . . . . 56 THR CA . 51025 1
186 . 1 . 1 56 56 THR N N 15 118.5219668 0.06522944853 . . . . . . . 56 THR N . 51025 1
187 . 1 . 1 57 57 GLY H H 1 8.78649167 0.00396488337 . . . . . . . 57 GLY H . 51025 1
188 . 1 . 1 57 57 GLY C C 13 175.9634948 0.03050305784 . . . . . . . 57 GLY C . 51025 1
189 . 1 . 1 57 57 GLY CA C 13 47.20137392 0.01267004021 . . . . . . . 57 GLY CA . 51025 1
190 . 1 . 1 57 57 GLY N N 15 107.4310842 0.05776305942 . . . . . . . 57 GLY N . 51025 1
191 . 1 . 1 58 58 ILE H H 1 6.839903968 0.00724135597 . . . . . . . 58 ILE H . 51025 1
192 . 1 . 1 58 58 ILE C C 13 176.9061996 0.03707306556 . . . . . . . 58 ILE C . 51025 1
193 . 1 . 1 58 58 ILE CA C 13 64.18976882 0.0009826321589 . . . . . . . 58 ILE CA . 51025 1
194 . 1 . 1 58 58 ILE N N 15 119.4499375 0.06024265972 . . . . . . . 58 ILE N . 51025 1
195 . 1 . 1 59 59 ALA H H 1 7.896146385 0.003738461899 . . . . . . . 59 ALA H . 51025 1
196 . 1 . 1 59 59 ALA C C 13 179.1461816 0 . . . . . . . 59 ALA C . 51025 1
197 . 1 . 1 59 59 ALA CA C 13 55.26307806 0.01876553522 . . . . . . . 59 ALA CA . 51025 1
198 . 1 . 1 59 59 ALA N N 15 121.0362004 0.05656050465 . . . . . . . 59 ALA N . 51025 1
199 . 1 . 1 60 60 TYR H H 1 8.633288313 0.0018234181 . . . . . . . 60 TYR H . 51025 1
200 . 1 . 1 60 60 TYR CA C 13 60.17133441 0 . . . . . . . 60 TYR CA . 51025 1
201 . 1 . 1 60 60 TYR N N 15 115.0657332 0.03450392404 . . . . . . . 60 TYR N . 51025 1
202 . 1 . 1 62 62 ILE H H 1 8.021776483 0.005294882503 . . . . . . . 62 ILE H . 51025 1
203 . 1 . 1 62 62 ILE N N 15 115.7232346 0.07153940196 . . . . . . . 62 ILE N . 51025 1
204 . 1 . 1 67 67 GLY C C 13 175.0154369 0 . . . . . . . 67 GLY C . 51025 1
205 . 1 . 1 68 68 ILE H H 1 8.761120423 0.007958364054 . . . . . . . 68 ILE H . 51025 1
206 . 1 . 1 68 68 ILE C C 13 179.0467722 0.04868097469 . . . . . . . 68 ILE C . 51025 1
207 . 1 . 1 68 68 ILE CA C 13 66.27475567 0.007241374997 . . . . . . . 68 ILE CA . 51025 1
208 . 1 . 1 68 68 ILE N N 15 120.7837351 0.07753597226 . . . . . . . 68 ILE N . 51025 1
209 . 1 . 1 69 69 VAL H H 1 7.402821462 0.004366712286 . . . . . . . 69 VAL H . 51025 1
210 . 1 . 1 69 69 VAL CA C 13 66.84836931 0 . . . . . . . 69 VAL CA . 51025 1
211 . 1 . 1 69 69 VAL N N 15 119.7424575 0.06217904573 . . . . . . . 69 VAL N . 51025 1
212 . 1 . 1 70 70 LEU C C 13 179.4670044 0 . . . . . . . 70 LEU C . 51025 1
213 . 1 . 1 71 71 ILE H H 1 9.206081364 0.01270325172 . . . . . . . 71 ILE H . 51025 1
214 . 1 . 1 71 71 ILE C C 13 179.8402557 0 . . . . . . . 71 ILE C . 51025 1
215 . 1 . 1 71 71 ILE CA C 13 65.60428272 0.005862188548 . . . . . . . 71 ILE CA . 51025 1
216 . 1 . 1 71 71 ILE N N 15 119.9346486 0.09230376592 . . . . . . . 71 ILE N . 51025 1
217 . 1 . 1 72 72 SER H H 1 7.811465412 0.003363056465 . . . . . . . 72 SER H . 51025 1
218 . 1 . 1 72 72 SER C C 13 176.7621474 0 . . . . . . . 72 SER C . 51025 1
219 . 1 . 1 72 72 SER CA C 13 63.08165177 0.02239658891 . . . . . . . 72 SER CA . 51025 1
220 . 1 . 1 72 72 SER N N 15 118.5938592 0.07868642998 . . . . . . . 72 SER N . 51025 1
221 . 1 . 1 73 73 LEU H H 1 8.493502082 0.006134790822 . . . . . . . 73 LEU H . 51025 1
222 . 1 . 1 73 73 LEU C C 13 178.5194485 0.04854130349 . . . . . . . 73 LEU C . 51025 1
223 . 1 . 1 73 73 LEU CA C 13 58.16259063 0.03053403354 . . . . . . . 73 LEU CA . 51025 1
224 . 1 . 1 73 73 LEU N N 15 124.3046165 0.07967235238 . . . . . . . 73 LEU N . 51025 1
225 . 1 . 1 74 74 LEU H H 1 8.723257555 0.003176887306 . . . . . . . 74 LEU H . 51025 1
226 . 1 . 1 74 74 LEU C C 13 179.0855615 0.09311663002 . . . . . . . 74 LEU C . 51025 1
227 . 1 . 1 74 74 LEU CA C 13 58.06217046 0 . . . . . . . 74 LEU CA . 51025 1
228 . 1 . 1 74 74 LEU N N 15 119.152314 0.04958712355 . . . . . . . 74 LEU N . 51025 1
229 . 1 . 1 75 75 SER H H 1 8.247336623 0.003596130581 . . . . . . . 75 SER H . 51025 1
230 . 1 . 1 75 75 SER C C 13 177.1188007 0 . . . . . . . 75 SER C . 51025 1
231 . 1 . 1 75 75 SER CA C 13 62.81137409 0.01336217878 . . . . . . . 75 SER CA . 51025 1
232 . 1 . 1 75 75 SER N N 15 115.433822 0.05810681776 . . . . . . . 75 SER N . 51025 1
233 . 1 . 1 76 76 TRP H H 1 7.869587432 0.005086575609 . . . . . . . 76 TRP H . 51025 1
234 . 1 . 1 76 76 TRP C C 13 177.8518045 0.02533483379 . . . . . . . 76 TRP C . 51025 1
235 . 1 . 1 76 76 TRP CA C 13 59.25962112 0.004319798222 . . . . . . . 76 TRP CA . 51025 1
236 . 1 . 1 76 76 TRP N N 15 125.6531338 0.07360362947 . . . . . . . 76 TRP N . 51025 1
237 . 1 . 1 77 77 GLY H H 1 8.203447305 0.003148998291 . . . . . . . 77 GLY H . 51025 1
238 . 1 . 1 77 77 GLY C C 13 173.732972 0.0282792702 . . . . . . . 77 GLY C . 51025 1
239 . 1 . 1 77 77 GLY CA C 13 46.98898048 0.0164615914 . . . . . . . 77 GLY CA . 51025 1
240 . 1 . 1 77 77 GLY N N 15 104.3118277 0.06849015218 . . . . . . . 77 GLY N . 51025 1
241 . 1 . 1 78 78 PHE H H 1 8.492704001 0.003409312596 . . . . . . . 78 PHE H . 51025 1
242 . 1 . 1 78 78 PHE C C 13 176.7945492 0.08269001794 . . . . . . . 78 PHE C . 51025 1
243 . 1 . 1 78 78 PHE CA C 13 58.82836998 0.04320464089 . . . . . . . 78 PHE CA . 51025 1
244 . 1 . 1 78 78 PHE N N 15 114.4648839 0.06925856133 . . . . . . . 78 PHE N . 51025 1
245 . 1 . 1 79 79 PHE H H 1 6.863520755 0.006424786257 . . . . . . . 79 PHE H . 51025 1
246 . 1 . 1 79 79 PHE C C 13 176.5553872 0.01377349499 . . . . . . . 79 PHE C . 51025 1
247 . 1 . 1 79 79 PHE CA C 13 55.18723583 0.007247218079 . . . . . . . 79 PHE CA . 51025 1
248 . 1 . 1 79 79 PHE N N 15 112.3836553 0.08383790582 . . . . . . . 79 PHE N . 51025 1
249 . 1 . 1 80 80 GLY H H 1 7.514861941 0.002983988965 . . . . . . . 80 GLY H . 51025 1
250 . 1 . 1 80 80 GLY C C 13 175.0427124 0.002477220024 . . . . . . . 80 GLY C . 51025 1
251 . 1 . 1 80 80 GLY CA C 13 46.31323108 0.01111554798 . . . . . . . 80 GLY CA . 51025 1
252 . 1 . 1 80 80 GLY N N 15 109.2952436 0.06262292648 . . . . . . . 80 GLY N . 51025 1
253 . 1 . 1 81 81 GLN H H 1 7.602272943 0.006464452269 . . . . . . . 81 GLN H . 51025 1
254 . 1 . 1 81 81 GLN C C 13 174.1761125 0.0008997774401 . . . . . . . 81 GLN C . 51025 1
255 . 1 . 1 81 81 GLN CA C 13 55.41338265 0.02224778167 . . . . . . . 81 GLN CA . 51025 1
256 . 1 . 1 81 81 GLN N N 15 119.5067713 0.0726051607 . . . . . . . 81 GLN N . 51025 1
257 . 1 . 1 82 82 ARG H H 1 7.85012413 0.004640160708 . . . . . . . 82 ARG H . 51025 1
258 . 1 . 1 82 82 ARG C C 13 175.308345 0.01568353179 . . . . . . . 82 ARG C . 51025 1
259 . 1 . 1 82 82 ARG CA C 13 55.29782819 0.01680712079 . . . . . . . 82 ARG CA . 51025 1
260 . 1 . 1 82 82 ARG N N 15 126.3109008 0.05616637071 . . . . . . . 82 ARG N . 51025 1
261 . 1 . 1 83 83 LEU H H 1 6.741868011 0.00941198607 . . . . . . . 83 LEU H . 51025 1
262 . 1 . 1 83 83 LEU C C 13 174.8254829 0.0009055307125 . . . . . . . 83 LEU C . 51025 1
263 . 1 . 1 83 83 LEU CA C 13 52.89158532 0.01096014576 . . . . . . . 83 LEU CA . 51025 1
264 . 1 . 1 83 83 LEU N N 15 123.0609396 0.07829385181 . . . . . . . 83 LEU N . 51025 1
265 . 1 . 1 84 84 ASP H H 1 7.486927609 0.003569987234 . . . . . . . 84 ASP H . 51025 1
266 . 1 . 1 84 84 ASP C C 13 175.3460787 0.01028352477 . . . . . . . 84 ASP C . 51025 1
267 . 1 . 1 84 84 ASP CA C 13 50.92765775 0.01270083893 . . . . . . . 84 ASP CA . 51025 1
268 . 1 . 1 84 84 ASP N N 15 119.1786568 0.0577730521 . . . . . . . 84 ASP N . 51025 1
269 . 1 . 1 85 85 LEU H H 1 8.751418317 0.005015254279 . . . . . . . 85 LEU H . 51025 1
270 . 1 . 1 85 85 LEU C C 13 175.9176979 0 . . . . . . . 85 LEU C . 51025 1
271 . 1 . 1 85 85 LEU CA C 13 59.27318858 0 . . . . . . . 85 LEU CA . 51025 1
272 . 1 . 1 85 85 LEU N N 15 118.5498467 0.1526056918 . . . . . . . 85 LEU N . 51025 1
273 . 1 . 1 86 86 PRO C C 13 177.8982883 0 . . . . . . . 86 PRO C . 51025 1
274 . 1 . 1 86 86 PRO CA C 13 66.15346503 0 . . . . . . . 86 PRO CA . 51025 1
275 . 1 . 1 87 87 ALA H H 1 7.541463429 0.00457891162 . . . . . . . 87 ALA H . 51025 1
276 . 1 . 1 87 87 ALA C C 13 179.0236881 0.06056801726 . . . . . . . 87 ALA C . 51025 1
277 . 1 . 1 87 87 ALA CA C 13 55.35845921 0.006473789262 . . . . . . . 87 ALA CA . 51025 1
278 . 1 . 1 87 87 ALA N N 15 117.4777296 0.1343896328 . . . . . . . 87 ALA N . 51025 1
279 . 1 . 1 88 88 ILE H H 1 8.217058148 0.004130313431 . . . . . . . 88 ILE H . 51025 1
280 . 1 . 1 88 88 ILE C C 13 178.2232436 0.08618688361 . . . . . . . 88 ILE C . 51025 1
281 . 1 . 1 88 88 ILE CA C 13 65.13231744 0.01210634404 . . . . . . . 88 ILE CA . 51025 1
282 . 1 . 1 88 88 ILE N N 15 118.2766171 0.05882493921 . . . . . . . 88 ILE N . 51025 1
283 . 1 . 1 89 89 ILE H H 1 8.786420556 0.003127506062 . . . . . . . 89 ILE H . 51025 1
284 . 1 . 1 89 89 ILE C C 13 178.3450689 0.08874244601 . . . . . . . 89 ILE C . 51025 1
285 . 1 . 1 89 89 ILE CA C 13 64.2853074 0.02876634119 . . . . . . . 89 ILE CA . 51025 1
286 . 1 . 1 89 89 ILE N N 15 119.3399371 0.05093059585 . . . . . . . 89 ILE N . 51025 1
287 . 1 . 1 90 90 GLY H H 1 8.815861999 0.008111646934 . . . . . . . 90 GLY H . 51025 1
288 . 1 . 1 90 90 GLY C C 13 175.781668 0.02490300363 . . . . . . . 90 GLY C . 51025 1
289 . 1 . 1 90 90 GLY CA C 13 47.53025557 0.0384859155 . . . . . . . 90 GLY CA . 51025 1
290 . 1 . 1 90 90 GLY N N 15 107.5703417 0.05690068521 . . . . . . . 90 GLY N . 51025 1
291 . 1 . 1 91 91 MET H H 1 8.66060014 0.00447475444 . . . . . . . 91 MET H . 51025 1
292 . 1 . 1 91 91 MET C C 13 178.4234929 0.05055124201 . . . . . . . 91 MET C . 51025 1
293 . 1 . 1 91 91 MET CA C 13 59.7522207 0.01142696345 . . . . . . . 91 MET CA . 51025 1
294 . 1 . 1 91 91 MET N N 15 120.8270632 0.05980504388 . . . . . . . 91 MET N . 51025 1
295 . 1 . 1 92 92 MET H H 1 8.581435289 0.003121160849 . . . . . . . 92 MET H . 51025 1
296 . 1 . 1 92 92 MET C C 13 178.1471295 0.07118386226 . . . . . . . 92 MET C . 51025 1
297 . 1 . 1 92 92 MET CA C 13 59.19270124 0.01986630309 . . . . . . . 92 MET CA . 51025 1
298 . 1 . 1 92 92 MET N N 15 120.2161298 0.05099505075 . . . . . . . 92 MET N . 51025 1
299 . 1 . 1 93 93 LEU H H 1 8.238493946 0.003735459788 . . . . . . . 93 LEU H . 51025 1
300 . 1 . 1 93 93 LEU CA C 13 58.34417539 0 . . . . . . . 93 LEU CA . 51025 1
301 . 1 . 1 93 93 LEU N N 15 120.4742999 0.1164025561 . . . . . . . 93 LEU N . 51025 1
302 . 1 . 1 95 95 CYS C C 13 176.4022104 0 . . . . . . . 95 CYS C . 51025 1
303 . 1 . 1 96 96 ALA H H 1 8.802463474 0.002672303601 . . . . . . . 96 ALA H . 51025 1
304 . 1 . 1 96 96 ALA C C 13 179.0486162 0 . . . . . . . 96 ALA C . 51025 1
305 . 1 . 1 96 96 ALA CA C 13 54.94813403 0.02154982183 . . . . . . . 96 ALA CA . 51025 1
306 . 1 . 1 96 96 ALA N N 15 119.8491395 0.04786673066 . . . . . . . 96 ALA N . 51025 1
307 . 1 . 1 97 97 GLY H H 1 8.537674802 0.003276415916 . . . . . . . 97 GLY H . 51025 1
308 . 1 . 1 97 97 GLY C C 13 175.1355105 0.02712630635 . . . . . . . 97 GLY C . 51025 1
309 . 1 . 1 97 97 GLY CA C 13 48.39683772 0.00722143515 . . . . . . . 97 GLY CA . 51025 1
310 . 1 . 1 97 97 GLY N N 15 105.5939184 0.04884668491 . . . . . . . 97 GLY N . 51025 1
311 . 1 . 1 98 98 VAL H H 1 8.360846427 0.004321951526 . . . . . . . 98 VAL H . 51025 1
312 . 1 . 1 98 98 VAL C C 13 178.4579404 0 . . . . . . . 98 VAL C . 51025 1
313 . 1 . 1 98 98 VAL CA C 13 66.78249471 0 . . . . . . . 98 VAL CA . 51025 1
314 . 1 . 1 98 98 VAL N N 15 120.9692589 0.06676883578 . . . . . . . 98 VAL N . 51025 1
315 . 1 . 1 100 100 ILE C C 13 177.8078822 0 . . . . . . . 100 ILE C . 51025 1
316 . 1 . 1 101 101 ILE H H 1 8.002914437 0.003943529308 . . . . . . . 101 ILE H . 51025 1
317 . 1 . 1 101 101 ILE C C 13 176.7519883 0.03280274243 . . . . . . . 101 ILE C . 51025 1
318 . 1 . 1 101 101 ILE CA C 13 65.75276133 0.04530350446 . . . . . . . 101 ILE CA . 51025 1
319 . 1 . 1 101 101 ILE N N 15 118.1175063 0.0643977324 . . . . . . . 101 ILE N . 51025 1
320 . 1 . 1 102 102 ASN H H 1 7.55737215 0.004660674339 . . . . . . . 102 ASN H . 51025 1
321 . 1 . 1 102 102 ASN C C 13 175.9059709 0 . . . . . . . 102 ASN C . 51025 1
322 . 1 . 1 102 102 ASN CA C 13 56.43012898 0.01643440758 . . . . . . . 102 ASN CA . 51025 1
323 . 1 . 1 102 102 ASN N N 15 114.475051 0.1030062933 . . . . . . . 102 ASN N . 51025 1
324 . 1 . 1 103 103 LEU H H 1 8.338960964 0.004933480692 . . . . . . . 103 LEU H . 51025 1
325 . 1 . 1 103 103 LEU C C 13 177.5690885 0 . . . . . . . 103 LEU C . 51025 1
326 . 1 . 1 103 103 LEU CA C 13 55.81396656 0.03302272393 . . . . . . . 103 LEU CA . 51025 1
327 . 1 . 1 103 103 LEU N N 15 115.0185426 0.06801730648 . . . . . . . 103 LEU N . 51025 1
328 . 1 . 1 104 104 LEU H H 1 7.684363948 0.006346823058 . . . . . . . 104 LEU H . 51025 1
329 . 1 . 1 104 104 LEU C C 13 176.6647645 0.01838637328 . . . . . . . 104 LEU C . 51025 1
330 . 1 . 1 104 104 LEU CA C 13 54.3772317 0.02130390108 . . . . . . . 104 LEU CA . 51025 1
331 . 1 . 1 104 104 LEU N N 15 114.7563406 0.07626026314 . . . . . . . 104 LEU N . 51025 1
332 . 1 . 1 105 105 SER H H 1 7.135413863 0.003794230852 . . . . . . . 105 SER H . 51025 1
333 . 1 . 1 105 105 SER C C 13 175.5890141 0 . . . . . . . 105 SER C . 51025 1
334 . 1 . 1 105 105 SER CA C 13 57.52948517 0.0004893348361 . . . . . . . 105 SER CA . 51025 1
335 . 1 . 1 105 105 SER N N 15 112.3914475 0.07995443588 . . . . . . . 105 SER N . 51025 1
336 . 1 . 1 106 106 ARG H H 1 9.443596859 0.004018692273 . . . . . . . 106 ARG H . 51025 1
337 . 1 . 1 106 106 ARG C C 13 176.7060445 0.03381163517 . . . . . . . 106 ARG C . 51025 1
338 . 1 . 1 106 106 ARG CA C 13 55.53658741 0.0008580368995 . . . . . . . 106 ARG CA . 51025 1
339 . 1 . 1 106 106 ARG N N 15 127.4301856 0.06657625553 . . . . . . . 106 ARG N . 51025 1
340 . 1 . 1 107 107 SER H H 1 8.536000889 0.004888980376 . . . . . . . 107 SER H . 51025 1
341 . 1 . 1 107 107 SER C C 13 174.0308029 0 . . . . . . . 107 SER C . 51025 1
342 . 1 . 1 107 107 SER CA C 13 58.44370256 0.01438950278 . . . . . . . 107 SER CA . 51025 1
343 . 1 . 1 107 107 SER N N 15 117.424846 0.05821566603 . . . . . . . 107 SER N . 51025 1
344 . 1 . 1 108 108 THR H H 1 7.696094487 0.003509785912 . . . . . . . 108 THR H . 51025 1
345 . 1 . 1 108 108 THR C C 13 172.7861799 0 . . . . . . . 108 THR C . 51025 1
346 . 1 . 1 108 108 THR CA C 13 59.18437602 0 . . . . . . . 108 THR CA . 51025 1
347 . 1 . 1 108 108 THR N N 15 117.018364 0.07145385017 . . . . . . . 108 THR N . 51025 1
348 . 1 . 1 109 109 PRO C C 13 175.6466721 0 . . . . . . . 109 PRO C . 51025 1
349 . 1 . 1 110 110 HIS H H 1 7.857920351 0.006822564633 . . . . . . . 110 HIS H . 51025 1
350 . 1 . 1 110 110 HIS C C 13 178.7418548 0 . . . . . . . 110 HIS C . 51025 1
351 . 1 . 1 110 110 HIS N N 15 123.9192821 0.06454962215 . . . . . . . 110 HIS N . 51025 1
352 . 2 . 1 1 1 MET H H 1 8.106292057 0.00503325859 . . . . . . . 1 MET H . 51025 1
353 . 2 . 1 1 1 MET C C 13 174.8640922 0 . . . . . . . 1 MET C . 51025 1
354 . 2 . 1 1 1 MET CA C 13 54.70272482 0.01607202125 . . . . . . . 1 MET CA . 51025 1
355 . 2 . 1 1 1 MET N N 15 120.6224306 0.002101011834 . . . . . . . 1 MET N . 51025 1
356 . 2 . 1 2 2 ASN H H 1 8.388374767 0.002560515819 . . . . . . . 2 ASN H . 51025 1
357 . 2 . 1 2 2 ASN N N 15 122.6860284 0.07888977523 . . . . . . . 2 ASN N . 51025 1
358 . 2 . 1 3 3 PRO C C 13 178.0175407 0 . . . . . . . 3 PRO C . 51025 1
359 . 2 . 1 3 3 PRO CA C 13 64.20821986 0 . . . . . . . 3 PRO CA . 51025 1
360 . 2 . 1 4 4 TYR H H 1 8.334136148 0.002713402106 . . . . . . . 4 TYR H . 51025 1
361 . 2 . 1 4 4 TYR C C 13 178.3186051 0.06873677381 . . . . . . . 4 TYR C . 51025 1
362 . 2 . 1 4 4 TYR CA C 13 61.63724569 0.01314787777 . . . . . . . 4 TYR CA . 51025 1
363 . 2 . 1 4 4 TYR N N 15 116.5004353 0.0696531031 . . . . . . . 4 TYR N . 51025 1
364 . 2 . 1 5 5 ILE H H 1 7.788910424 0.01090687336 . . . . . . . 5 ILE H . 51025 1
365 . 2 . 1 5 5 ILE C C 13 177.9658181 0.06071225239 . . . . . . . 5 ILE C . 51025 1
366 . 2 . 1 5 5 ILE CA C 13 64.31989465 0.009327434797 . . . . . . . 5 ILE CA . 51025 1
367 . 2 . 1 5 5 ILE N N 15 121.1286546 0.07563723338 . . . . . . . 5 ILE N . 51025 1
368 . 2 . 1 6 6 TYR H H 1 6.835309887 0.005040629648 . . . . . . . 6 TYR H . 51025 1
369 . 2 . 1 6 6 TYR C C 13 177.9581013 0.07827136487 . . . . . . . 6 TYR C . 51025 1
370 . 2 . 1 6 6 TYR CA C 13 61.2939764 0.02023888952 . . . . . . . 6 TYR CA . 51025 1
371 . 2 . 1 6 6 TYR N N 15 118.8251868 0.09664907071 . . . . . . . 6 TYR N . 51025 1
372 . 2 . 1 7 7 LEU H H 1 7.858353981 0.006033335319 . . . . . . . 7 LEU H . 51025 1
373 . 2 . 1 7 7 LEU C C 13 178.5902813 0.0821300422 . . . . . . . 7 LEU C . 51025 1
374 . 2 . 1 7 7 LEU CA C 13 57.43797466 0.0003951809345 . . . . . . . 7 LEU CA . 51025 1
375 . 2 . 1 7 7 LEU N N 15 120.1784161 0.05144373223 . . . . . . . 7 LEU N . 51025 1
376 . 2 . 1 8 8 GLY H H 1 8.720160315 0.004846021893 . . . . . . . 8 GLY H . 51025 1
377 . 2 . 1 8 8 GLY C C 13 175.546511 0.02653703454 . . . . . . . 8 GLY C . 51025 1
378 . 2 . 1 8 8 GLY CA C 13 47.16791075 0.03017369887 . . . . . . . 8 GLY CA . 51025 1
379 . 2 . 1 8 8 GLY N N 15 106.2549105 0.08583208779 . . . . . . . 8 GLY N . 51025 1
380 . 2 . 1 9 9 GLY H H 1 8.666054422 0.004362932056 . . . . . . . 9 GLY H . 51025 1
381 . 2 . 1 9 9 GLY C C 13 174.1819753 0.03113524921 . . . . . . . 9 GLY C . 51025 1
382 . 2 . 1 9 9 GLY CA C 13 47.58022277 0.02014391097 . . . . . . . 9 GLY CA . 51025 1
383 . 2 . 1 9 9 GLY N N 15 109.331584 0.08760489883 . . . . . . . 9 GLY N . 51025 1
384 . 2 . 1 10 10 ALA H H 1 8.799647876 0.006038966008 . . . . . . . 10 ALA H . 51025 1
385 . 2 . 1 10 10 ALA C C 13 181.9979009 0.0856906888 . . . . . . . 10 ALA C . 51025 1
386 . 2 . 1 10 10 ALA CA C 13 55.32338143 0.03459080688 . . . . . . . 10 ALA CA . 51025 1
387 . 2 . 1 10 10 ALA N N 15 125.3051441 0.06629890427 . . . . . . . 10 ALA N . 51025 1
388 . 2 . 1 11 11 ILE H H 1 8.442965557 0.003752026326 . . . . . . . 11 ILE H . 51025 1
389 . 2 . 1 11 11 ILE C C 13 177.2669844 0 . . . . . . . 11 ILE C . 51025 1
390 . 2 . 1 11 11 ILE CA C 13 64.04751628 0.005378217707 . . . . . . . 11 ILE CA . 51025 1
391 . 2 . 1 11 11 ILE N N 15 122.1464407 0.069086584 . . . . . . . 11 ILE N . 51025 1
392 . 2 . 1 12 12 LEU H H 1 8.358992438 0.003555784099 . . . . . . . 12 LEU H . 51025 1
393 . 2 . 1 12 12 LEU C C 13 178.3932667 0.008071001125 . . . . . . . 12 LEU C . 51025 1
394 . 2 . 1 12 12 LEU CA C 13 58.07158012 0.008560505163 . . . . . . . 12 LEU CA . 51025 1
395 . 2 . 1 12 12 LEU N N 15 120.158249 0.07324861992 . . . . . . . 12 LEU N . 51025 1
396 . 2 . 1 13 13 ALA H H 1 8.693195994 0.006734628488 . . . . . . . 13 ALA H . 51025 1
397 . 2 . 1 13 13 ALA C C 13 179.0174901 0.009058530402 . . . . . . . 13 ALA C . 51025 1
398 . 2 . 1 13 13 ALA CA C 13 55.40502431 0.02087974666 . . . . . . . 13 ALA CA . 51025 1
399 . 2 . 1 13 13 ALA N N 15 119.1074996 0.08646910544 . . . . . . . 13 ALA N . 51025 1
400 . 2 . 1 14 14 GLU H H 1 7.875826134 0.005551382081 . . . . . . . 14 GLU H . 51025 1
401 . 2 . 1 14 14 GLU C C 13 178.3420529 0 . . . . . . . 14 GLU C . 51025 1
402 . 2 . 1 14 14 GLU CA C 13 59.72402794 0.01106324003 . . . . . . . 14 GLU CA . 51025 1
403 . 2 . 1 14 14 GLU N N 15 119.5324405 0.0653557414 . . . . . . . 14 GLU N . 51025 1
404 . 2 . 1 15 15 VAL H H 1 8.581005011 0.00875236424 . . . . . . . 15 VAL H . 51025 1
405 . 2 . 1 15 15 VAL C C 13 179.4903917 0 . . . . . . . 15 VAL C . 51025 1
406 . 2 . 1 15 15 VAL CA C 13 66.3616493 0.07063419043 . . . . . . . 15 VAL CA . 51025 1
407 . 2 . 1 15 15 VAL N N 15 121.573616 0.07874324269 . . . . . . . 15 VAL N . 51025 1
408 . 2 . 1 16 16 ILE H H 1 8.633609146 0.008294920268 . . . . . . . 16 ILE H . 51025 1
409 . 2 . 1 16 16 ILE C C 13 177.9844555 0 . . . . . . . 16 ILE C . 51025 1
410 . 2 . 1 16 16 ILE CA C 13 65.15530718 0.01384270875 . . . . . . . 16 ILE CA . 51025 1
411 . 2 . 1 16 16 ILE N N 15 122.2650056 0.06197857297 . . . . . . . 16 ILE N . 51025 1
412 . 2 . 1 17 17 GLY H H 1 8.595001137 0.004505382128 . . . . . . . 17 GLY H . 51025 1
413 . 2 . 1 17 17 GLY C C 13 174.5833634 0 . . . . . . . 17 GLY C . 51025 1
414 . 2 . 1 17 17 GLY CA C 13 47.81830356 0 . . . . . . . 17 GLY CA . 51025 1
415 . 2 . 1 17 17 GLY N N 15 108.7224661 0.09676051651 . . . . . . . 17 GLY N . 51025 1
416 . 2 . 1 19 19 THR CA C 13 67.75877252 0 . . . . . . . 19 THR CA . 51025 1
417 . 2 . 1 20 20 LEU H H 1 8.389006864 0.005911830221 . . . . . . . 20 LEU H . 51025 1
418 . 2 . 1 20 20 LEU CA C 13 57.93502097 0.05661562158 . . . . . . . 20 LEU CA . 51025 1
419 . 2 . 1 20 20 LEU N N 15 121.0456989 0.08634219776 . . . . . . . 20 LEU N . 51025 1
420 . 2 . 1 21 21 MET H H 1 8.291995281 0.001266389987 . . . . . . . 21 MET H . 51025 1
421 . 2 . 1 21 21 MET C C 13 181.3490005 0 . . . . . . . 21 MET C . 51025 1
422 . 2 . 1 21 21 MET CA C 13 59.20785125 0.0006796242771 . . . . . . . 21 MET CA . 51025 1
423 . 2 . 1 21 21 MET N N 15 121.4405997 0.05321431954 . . . . . . . 21 MET N . 51025 1
424 . 2 . 1 22 22 LYS H H 1 7.751606785 0.005494992679 . . . . . . . 22 LYS H . 51025 1
425 . 2 . 1 22 22 LYS C C 13 178.2905383 0.05277684287 . . . . . . . 22 LYS C . 51025 1
426 . 2 . 1 22 22 LYS CA C 13 58.65054625 0.003795749037 . . . . . . . 22 LYS CA . 51025 1
427 . 2 . 1 22 22 LYS N N 15 122.9413382 0.08011640715 . . . . . . . 22 LYS N . 51025 1
428 . 2 . 1 23 23 PHE H H 1 7.613751486 0.003803678478 . . . . . . . 23 PHE H . 51025 1
429 . 2 . 1 23 23 PHE C C 13 175.6357919 0.02134080017 . . . . . . . 23 PHE C . 51025 1
430 . 2 . 1 23 23 PHE CA C 13 58.70237612 0.006245837351 . . . . . . . 23 PHE CA . 51025 1
431 . 2 . 1 23 23 PHE N N 15 117.9595134 0.0571016845 . . . . . . . 23 PHE N . 51025 1
432 . 2 . 1 24 24 SER H H 1 7.930102484 0.004043131098 . . . . . . . 24 SER H . 51025 1
433 . 2 . 1 24 24 SER C C 13 173.7090033 0 . . . . . . . 24 SER C . 51025 1
434 . 2 . 1 24 24 SER CA C 13 60.09464257 0.007316559771 . . . . . . . 24 SER CA . 51025 1
435 . 2 . 1 24 24 SER N N 15 115.2068975 0.06333152788 . . . . . . . 24 SER N . 51025 1
436 . 2 . 1 25 25 GLU H H 1 8.094354524 0.003097601051 . . . . . . . 25 GLU H . 51025 1
437 . 2 . 1 25 25 GLU C C 13 178.0272347 0.04853139341 . . . . . . . 25 GLU C . 51025 1
438 . 2 . 1 25 25 GLU CA C 13 55.86498077 0.008525877004 . . . . . . . 25 GLU CA . 51025 1
439 . 2 . 1 25 25 GLU N N 15 122.1857728 0.06310299895 . . . . . . . 25 GLU N . 51025 1
440 . 2 . 1 26 26 GLY H H 1 9.173947961 0.003452493272 . . . . . . . 26 GLY H . 51025 1
441 . 2 . 1 26 26 GLY C C 13 174.5918285 0.0007134401803 . . . . . . . 26 GLY C . 51025 1
442 . 2 . 1 26 26 GLY CA C 13 46.8459675 0.00950378129 . . . . . . . 26 GLY CA . 51025 1
443 . 2 . 1 26 26 GLY N N 15 113.1358407 0.05297376515 . . . . . . . 26 GLY N . 51025 1
444 . 2 . 1 27 27 PHE H H 1 7.91925662 0.002233374101 . . . . . . . 27 PHE H . 51025 1
445 . 2 . 1 27 27 PHE C C 13 173.784076 0 . . . . . . . 27 PHE C . 51025 1
446 . 2 . 1 27 27 PHE CA C 13 58.90895203 0.003639905456 . . . . . . . 27 PHE CA . 51025 1
447 . 2 . 1 27 27 PHE N N 15 113.6690966 0.06427735644 . . . . . . . 27 PHE N . 51025 1
448 . 2 . 1 28 28 THR H H 1 7.588193911 0.006880989196 . . . . . . . 28 THR H . 51025 1
449 . 2 . 1 28 28 THR C C 13 175.4015863 0 . . . . . . . 28 THR C . 51025 1
450 . 2 . 1 28 28 THR CA C 13 62.01542348 0.008665511232 . . . . . . . 28 THR CA . 51025 1
451 . 2 . 1 28 28 THR N N 15 102.6330509 0.03175348132 . . . . . . . 28 THR N . 51025 1
452 . 2 . 1 29 29 ARG H H 1 7.590280102 0.003856827933 . . . . . . . 29 ARG H . 51025 1
453 . 2 . 1 29 29 ARG C C 13 177.8309451 0.04877079616 . . . . . . . 29 ARG C . 51025 1
454 . 2 . 1 29 29 ARG CA C 13 54.11672948 0.06064775557 . . . . . . . 29 ARG CA . 51025 1
455 . 2 . 1 29 29 ARG N N 15 120.9404931 0.0695524812 . . . . . . . 29 ARG N . 51025 1
456 . 2 . 1 30 30 LEU H H 1 8.960029777 0.003225775454 . . . . . . . 30 LEU H . 51025 1
457 . 2 . 1 30 30 LEU C C 13 177.4853852 0 . . . . . . . 30 LEU C . 51025 1
458 . 2 . 1 30 30 LEU CA C 13 59.64767225 0.001865274942 . . . . . . . 30 LEU CA . 51025 1
459 . 2 . 1 30 30 LEU N N 15 131.0995678 0.06348238945 . . . . . . . 30 LEU N . 51025 1
460 . 2 . 1 31 31 TRP H H 1 9.188185235 0.003334361476 . . . . . . . 31 TRP H . 51025 1
461 . 2 . 1 31 31 TRP C C 13 177.0818224 0 . . . . . . . 31 TRP C . 51025 1
462 . 2 . 1 31 31 TRP CA C 13 61.66654849 0 . . . . . . . 31 TRP CA . 51025 1
463 . 2 . 1 31 31 TRP N N 15 118.7913758 0.06272901995 . . . . . . . 31 TRP N . 51025 1
464 . 2 . 1 32 32 PRO C C 13 179.1018479 0 . . . . . . . 32 PRO C . 51025 1
465 . 2 . 1 32 32 PRO CA C 13 65.36805804 0 . . . . . . . 32 PRO CA . 51025 1
466 . 2 . 1 33 33 SER H H 1 7.293183357 0.003351525641 . . . . . . . 33 SER H . 51025 1
467 . 2 . 1 33 33 SER C C 13 175.137106 0 . . . . . . . 33 SER C . 51025 1
468 . 2 . 1 33 33 SER CA C 13 63.54570092 0.007964475692 . . . . . . . 33 SER CA . 51025 1
469 . 2 . 1 33 33 SER N N 15 115.5688672 0.06889405112 . . . . . . . 33 SER N . 51025 1
470 . 2 . 1 34 34 VAL H H 1 8.397320411 0.004643774925 . . . . . . . 34 VAL H . 51025 1
471 . 2 . 1 34 34 VAL C C 13 178.4316968 0.09403112006 . . . . . . . 34 VAL C . 51025 1
472 . 2 . 1 34 34 VAL CA C 13 66.45167884 0.0127800284 . . . . . . . 34 VAL CA . 51025 1
473 . 2 . 1 34 34 VAL N N 15 121.9338605 0.04427454034 . . . . . . . 34 VAL N . 51025 1
474 . 2 . 1 35 35 GLY H H 1 8.784593866 0.004265677813 . . . . . . . 35 GLY H . 51025 1
475 . 2 . 1 35 35 GLY C C 13 174.6343351 0.01501021693 . . . . . . . 35 GLY C . 51025 1
476 . 2 . 1 35 35 GLY CA C 13 47.76602126 0.02451749938 . . . . . . . 35 GLY CA . 51025 1
477 . 2 . 1 35 35 GLY N N 15 105.4377395 0.1304757605 . . . . . . . 35 GLY N . 51025 1
478 . 2 . 1 36 36 THR H H 1 8.319103617 0.004659509382 . . . . . . . 36 THR H . 51025 1
479 . 2 . 1 36 36 THR C C 13 175.2527084 0 . . . . . . . 36 THR C . 51025 1
480 . 2 . 1 36 36 THR CA C 13 68.58627625 0.004006541757 . . . . . . . 36 THR CA . 51025 1
481 . 2 . 1 36 36 THR N N 15 121.2610395 0.06734195495 . . . . . . . 36 THR N . 51025 1
482 . 2 . 1 37 37 ILE H H 1 7.485453432 0.01269601121 . . . . . . . 37 ILE H . 51025 1
483 . 2 . 1 37 37 ILE C C 13 178.2987901 0.04333307433 . . . . . . . 37 ILE C . 51025 1
484 . 2 . 1 37 37 ILE CA C 13 65.01655453 0.01756874724 . . . . . . . 37 ILE CA . 51025 1
485 . 2 . 1 37 37 ILE N N 15 119.304524 0.05810590962 . . . . . . . 37 ILE N . 51025 1
486 . 2 . 1 38 38 ILE H H 1 8.365442521 0.005011208681 . . . . . . . 38 ILE H . 51025 1
487 . 2 . 1 38 38 ILE C C 13 177.710827 0.05382211927 . . . . . . . 38 ILE C . 51025 1
488 . 2 . 1 38 38 ILE CA C 13 65.58961652 0.005315858059 . . . . . . . 38 ILE CA . 51025 1
489 . 2 . 1 38 38 ILE N N 15 119.4647339 0.05364928305 . . . . . . . 38 ILE N . 51025 1
490 . 2 . 1 39 39 CYS H H 1 8.261771704 0.005625792019 . . . . . . . 39 CYS H . 51025 1
491 . 2 . 1 39 39 CYS C C 13 177.6134756 0.004809227059 . . . . . . . 39 CYS C . 51025 1
492 . 2 . 1 39 39 CYS CA C 13 65.20118011 0.01927178614 . . . . . . . 39 CYS CA . 51025 1
493 . 2 . 1 39 39 CYS N N 15 116.9379339 0.07121882584 . . . . . . . 39 CYS N . 51025 1
494 . 2 . 1 40 40 TYR H H 1 8.586713827 0.005178141618 . . . . . . . 40 TYR H . 51025 1
495 . 2 . 1 40 40 TYR C C 13 178.2936746 0 . . . . . . . 40 TYR C . 51025 1
496 . 2 . 1 40 40 TYR CA C 13 59.52092964 0.0823619719 . . . . . . . 40 TYR CA . 51025 1
497 . 2 . 1 40 40 TYR N N 15 119.1791332 0.05227088653 . . . . . . . 40 TYR N . 51025 1
498 . 2 . 1 41 41 CYS H H 1 8.548439722 0.006770926855 . . . . . . . 41 CYS H . 51025 1
499 . 2 . 1 41 41 CYS C C 13 176.4722256 0.04709167924 . . . . . . . 41 CYS C . 51025 1
500 . 2 . 1 41 41 CYS CA C 13 64.80302021 0.001100107038 . . . . . . . 41 CYS CA . 51025 1
501 . 2 . 1 41 41 CYS N N 15 118.0374332 0.1118036841 . . . . . . . 41 CYS N . 51025 1
502 . 2 . 1 42 42 ALA H H 1 8.334173239 0.004306410016 . . . . . . . 42 ALA H . 51025 1
503 . 2 . 1 42 42 ALA C C 13 178.4492845 0.08479033888 . . . . . . . 42 ALA C . 51025 1
504 . 2 . 1 42 42 ALA CA C 13 54.93572036 0.01750504476 . . . . . . . 42 ALA CA . 51025 1
505 . 2 . 1 42 42 ALA N N 15 120.0994243 0.05909292629 . . . . . . . 42 ALA N . 51025 1
506 . 2 . 1 43 43 SER H H 1 8.483538604 0.003473411345 . . . . . . . 43 SER H . 51025 1
507 . 2 . 1 43 43 SER C C 13 176.6392447 0 . . . . . . . 43 SER C . 51025 1
508 . 2 . 1 43 43 SER CA C 13 62.75313168 0.05806298632 . . . . . . . 43 SER CA . 51025 1
509 . 2 . 1 43 43 SER N N 15 112.520886 0.08698405639 . . . . . . . 43 SER N . 51025 1
510 . 2 . 1 44 44 PHE H H 1 8.148633244 0.004493488506 . . . . . . . 44 PHE H . 51025 1
511 . 2 . 1 44 44 PHE C C 13 177.9225105 0 . . . . . . . 44 PHE C . 51025 1
512 . 2 . 1 44 44 PHE CA C 13 60.73624431 0.0001346775885 . . . . . . . 44 PHE CA . 51025 1
513 . 2 . 1 44 44 PHE N N 15 116.3276039 0.082027546 . . . . . . . 44 PHE N . 51025 1
514 . 2 . 1 45 45 TRP H H 1 8.43250205 0.003134349076 . . . . . . . 45 TRP H . 51025 1
515 . 2 . 1 45 45 TRP C C 13 178.7870113 0.02178884344 . . . . . . . 45 TRP C . 51025 1
516 . 2 . 1 45 45 TRP CA C 13 63.12245872 0.03364963033 . . . . . . . 45 TRP CA . 51025 1
517 . 2 . 1 45 45 TRP N N 15 120.8818866 0.1038923342 . . . . . . . 45 TRP N . 51025 1
518 . 2 . 1 46 46 LEU H H 1 8.683794442 0.003258290305 . . . . . . . 46 LEU H . 51025 1
519 . 2 . 1 46 46 LEU C C 13 179.3672633 0 . . . . . . . 46 LEU C . 51025 1
520 . 2 . 1 46 46 LEU CA C 13 58.09474379 0.03861548683 . . . . . . . 46 LEU CA . 51025 1
521 . 2 . 1 46 46 LEU N N 15 119.1046446 0.05196768494 . . . . . . . 46 LEU N . 51025 1
522 . 2 . 1 47 47 LEU H H 1 8.647366137 0.001986201023 . . . . . . . 47 LEU H . 51025 1
523 . 2 . 1 47 47 LEU C C 13 180.2404388 0 . . . . . . . 47 LEU C . 51025 1
524 . 2 . 1 47 47 LEU CA C 13 57.06707105 0.02106335129 . . . . . . . 47 LEU CA . 51025 1
525 . 2 . 1 47 47 LEU N N 15 121.7837538 0.01974161078 . . . . . . . 47 LEU N . 51025 1
526 . 2 . 1 48 48 ALA H H 1 8.725966265 0.009660661754 . . . . . . . 48 ALA H . 51025 1
527 . 2 . 1 48 48 ALA C C 13 180.7070115 0.01528796078 . . . . . . . 48 ALA C . 51025 1
528 . 2 . 1 48 48 ALA CA C 13 54.7820863 0.007946699585 . . . . . . . 48 ALA CA . 51025 1
529 . 2 . 1 48 48 ALA N N 15 121.2106255 0.1021354654 . . . . . . . 48 ALA N . 51025 1
530 . 2 . 1 49 49 GLN H H 1 7.315991188 0.005283348312 . . . . . . . 49 GLN H . 51025 1
531 . 2 . 1 49 49 GLN C C 13 177.6461745 0 . . . . . . . 49 GLN C . 51025 1
532 . 2 . 1 49 49 GLN CA C 13 55.87358685 0 . . . . . . . 49 GLN CA . 51025 1
533 . 2 . 1 49 49 GLN N N 15 114.9413566 0.09417764788 . . . . . . . 49 GLN N . 51025 1
534 . 2 . 1 50 50 THR C C 13 177.1729701 0 . . . . . . . 50 THR C . 51025 1
535 . 2 . 1 51 51 LEU H H 1 6.872594349 0.004746717663 . . . . . . . 51 LEU H . 51025 1
536 . 2 . 1 51 51 LEU C C 13 176.7785325 0.04988297 . . . . . . . 51 LEU C . 51025 1
537 . 2 . 1 51 51 LEU CA C 13 55.51380873 0.001542684574 . . . . . . . 51 LEU CA . 51025 1
538 . 2 . 1 51 51 LEU N N 15 118.0321415 0.04736426963 . . . . . . . 51 LEU N . 51025 1
539 . 2 . 1 52 52 ALA H H 1 7.047336152 0.005561959758 . . . . . . . 52 ALA H . 51025 1
540 . 2 . 1 52 52 ALA C C 13 177.2185741 0.03766269683 . . . . . . . 52 ALA C . 51025 1
541 . 2 . 1 52 52 ALA CA C 13 52.77648411 0.01757304783 . . . . . . . 52 ALA CA . 51025 1
542 . 2 . 1 52 52 ALA N N 15 120.2563715 0.08654930198 . . . . . . . 52 ALA N . 51025 1
543 . 2 . 1 53 53 TYR H H 1 7.544409963 0.005745188335 . . . . . . . 53 TYR H . 51025 1
544 . 2 . 1 53 53 TYR C C 13 174.4989483 0.001343886499 . . . . . . . 53 TYR C . 51025 1
545 . 2 . 1 53 53 TYR CA C 13 57.89672009 0.01938571627 . . . . . . . 53 TYR CA . 51025 1
546 . 2 . 1 53 53 TYR N N 15 113.2702438 0.09358110204 . . . . . . . 53 TYR N . 51025 1
547 . 2 . 1 54 54 ILE H H 1 7.809619101 0.003051885984 . . . . . . . 54 ILE H . 51025 1
548 . 2 . 1 54 54 ILE C C 13 173.341532 0 . . . . . . . 54 ILE C . 51025 1
549 . 2 . 1 54 54 ILE CA C 13 57.37109584 0 . . . . . . . 54 ILE CA . 51025 1
550 . 2 . 1 54 54 ILE N N 15 119.4328464 0.04396230283 . . . . . . . 54 ILE N . 51025 1
551 . 2 . 1 55 55 PRO C C 13 176.9649444 0 . . . . . . . 55 PRO C . 51025 1
552 . 2 . 1 55 55 PRO CA C 13 63.06913902 0 . . . . . . . 55 PRO CA . 51025 1
553 . 2 . 1 56 56 THR H H 1 9.088330426 0.00827640042 . . . . . . . 56 THR H . 51025 1
554 . 2 . 1 56 56 THR C C 13 176.1070474 0 . . . . . . . 56 THR C . 51025 1
555 . 2 . 1 56 56 THR CA C 13 66.7809921 0.007797810409 . . . . . . . 56 THR CA . 51025 1
556 . 2 . 1 56 56 THR N N 15 123.9894023 0.04635139443 . . . . . . . 56 THR N . 51025 1
557 . 2 . 1 57 57 GLY H H 1 9.996684816 0.004510585285 . . . . . . . 57 GLY H . 51025 1
558 . 2 . 1 57 57 GLY C C 13 175.2387401 0.05299841634 . . . . . . . 57 GLY C . 51025 1
559 . 2 . 1 57 57 GLY CA C 13 46.82068445 0.004179755108 . . . . . . . 57 GLY CA . 51025 1
560 . 2 . 1 57 57 GLY N N 15 106.945556 0.09870504728 . . . . . . . 57 GLY N . 51025 1
561 . 2 . 1 58 58 ILE H H 1 6.49576776 0.003049866511 . . . . . . . 58 ILE H . 51025 1
562 . 2 . 1 58 58 ILE C C 13 176.7610999 0.02375379067 . . . . . . . 58 ILE C . 51025 1
563 . 2 . 1 58 58 ILE CA C 13 63.85653714 0.01201472819 . . . . . . . 58 ILE CA . 51025 1
564 . 2 . 1 58 58 ILE N N 15 118.1682352 0.05076668122 . . . . . . . 58 ILE N . 51025 1
565 . 2 . 1 59 59 ALA H H 1 8.293429808 0.002230359678 . . . . . . . 59 ALA H . 51025 1
566 . 2 . 1 59 59 ALA C C 13 178.5688774 0.08105055165 . . . . . . . 59 ALA C . 51025 1
567 . 2 . 1 59 59 ALA CA C 13 55.41325859 0.006828495874 . . . . . . . 59 ALA CA . 51025 1
568 . 2 . 1 59 59 ALA N N 15 122.0095822 0.07626540929 . . . . . . . 59 ALA N . 51025 1
569 . 2 . 1 60 60 TYR H H 1 8.419090517 0.006004861875 . . . . . . . 60 TYR H . 51025 1
570 . 2 . 1 60 60 TYR C C 13 176.6574119 0.005172562104 . . . . . . . 60 TYR C . 51025 1
571 . 2 . 1 60 60 TYR CA C 13 62.26638181 0.001946037932 . . . . . . . 60 TYR CA . 51025 1
572 . 2 . 1 60 60 TYR N N 15 116.0160081 0.09468610323 . . . . . . . 60 TYR N . 51025 1
573 . 2 . 1 61 61 ALA H H 1 8.117394927 0.003146254415 . . . . . . . 61 ALA H . 51025 1
574 . 2 . 1 61 61 ALA C C 13 179.7513226 0.06032934931 . . . . . . . 61 ALA C . 51025 1
575 . 2 . 1 61 61 ALA CA C 13 55.17327314 0.03340317211 . . . . . . . 61 ALA CA . 51025 1
576 . 2 . 1 61 61 ALA N N 15 118.6765284 0.06028994435 . . . . . . . 61 ALA N . 51025 1
577 . 2 . 1 62 62 ILE H H 1 8.541723204 0.003412202523 . . . . . . . 62 ILE H . 51025 1
578 . 2 . 1 62 62 ILE C C 13 176.7667575 0.02612464042 . . . . . . . 62 ILE C . 51025 1
579 . 2 . 1 62 62 ILE CA C 13 65.92203811 0.00186401421 . . . . . . . 62 ILE CA . 51025 1
580 . 2 . 1 62 62 ILE N N 15 117.067119 0.04350756918 . . . . . . . 62 ILE N . 51025 1
581 . 2 . 1 63 63 TRP H H 1 8.425923954 0.003586433996 . . . . . . . 63 TRP H . 51025 1
582 . 2 . 1 63 63 TRP C C 13 178.3278458 0 . . . . . . . 63 TRP C . 51025 1
583 . 2 . 1 63 63 TRP CA C 13 60.1462311 0 . . . . . . . 63 TRP CA . 51025 1
584 . 2 . 1 63 63 TRP N N 15 122.2022767 0.08286867471 . . . . . . . 63 TRP N . 51025 1
585 . 2 . 1 65 65 GLY C C 13 175.0714375 0 . . . . . . . 65 GLY C . 51025 1
586 . 2 . 1 65 65 GLY CA C 13 47.13417925 0 . . . . . . . 65 GLY CA . 51025 1
587 . 2 . 1 66 66 VAL H H 1 9.10021301 0.00478556872 . . . . . . . 66 VAL H . 51025 1
588 . 2 . 1 66 66 VAL C C 13 177.979673 0 . . . . . . . 66 VAL C . 51025 1
589 . 2 . 1 66 66 VAL CA C 13 66.20419791 0 . . . . . . . 66 VAL CA . 51025 1
590 . 2 . 1 66 66 VAL N N 15 120.4432513 0.1464563163 . . . . . . . 66 VAL N . 51025 1
591 . 2 . 1 67 67 GLY H H 1 7.267157339 0.01066664698 . . . . . . . 67 GLY H . 51025 1
592 . 2 . 1 67 67 GLY CA C 13 47.654013 0 . . . . . . . 67 GLY CA . 51025 1
593 . 2 . 1 67 67 GLY N N 15 107.2124965 0.03421705959 . . . . . . . 67 GLY N . 51025 1
594 . 2 . 1 68 68 ILE C C 13 178.8958206 0 . . . . . . . 68 ILE C . 51025 1
595 . 2 . 1 68 68 ILE CA C 13 64.32507454 0 . . . . . . . 68 ILE CA . 51025 1
596 . 2 . 1 69 69 VAL H H 1 7.710445727 0.007472402073 . . . . . . . 69 VAL H . 51025 1
597 . 2 . 1 69 69 VAL CA C 13 66.91570856 0 . . . . . . . 69 VAL CA . 51025 1
598 . 2 . 1 69 69 VAL N N 15 122.8542328 0.07830286142 . . . . . . . 69 VAL N . 51025 1
599 . 2 . 1 70 70 LEU C C 13 179.1115654 0 . . . . . . . 70 LEU C . 51025 1
600 . 2 . 1 71 71 ILE H H 1 8.637890482 0.004111904673 . . . . . . . 71 ILE H . 51025 1
601 . 2 . 1 71 71 ILE C C 13 178.7516274 0.05364096185 . . . . . . . 71 ILE C . 51025 1
602 . 2 . 1 71 71 ILE CA C 13 64.23845373 0.004817836923 . . . . . . . 71 ILE CA . 51025 1
603 . 2 . 1 71 71 ILE N N 15 119.3052419 0.05932701032 . . . . . . . 71 ILE N . 51025 1
604 . 2 . 1 72 72 SER H H 1 8.042123348 0.008462186793 . . . . . . . 72 SER H . 51025 1
605 . 2 . 1 72 72 SER C C 13 176.5092534 0 . . . . . . . 72 SER C . 51025 1
606 . 2 . 1 72 72 SER CA C 13 62.87827203 0.001845553854 . . . . . . . 72 SER CA . 51025 1
607 . 2 . 1 72 72 SER N N 15 119.8041754 0.08139353732 . . . . . . . 72 SER N . 51025 1
608 . 2 . 1 73 73 LEU H H 1 8.216397921 0.01249082907 . . . . . . . 73 LEU H . 51025 1
609 . 2 . 1 73 73 LEU C C 13 179.3927544 0.1314349079 . . . . . . . 73 LEU C . 51025 1
610 . 2 . 1 73 73 LEU CA C 13 57.86880811 0.02884281062 . . . . . . . 73 LEU CA . 51025 1
611 . 2 . 1 73 73 LEU N N 15 121.3326597 0.09340196493 . . . . . . . 73 LEU N . 51025 1
612 . 2 . 1 74 74 LEU H H 1 8.739410302 0.004389664599 . . . . . . . 74 LEU H . 51025 1
613 . 2 . 1 74 74 LEU C C 13 179.3776585 0.06020045605 . . . . . . . 74 LEU C . 51025 1
614 . 2 . 1 74 74 LEU CA C 13 57.99989516 0.004268212047 . . . . . . . 74 LEU CA . 51025 1
615 . 2 . 1 74 74 LEU N N 15 120.2579565 0.0807780208 . . . . . . . 74 LEU N . 51025 1
616 . 2 . 1 75 75 SER H H 1 8.550234943 0.0080065202 . . . . . . . 75 SER H . 51025 1
617 . 2 . 1 75 75 SER C C 13 176.6978712 0.01002471849 . . . . . . . 75 SER C . 51025 1
618 . 2 . 1 75 75 SER CA C 13 62.10957557 0.03363711872 . . . . . . . 75 SER CA . 51025 1
619 . 2 . 1 75 75 SER N N 15 117.1653584 0.1593624157 . . . . . . . 75 SER N . 51025 1
620 . 2 . 1 76 76 TRP H H 1 7.892188218 0.003157864244 . . . . . . . 76 TRP H . 51025 1
621 . 2 . 1 76 76 TRP C C 13 177.9267849 0.07177546859 . . . . . . . 76 TRP C . 51025 1
622 . 2 . 1 76 76 TRP CA C 13 58.97900379 0.00523671581 . . . . . . . 76 TRP CA . 51025 1
623 . 2 . 1 76 76 TRP N N 15 124.5269648 0.07699903273 . . . . . . . 76 TRP N . 51025 1
624 . 2 . 1 77 77 GLY H H 1 8.759725928 0.004507470115 . . . . . . . 77 GLY H . 51025 1
625 . 2 . 1 77 77 GLY C C 13 173.5856198 0.01763638203 . . . . . . . 77 GLY C . 51025 1
626 . 2 . 1 77 77 GLY CA C 13 46.72610712 0.02394132318 . . . . . . . 77 GLY CA . 51025 1
627 . 2 . 1 77 77 GLY N N 15 105.5270624 0.05353241186 . . . . . . . 77 GLY N . 51025 1
628 . 2 . 1 78 78 PHE H H 1 8.225860958 0.00373616154 . . . . . . . 78 PHE H . 51025 1
629 . 2 . 1 78 78 PHE C C 13 176.0922968 0.02613626998 . . . . . . . 78 PHE C . 51025 1
630 . 2 . 1 78 78 PHE CA C 13 58.20956703 0.002931515271 . . . . . . . 78 PHE CA . 51025 1
631 . 2 . 1 78 78 PHE N N 15 113.4969457 0.07731956357 . . . . . . . 78 PHE N . 51025 1
632 . 2 . 1 79 79 PHE H H 1 7.21323459 0.002956748427 . . . . . . . 79 PHE H . 51025 1
633 . 2 . 1 79 79 PHE C C 13 176.9184784 0.04351216159 . . . . . . . 79 PHE C . 51025 1
634 . 2 . 1 79 79 PHE CA C 13 56.61107474 0.005764760526 . . . . . . . 79 PHE CA . 51025 1
635 . 2 . 1 79 79 PHE N N 15 114.2871299 0.05752975913 . . . . . . . 79 PHE N . 51025 1
636 . 2 . 1 80 80 GLY H H 1 7.957099302 0.009788987256 . . . . . . . 80 GLY H . 51025 1
637 . 2 . 1 80 80 GLY C C 13 174.638329 0.002368980751 . . . . . . . 80 GLY C . 51025 1
638 . 2 . 1 80 80 GLY CA C 13 46.37819455 0.01246020807 . . . . . . . 80 GLY CA . 51025 1
639 . 2 . 1 80 80 GLY N N 15 109.1175375 0.07699004839 . . . . . . . 80 GLY N . 51025 1
640 . 2 . 1 81 81 GLN H H 1 7.786829327 0.003609331901 . . . . . . . 81 GLN H . 51025 1
641 . 2 . 1 81 81 GLN C C 13 174.9882809 0.01108268021 . . . . . . . 81 GLN C . 51025 1
642 . 2 . 1 81 81 GLN CA C 13 54.98096706 0.004892410311 . . . . . . . 81 GLN CA . 51025 1
643 . 2 . 1 81 81 GLN N N 15 120.7091544 0.06230927495 . . . . . . . 81 GLN N . 51025 1
644 . 2 . 1 82 82 ARG H H 1 8.282530833 0.003413112384 . . . . . . . 82 ARG H . 51025 1
645 . 2 . 1 82 82 ARG C C 13 176.5896838 0.02929957596 . . . . . . . 82 ARG C . 51025 1
646 . 2 . 1 82 82 ARG CA C 13 55.75908167 0.002740944351 . . . . . . . 82 ARG CA . 51025 1
647 . 2 . 1 82 82 ARG N N 15 124.1884535 0.06492232241 . . . . . . . 82 ARG N . 51025 1
648 . 2 . 1 83 83 LEU H H 1 8.106564425 0.003415945695 . . . . . . . 83 LEU H . 51025 1
649 . 2 . 1 83 83 LEU C C 13 174.6178625 0.0001813586678 . . . . . . . 83 LEU C . 51025 1
650 . 2 . 1 83 83 LEU CA C 13 53.7466026 0.01011087889 . . . . . . . 83 LEU CA . 51025 1
651 . 2 . 1 83 83 LEU N N 15 124.4157341 0.0620995013 . . . . . . . 83 LEU N . 51025 1
652 . 2 . 1 84 84 ASP H H 1 7.456716468 0.003190668799 . . . . . . . 84 ASP H . 51025 1
653 . 2 . 1 84 84 ASP C C 13 175.2941375 0.04579804039 . . . . . . . 84 ASP C . 51025 1
654 . 2 . 1 84 84 ASP CA C 13 50.96001883 0.004616097024 . . . . . . . 84 ASP CA . 51025 1
655 . 2 . 1 84 84 ASP N N 15 120.4736443 0.05123587549 . . . . . . . 84 ASP N . 51025 1
656 . 2 . 1 85 85 LEU H H 1 8.757885192 0.004251909896 . . . . . . . 85 LEU H . 51025 1
657 . 2 . 1 85 85 LEU C C 13 175.9444282 0 . . . . . . . 85 LEU C . 51025 1
658 . 2 . 1 85 85 LEU CA C 13 59.27318858 0 . . . . . . . 85 LEU CA . 51025 1
659 . 2 . 1 85 85 LEU N N 15 118.8671336 0.0482357743 . . . . . . . 85 LEU N . 51025 1
660 . 2 . 1 86 86 PRO C C 13 177.6489439 0 . . . . . . . 86 PRO C . 51025 1
661 . 2 . 1 86 86 PRO CA C 13 66.2107157 0 . . . . . . . 86 PRO CA . 51025 1
662 . 2 . 1 87 87 ALA H H 1 7.52889688 0.004015143391 . . . . . . . 87 ALA H . 51025 1
663 . 2 . 1 87 87 ALA C C 13 179.307132 0.07272522154 . . . . . . . 87 ALA C . 51025 1
664 . 2 . 1 87 87 ALA CA C 13 55.36993145 0.0179460198 . . . . . . . 87 ALA CA . 51025 1
665 . 2 . 1 87 87 ALA N N 15 117.8214801 0.05326378441 . . . . . . . 87 ALA N . 51025 1
666 . 2 . 1 88 88 ILE H H 1 7.964370332 0.00375874436 . . . . . . . 88 ILE H . 51025 1
667 . 2 . 1 88 88 ILE C C 13 178.260333 0.06531403576 . . . . . . . 88 ILE C . 51025 1
668 . 2 . 1 88 88 ILE CA C 13 64.59053972 0.002075718759 . . . . . . . 88 ILE CA . 51025 1
669 . 2 . 1 88 88 ILE N N 15 118.1025543 0.06917640558 . . . . . . . 88 ILE N . 51025 1
670 . 2 . 1 89 89 ILE H H 1 8.682858487 0.003342878378 . . . . . . . 89 ILE H . 51025 1
671 . 2 . 1 89 89 ILE C C 13 178.3984835 0.04357971209 . . . . . . . 89 ILE C . 51025 1
672 . 2 . 1 89 89 ILE CA C 13 64.34828403 0.01026283468 . . . . . . . 89 ILE CA . 51025 1
673 . 2 . 1 89 89 ILE N N 15 119.6227942 0.03294237627 . . . . . . . 89 ILE N . 51025 1
674 . 2 . 1 90 90 GLY H H 1 8.843269754 0.00442745926 . . . . . . . 90 GLY H . 51025 1
675 . 2 . 1 90 90 GLY C C 13 175.524141 0.01301055547 . . . . . . . 90 GLY C . 51025 1
676 . 2 . 1 90 90 GLY CA C 13 47.58893297 0.01031180904 . . . . . . . 90 GLY CA . 51025 1
677 . 2 . 1 90 90 GLY N N 15 107.5817826 0.04150483285 . . . . . . . 90 GLY N . 51025 1
678 . 2 . 1 91 91 MET H H 1 8.558968297 0.003589012262 . . . . . . . 91 MET H . 51025 1
679 . 2 . 1 91 91 MET C C 13 178.4198817 0.0673600935 . . . . . . . 91 MET C . 51025 1
680 . 2 . 1 91 91 MET CA C 13 59.78790759 0.007039465426 . . . . . . . 91 MET CA . 51025 1
681 . 2 . 1 91 91 MET N N 15 119.856082 0.0588812782 . . . . . . . 91 MET N . 51025 1
682 . 2 . 1 92 92 MET H H 1 8.437034905 0.003942788014 . . . . . . . 92 MET H . 51025 1
683 . 2 . 1 92 92 MET C C 13 177.9662823 0 . . . . . . . 92 MET C . 51025 1
684 . 2 . 1 92 92 MET CA C 13 59.55315405 0.06301197293 . . . . . . . 92 MET CA . 51025 1
685 . 2 . 1 92 92 MET N N 15 119.6292891 0.09803261532 . . . . . . . 92 MET N . 51025 1
686 . 2 . 1 93 93 LEU H H 1 8.285154901 0.003324822066 . . . . . . . 93 LEU H . 51025 1
687 . 2 . 1 93 93 LEU C C 13 178.2821046 0 . . . . . . . 93 LEU C . 51025 1
688 . 2 . 1 93 93 LEU CA C 13 58.03862425 0 . . . . . . . 93 LEU CA . 51025 1
689 . 2 . 1 93 93 LEU N N 15 119.5608958 0.05723265848 . . . . . . . 93 LEU N . 51025 1
690 . 2 . 1 94 94 ILE C C 13 177.7831232 0 . . . . . . . 94 ILE C . 51025 1
691 . 2 . 1 94 94 ILE CA C 13 65.39191564 0 . . . . . . . 94 ILE CA . 51025 1
692 . 2 . 1 95 95 CYS H H 1 8.160182879 0.004446527493 . . . . . . . 95 CYS H . 51025 1
693 . 2 . 1 95 95 CYS C C 13 176.2329731 0 . . . . . . . 95 CYS C . 51025 1
694 . 2 . 1 95 95 CYS CA C 13 64.32380285 0.005954377461 . . . . . . . 95 CYS CA . 51025 1
695 . 2 . 1 95 95 CYS N N 15 116.3524887 0.03245274599 . . . . . . . 95 CYS N . 51025 1
696 . 2 . 1 96 96 ALA H H 1 8.634679063 0.006359576198 . . . . . . . 96 ALA H . 51025 1
697 . 2 . 1 96 96 ALA C C 13 178.7229461 0.08470052775 . . . . . . . 96 ALA C . 51025 1
698 . 2 . 1 96 96 ALA CA C 13 54.85393594 0.004306805725 . . . . . . . 96 ALA CA . 51025 1
699 . 2 . 1 96 96 ALA N N 15 120.3197819 0.03465541928 . . . . . . . 96 ALA N . 51025 1
700 . 2 . 1 97 97 GLY H H 1 8.470535019 0.005489609978 . . . . . . . 97 GLY H . 51025 1
701 . 2 . 1 97 97 GLY C C 13 174.9756778 0 . . . . . . . 97 GLY C . 51025 1
702 . 2 . 1 97 97 GLY CA C 13 48.59169082 0.01071618844 . . . . . . . 97 GLY CA . 51025 1
703 . 2 . 1 97 97 GLY N N 15 105.8373708 0.04738868059 . . . . . . . 97 GLY N . 51025 1
704 . 2 . 1 98 98 VAL H H 1 8.247993296 0.004198582955 . . . . . . . 98 VAL H . 51025 1
705 . 2 . 1 98 98 VAL C C 13 177.7388587 0 . . . . . . . 98 VAL C . 51025 1
706 . 2 . 1 98 98 VAL CA C 13 66.84967289 0.09858665766 . . . . . . . 98 VAL CA . 51025 1
707 . 2 . 1 98 98 VAL N N 15 120.3608212 0.09009711762 . . . . . . . 98 VAL N . 51025 1
708 . 2 . 1 99 99 LEU H H 1 8.072471799 0.008751805231 . . . . . . . 99 LEU H . 51025 1
709 . 2 . 1 99 99 LEU C C 13 178.3463733 0 . . . . . . . 99 LEU C . 51025 1
710 . 2 . 1 99 99 LEU CA C 13 58.18754885 0.01430474756 . . . . . . . 99 LEU CA . 51025 1
711 . 2 . 1 99 99 LEU N N 15 119.8039212 0.05994733341 . . . . . . . 99 LEU N . 51025 1
712 . 2 . 1 100 100 ILE H H 1 8.42412521 0.006864248271 . . . . . . . 100 ILE H . 51025 1
713 . 2 . 1 100 100 ILE C C 13 177.7493405 0.03404065208 . . . . . . . 100 ILE C . 51025 1
714 . 2 . 1 100 100 ILE CA C 13 65.70019953 0.06088682448 . . . . . . . 100 ILE CA . 51025 1
715 . 2 . 1 100 100 ILE N N 15 119.271943 0.1381763611 . . . . . . . 100 ILE N . 51025 1
716 . 2 . 1 101 101 ILE H H 1 7.820649316 0.00230077271 . . . . . . . 101 ILE H . 51025 1
717 . 2 . 1 101 101 ILE C C 13 177.5874657 0 . . . . . . . 101 ILE C . 51025 1
718 . 2 . 1 101 101 ILE CA C 13 65.70239352 0.004900262709 . . . . . . . 101 ILE CA . 51025 1
719 . 2 . 1 101 101 ILE N N 15 118.5970627 0.05737161876 . . . . . . . 101 ILE N . 51025 1
720 . 2 . 1 102 102 ASN H H 1 8.129547722 0.005650749822 . . . . . . . 102 ASN H . 51025 1
721 . 2 . 1 102 102 ASN C C 13 176.4965819 0.03304993968 . . . . . . . 102 ASN C . 51025 1
722 . 2 . 1 102 102 ASN CA C 13 56.58173399 0.01039510898 . . . . . . . 102 ASN CA . 51025 1
723 . 2 . 1 102 102 ASN N N 15 115.2818327 0.05063280065 . . . . . . . 102 ASN N . 51025 1
724 . 2 . 1 103 103 LEU H H 1 8.485723168 0.004206131294 . . . . . . . 103 LEU H . 51025 1
725 . 2 . 1 103 103 LEU C C 13 178.3015276 0.04119253536 . . . . . . . 103 LEU C . 51025 1
726 . 2 . 1 103 103 LEU CA C 13 56.19983326 0.007668651938 . . . . . . . 103 LEU CA . 51025 1
727 . 2 . 1 103 103 LEU N N 15 114.6945631 0.06317112518 . . . . . . . 103 LEU N . 51025 1
728 . 2 . 1 104 104 LEU H H 1 7.801811619 0.003895423864 . . . . . . . 104 LEU H . 51025 1
729 . 2 . 1 104 104 LEU C C 13 177.128305 0 . . . . . . . 104 LEU C . 51025 1
730 . 2 . 1 104 104 LEU CA C 13 54.62980628 0.01181097548 . . . . . . . 104 LEU CA . 51025 1
731 . 2 . 1 104 104 LEU N N 15 114.2845487 0.07577623212 . . . . . . . 104 LEU N . 51025 1
732 . 2 . 1 105 105 SER H H 1 7.546364854 0.00364322296 . . . . . . . 105 SER H . 51025 1
733 . 2 . 1 105 105 SER C C 13 176.3252446 0 . . . . . . . 105 SER C . 51025 1
734 . 2 . 1 105 105 SER CA C 13 58.04275204 0.00977674111 . . . . . . . 105 SER CA . 51025 1
735 . 2 . 1 105 105 SER N N 15 112.0406916 0.05776278354 . . . . . . . 105 SER N . 51025 1
736 . 2 . 1 106 106 ARG H H 1 10.07502306 0.004657643331 . . . . . . . 106 ARG H . 51025 1
737 . 2 . 1 106 106 ARG C C 13 177.0710145 0.03886345764 . . . . . . . 106 ARG C . 51025 1
738 . 2 . 1 106 106 ARG CA C 13 54.77463811 0.007138158801 . . . . . . . 106 ARG CA . 51025 1
739 . 2 . 1 106 106 ARG N N 15 129.3031844 0.07978333232 . . . . . . . 106 ARG N . 51025 1
740 . 2 . 1 107 107 SER H H 1 8.487230054 0.004398733517 . . . . . . . 107 SER H . 51025 1
741 . 2 . 1 107 107 SER C C 13 173.4262455 0 . . . . . . . 107 SER C . 51025 1
742 . 2 . 1 107 107 SER CA C 13 59.8372463 0.01255718244 . . . . . . . 107 SER CA . 51025 1
743 . 2 . 1 107 107 SER N N 15 117.8223601 0.07161782613 . . . . . . . 107 SER N . 51025 1
744 . 2 . 1 108 108 THR H H 1 7.679500327 0.006128637884 . . . . . . . 108 THR H . 51025 1
745 . 2 . 1 108 108 THR C C 13 172.5819781 0 . . . . . . . 108 THR C . 51025 1
746 . 2 . 1 108 108 THR CA C 13 58.18415569 0 . . . . . . . 108 THR CA . 51025 1
747 . 2 . 1 108 108 THR N N 15 114.3595048 0.05594028674 . . . . . . . 108 THR N . 51025 1
748 . 2 . 1 109 109 PRO C C 13 175.7002919 0 . . . . . . . 109 PRO C . 51025 1
749 . 2 . 1 109 109 PRO CA C 13 63.08621148 0 . . . . . . . 109 PRO CA . 51025 1
750 . 2 . 1 110 110 HIS H H 1 7.770797599 0.00550536732 . . . . . . . 110 HIS H . 51025 1
751 . 2 . 1 110 110 HIS C C 13 178.7135522 0 . . . . . . . 110 HIS C . 51025 1
752 . 2 . 1 110 110 HIS N N 15 123.9068174 0.05834879274 . . . . . . . 110 HIS N . 51025 1
stop_
save_