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 50959
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'Mg-bound CorA in DMPC'
_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 hCANH' . . . 50959 1
2 '3D hcoCAcoNH' . . . 50959 1
3 '3D hCONH' . . . 50959 1
4 '3D hCOcaNH' . . . 50959 1
5 '3D hcaCBcaNH' . . . 50959 1
6 '3D hcaCBcacoNH' . . . 50959 1
7 '3D HNCAHa' . . . 50959 1
8 '3D hNcoCAHa' . . . 50959 1
9 '3D hCOCAHa' . . . 50959 1
10 '3D hCBCAHa' . . . 50959 1
11 '3D HCCH-TOCSY' . . . 50959 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 . . 50959 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 27 27 PHE H H 1 8.653 0.00361 . 1 . . . . . 27 F HN . 50959 1
2 . 1 . 1 27 27 PHE HA H 1 5.398 0.02431 . 1 . . . . . 27 F HA . 50959 1
3 . 1 . 1 27 27 PHE C C 13 173.233 0.01242 . 1 . . . . . 27 F C . 50959 1
4 . 1 . 1 27 27 PHE CA C 13 58.529 0.05581 . 1 . . . . . 27 F CA . 50959 1
5 . 1 . 1 27 27 PHE N N 15 120.483 0.09571 . 1 . . . . . 27 F N . 50959 1
6 . 1 . 1 28 28 GLU H H 1 8.104 0.03106 . 1 . . . . . 28 E HN . 50959 1
7 . 1 . 1 28 28 GLU HA H 1 3.468 0.01370 . 1 . . . . . 28 E HA . 50959 1
8 . 1 . 1 28 28 GLU HB2 H 1 1.805 0.01324 . 1 . . . . . 28 E HB2 . 50959 1
9 . 1 . 1 28 28 GLU C C 13 171.747 0.02963 . 1 . . . . . 28 E C . 50959 1
10 . 1 . 1 28 28 GLU CA C 13 56.013 0.03917 . 1 . . . . . 28 E CA . 50959 1
11 . 1 . 1 28 28 GLU CB C 13 33.143 0.06242 . 1 . . . . . 28 E CB . 50959 1
12 . 1 . 1 28 28 GLU CG C 13 35.170 0.01973 . 1 . . . . . 28 E CG . 50959 1
13 . 1 . 1 28 28 GLU N N 15 125.210 0.16388 . 1 . . . . . 28 E N . 50959 1
14 . 1 . 1 29 29 ILE H H 1 7.889 0.02179 . 1 . . . . . 29 I HN . 50959 1
15 . 1 . 1 29 29 ILE HA H 1 4.582 0.01712 . 1 . . . . . 29 I HA . 50959 1
16 . 1 . 1 29 29 ILE C C 13 173.476 0.06364 . 1 . . . . . 29 I C . 50959 1
17 . 1 . 1 29 29 ILE CA C 13 59.768 0.05847 . 1 . . . . . 29 I CA . 50959 1
18 . 1 . 1 29 29 ILE CB C 13 38.531 0.02731 . 1 . . . . . 29 I CB . 50959 1
19 . 1 . 1 29 29 ILE N N 15 120.542 0.20246 . 1 . . . . . 29 I N . 50959 1
20 . 1 . 1 30 30 GLU H H 1 8.677 0.02420 . 1 . . . . . 30 E HN . 50959 1
21 . 1 . 1 30 30 GLU HA H 1 4.676 0.04598 . 1 . . . . . 30 E HA . 50959 1
22 . 1 . 1 30 30 GLU C C 13 173.829 0.06423 . 1 . . . . . 30 E C . 50959 1
23 . 1 . 1 30 30 GLU CA C 13 53.624 0.08079 . 1 . . . . . 30 E CA . 50959 1
24 . 1 . 1 30 30 GLU CB C 13 33.290 0 . 1 . . . . . 30 E CB . 50959 1
25 . 1 . 1 30 30 GLU N N 15 127.821 0.18530 . 1 . . . . . 30 E N . 50959 1
26 . 1 . 1 31 31 VAL H H 1 8.419 0.03035 . 1 . . . . . 31 V HN . 50959 1
27 . 1 . 1 31 31 VAL HA H 1 4.312 0.01988 . 1 . . . . . 31 V HA . 50959 1
28 . 1 . 1 31 31 VAL HB H 1 1.545 0 . 1 . . . . . 31 V HB . 50959 1
29 . 1 . 1 31 31 VAL C C 13 174.529 0.03545 . 1 . . . . . 31 V C . 50959 1
30 . 1 . 1 31 31 VAL CA C 13 60.131 0.04006 . 1 . . . . . 31 V CA . 50959 1
31 . 1 . 1 31 31 VAL CB C 13 33.717 0.12664 . 1 . . . . . 31 V CB . 50959 1
32 . 1 . 1 31 31 VAL CG1 C 13 21.795 0 . 1 . . . . . 31 V CG1 . 50959 1
33 . 1 . 1 31 31 VAL N N 15 127.646 0.17972 . 1 . . . . . 31 V N . 50959 1
34 . 1 . 1 32 32 MET H H 1 8.245 0.02118 . 1 . . . . . 32 M HN . 50959 1
35 . 1 . 1 32 32 MET HA H 1 5.076 0.03824 . 1 . . . . . 32 M HA . 50959 1
36 . 1 . 1 32 32 MET C C 13 173.637 0.04801 . 1 . . . . . 32 M C . 50959 1
37 . 1 . 1 32 32 MET CA C 13 55.432 0.03659 . 1 . . . . . 32 M CA . 50959 1
38 . 1 . 1 32 32 MET CB C 13 36.677 0.06996 . 1 . . . . . 32 M CB . 50959 1
39 . 1 . 1 32 32 MET CG C 13 33.032 0 . 1 . . . . . 32 M CG . 50959 1
40 . 1 . 1 32 32 MET N N 15 121.268 0.14530 . 1 . . . . . 32 M N . 50959 1
41 . 1 . 1 33 33 ASN H H 1 9.007 0.02244 . 1 . . . . . 33 N HN . 50959 1
42 . 1 . 1 33 33 ASN HA H 1 5.608 0.02658 . 1 . . . . . 33 N HA . 50959 1
43 . 1 . 1 33 33 ASN C C 13 172.656 0.09038 . 1 . . . . . 33 N C . 50959 1
44 . 1 . 1 33 33 ASN CA C 13 52.051 0.01846 . 1 . . . . . 33 N CA . 50959 1
45 . 1 . 1 33 33 ASN CB C 13 44.311 0.03419 . 1 . . . . . 33 N CB . 50959 1
46 . 1 . 1 33 33 ASN N N 15 124.409 0.12073 . 1 . . . . . 33 N N . 50959 1
47 . 1 . 1 34 34 TYR H H 1 8.358 0.03045 . 1 . . . . . 34 Y HN . 50959 1
48 . 1 . 1 34 34 TYR HA H 1 5.323 0.01284 . 1 . . . . . 34 Y HA . 50959 1
49 . 1 . 1 34 34 TYR C C 13 170.647 0.05907 . 1 . . . . . 34 Y C . 50959 1
50 . 1 . 1 34 34 TYR CA C 13 56.457 0.05458 . 1 . . . . . 34 Y CA . 50959 1
51 . 1 . 1 34 34 TYR CB C 13 41.647 0.04881 . 1 . . . . . 34 Y CB . 50959 1
52 . 1 . 1 34 34 TYR N N 15 122.471 0.20120 . 1 . . . . . 34 Y N . 50959 1
53 . 1 . 1 35 35 SER H H 1 8.797 0.03571 . 1 . . . . . 35 S HN . 50959 1
54 . 1 . 1 35 35 SER HA H 1 4.864 0.02531 . 1 . . . . . 35 S HA . 50959 1
55 . 1 . 1 35 35 SER C C 13 175.498 0.08787 . 1 . . . . . 35 S C . 50959 1
56 . 1 . 1 35 35 SER CA C 13 56.108 0.09485 . 1 . . . . . 35 S CA . 50959 1
57 . 1 . 1 35 35 SER CB C 13 65.904 0.08864 . 1 . . . . . 35 S CB . 50959 1
58 . 1 . 1 35 35 SER N N 15 109.809 0.15898 . 1 . . . . . 35 S N . 50959 1
59 . 1 . 1 36 36 ILE H H 1 8.557 0.02395 . 1 . . . . . 36 I HN . 50959 1
60 . 1 . 1 36 36 ILE HA H 1 3.749 0.03315 . 1 . . . . . 36 I HA . 50959 1
61 . 1 . 1 36 36 ILE C C 13 176.436 0.03565 . 1 . . . . . 36 I C . 50959 1
62 . 1 . 1 36 36 ILE CA C 13 65.631 0.08470 . 1 . . . . . 36 I CA . 50959 1
63 . 1 . 1 36 36 ILE CB C 13 38.383 0.31482 . 1 . . . . . 36 I CB . 50959 1
64 . 1 . 1 36 36 ILE N N 15 120.299 0.06602 . 1 . . . . . 36 I N . 50959 1
65 . 1 . 1 37 37 GLU H H 1 8.777 0.02335 . 1 . . . . . 37 E HN . 50959 1
66 . 1 . 1 37 37 GLU CA C 13 58.099 0 . 1 . . . . . 37 E CA . 50959 1
67 . 1 . 1 37 37 GLU N N 15 119.092 0.12751 . 1 . . . . . 37 E N . 50959 1
68 . 1 . 1 39 39 PHE C C 13 172.638 0 . 1 . . . . . 39 F C . 50959 1
69 . 1 . 1 40 40 ARG H H 1 8.910 0.03421 . 1 . . . . . 40 R HN . 50959 1
70 . 1 . 1 40 40 ARG HA H 1 4.242 0.01883 . 1 . . . . . 40 R HA . 50959 1
71 . 1 . 1 40 40 ARG C C 13 172.898 0.13432 . 1 . . . . . 40 R C . 50959 1
72 . 1 . 1 40 40 ARG CA C 13 54.765 0.06880 . 1 . . . . . 40 R CA . 50959 1
73 . 1 . 1 40 40 ARG CB C 13 33.859 0.06138 . 1 . . . . . 40 R CB . 50959 1
74 . 1 . 1 40 40 ARG CG C 13 27.010 0 . 1 . . . . . 40 R CG . 50959 1
75 . 1 . 1 40 40 ARG N N 15 125.203 0.12210 . 1 . . . . . 40 R N . 50959 1
76 . 1 . 1 41 41 GLU H H 1 8.256 0.01558 . 1 . . . . . 41 E HN . 50959 1
77 . 1 . 1 41 41 GLU HA H 1 5.607 0.01870 . 1 . . . . . 41 E HA . 50959 1
78 . 1 . 1 41 41 GLU C C 13 174.757 0.07111 . 1 . . . . . 41 E C . 50959 1
79 . 1 . 1 41 41 GLU CA C 13 53.172 0.05243 . 1 . . . . . 41 E CA . 50959 1
80 . 1 . 1 41 41 GLU CB C 13 33.767 0.14679 . 1 . . . . . 41 E CB . 50959 1
81 . 1 . 1 41 41 GLU N N 15 120.986 0.04765 . 1 . . . . . 41 E N . 50959 1
82 . 1 . 1 42 42 PHE H H 1 8.285 0.03499 . 1 . . . . . 42 F HN . 50959 1
83 . 1 . 1 42 42 PHE HA H 1 4.760 0.03490 . 1 . . . . . 42 F HA . 50959 1
84 . 1 . 1 42 42 PHE C C 13 172.021 0.03309 . 1 . . . . . 42 F C . 50959 1
85 . 1 . 1 42 42 PHE CA C 13 56.863 0.03673 . 1 . . . . . 42 F CA . 50959 1
86 . 1 . 1 42 42 PHE CB C 13 39.992 0.11070 . 1 . . . . . 42 F CB . 50959 1
87 . 1 . 1 42 42 PHE N N 15 117.089 0.15962 . 1 . . . . . 42 F N . 50959 1
88 . 1 . 1 43 43 LYS H H 1 8.383 0.07816 . 1 . . . . . 43 K HN . 50959 1
89 . 1 . 1 43 43 LYS HA H 1 4.847 0.01078 . 1 . . . . . 43 K HA . 50959 1
90 . 1 . 1 43 43 LYS CA C 13 54.152 0.00944 . 1 . . . . . 43 K CA . 50959 1
91 . 1 . 1 43 43 LYS N N 15 118.217 0.16317 . 1 . . . . . 43 K N . 50959 1
92 . 1 . 1 44 44 THR H H 1 9.181 0.01482 . 1 . . . . . 44 T HN . 50959 1
93 . 1 . 1 44 44 THR HA H 1 4.830 0.02082 . 1 . . . . . 44 T HA . 50959 1
94 . 1 . 1 44 44 THR C C 13 171.679 0.03207 . 1 . . . . . 44 T C . 50959 1
95 . 1 . 1 44 44 THR CA C 13 60.015 0.03212 . 1 . . . . . 44 T CA . 50959 1
96 . 1 . 1 44 44 THR CB C 13 69.599 0.11509 . 1 . . . . . 44 T CB . 50959 1
97 . 1 . 1 44 44 THR CG2 C 13 19.758 0 . 1 . . . . . 44 T CG2 . 50959 1
98 . 1 . 1 44 44 THR N N 15 116.870 0.26165 . 1 . . . . . 44 T N . 50959 1
99 . 1 . 1 45 45 THR H H 1 7.957 0.02037 . 1 . . . . . 45 T HN . 50959 1
100 . 1 . 1 45 45 THR HA H 1 4.384 0.03074 . 1 . . . . . 45 T HA . 50959 1
101 . 1 . 1 45 45 THR HB H 1 4.755 0 . 1 . . . . . 45 T HB . 50959 1
102 . 1 . 1 45 45 THR C C 13 173.421 0.05934 . 1 . . . . . 45 T C . 50959 1
103 . 1 . 1 45 45 THR CA C 13 60.765 0.05895 . 1 . . . . . 45 T CA . 50959 1
104 . 1 . 1 45 45 THR CB C 13 69.113 0.15386 . 1 . . . . . 45 T CB . 50959 1
105 . 1 . 1 45 45 THR CG2 C 13 22.043 0 . 1 . . . . . 45 T CG2 . 50959 1
106 . 1 . 1 45 45 THR N N 15 112.112 0.19420 . 1 . . . . . 45 T N . 50959 1
107 . 1 . 1 46 46 ASP H H 1 8.853 0.03313 . 1 . . . . . 46 D HN . 50959 1
108 . 1 . 1 46 46 ASP HA H 1 4.899 0.02651 . 1 . . . . . 46 D HA . 50959 1
109 . 1 . 1 46 46 ASP C C 13 176.438 0.02950 . 1 . . . . . 46 D C . 50959 1
110 . 1 . 1 46 46 ASP CA C 13 52.263 0.03654 . 1 . . . . . 46 D CA . 50959 1
111 . 1 . 1 46 46 ASP CB C 13 41.421 0.10072 . 1 . . . . . 46 D CB . 50959 1
112 . 1 . 1 46 46 ASP N N 15 124.925 0.06951 . 1 . . . . . 46 D N . 50959 1
113 . 1 . 1 47 47 VAL H H 1 9.160 0.08835 . 1 . . . . . 47 V HN . 50959 1
114 . 1 . 1 47 47 VAL HA H 1 3.535 0.02770 . 1 . . . . . 47 V HA . 50959 1
115 . 1 . 1 47 47 VAL HG11 H 1 0.862 0.09540 . 1 . . . . . 47 V QG1 . 50959 1
116 . 1 . 1 47 47 VAL HG12 H 1 0.862 0.09540 . 1 . . . . . 47 V QG1 . 50959 1
117 . 1 . 1 47 47 VAL HG13 H 1 0.862 0.09540 . 1 . . . . . 47 V QG1 . 50959 1
118 . 1 . 1 47 47 VAL C C 13 176.316 0.02834 . 1 . . . . . 47 V C . 50959 1
119 . 1 . 1 47 47 VAL CA C 13 64.385 0.04185 . 1 . . . . . 47 V CA . 50959 1
120 . 1 . 1 47 47 VAL CB C 13 31.737 0.03412 . 1 . . . . . 47 V CB . 50959 1
121 . 1 . 1 47 47 VAL CG1 C 13 23.499 0.13257 . 1 . . . . . 47 V CG1 . 50959 1
122 . 1 . 1 47 47 VAL N N 15 127.276 0.03450 . 1 . . . . . 47 V N . 50959 1
123 . 1 . 1 48 48 GLU H H 1 8.031 0.02009 . 1 . . . . . 48 E HN . 50959 1
124 . 1 . 1 48 48 GLU HA H 1 3.731 0.02010 . 1 . . . . . 48 E HA . 50959 1
125 . 1 . 1 48 48 GLU C C 13 178.941 0.05873 . 1 . . . . . 48 E C . 50959 1
126 . 1 . 1 48 48 GLU CA C 13 58.446 0.08541 . 1 . . . . . 48 E CA . 50959 1
127 . 1 . 1 48 48 GLU CB C 13 28.347 0.09422 . 1 . . . . . 48 E CB . 50959 1
128 . 1 . 1 48 48 GLU CG C 13 36.184 0 . 1 . . . . . 48 E CG . 50959 1
129 . 1 . 1 48 48 GLU N N 15 118.972 0.11930 . 1 . . . . . 48 E N . 50959 1
130 . 1 . 1 49 49 SER H H 1 7.471 0.02442 . 1 . . . . . 49 S HN . 50959 1
131 . 1 . 1 49 49 SER HA H 1 4.212 0.02369 . 1 . . . . . 49 S HA . 50959 1
132 . 1 . 1 49 49 SER C C 13 174.608 0 . 1 . . . . . 49 S C . 50959 1
133 . 1 . 1 49 49 SER CA C 13 60.496 0.07962 . 1 . . . . . 49 S CA . 50959 1
134 . 1 . 1 49 49 SER CB C 13 64.207 0.06949 . 1 . . . . . 49 S CB . 50959 1
135 . 1 . 1 49 49 SER N N 15 111.787 0.10514 . 1 . . . . . 49 S N . 50959 1
136 . 1 . 1 54 54 ARG HA H 1 3.980 0.03358 . 1 . . . . . 54 R HA . 50959 1
137 . 1 . 1 54 54 ARG C C 13 177.297 0.02580 . 1 . . . . . 54 R C . 50959 1
138 . 1 . 1 54 54 ARG CA C 13 59.800 0.06619 . 1 . . . . . 54 R CA . 50959 1
139 . 1 . 1 54 54 ARG CB C 13 31.081 0 . 1 . . . . . 54 R CB . 50959 1
140 . 1 . 1 54 54 ARG N N 15 122.314 0 . 1 . . . . . 54 R N . 50959 1
141 . 1 . 1 55 55 ASP H H 1 6.999 0.02552 . 1 . . . . . 55 D HN . 50959 1
142 . 1 . 1 55 55 ASP HA H 1 4.756 0.01380 . 1 . . . . . 55 D HA . 50959 1
143 . 1 . 1 55 55 ASP C C 13 175.558 0.06574 . 1 . . . . . 55 D C . 50959 1
144 . 1 . 1 55 55 ASP CA C 13 53.155 0.08504 . 1 . . . . . 55 D CA . 50959 1
145 . 1 . 1 55 55 ASP CB C 13 41.255 0.05354 . 1 . . . . . 55 D CB . 50959 1
146 . 1 . 1 55 55 ASP N N 15 113.749 0.10767 . 1 . . . . . 55 D N . 50959 1
147 . 1 . 1 56 56 SER H H 1 7.377 0.02080 . 1 . . . . . 56 S HN . 50959 1
148 . 1 . 1 56 56 SER HA H 1 4.230 0.01812 . 1 . . . . . 56 S HA . 50959 1
149 . 1 . 1 56 56 SER CA C 13 58.510 0.08959 . 1 . . . . . 56 S CA . 50959 1
150 . 1 . 1 56 56 SER CB C 13 63.982 0 . 1 . . . . . 56 S CB . 50959 1
151 . 1 . 1 56 56 SER N N 15 115.215 0.06879 . 1 . . . . . 56 S N . 50959 1
152 . 1 . 1 57 57 SER H H 1 8.893 0.02844 . 1 . . . . . 57 S HN . 50959 1
153 . 1 . 1 57 57 SER HA H 1 4.395 0.01918 . 1 . . . . . 57 S HA . 50959 1
154 . 1 . 1 57 57 SER C C 13 174.284 0.12412 . 1 . . . . . 57 S C . 50959 1
155 . 1 . 1 57 57 SER CA C 13 59.887 0.05050 . 1 . . . . . 57 S CA . 50959 1
156 . 1 . 1 57 57 SER CB C 13 63.692 0.04657 . 1 . . . . . 57 S CB . 50959 1
157 . 1 . 1 57 57 SER N N 15 121.638 0.17302 . 1 . . . . . 57 S N . 50959 1
158 . 1 . 1 58 58 THR H H 1 7.870 0.02604 . 1 . . . . . 58 T HN . 50959 1
159 . 1 . 1 58 58 THR HA H 1 4.724 0.00721 . 1 . . . . . 58 T HA . 50959 1
160 . 1 . 1 58 58 THR HB H 1 4.644 0.01869 . 1 . . . . . 58 T HB . 50959 1
161 . 1 . 1 58 58 THR C C 13 171.786 0.06893 . 1 . . . . . 58 T C . 50959 1
162 . 1 . 1 58 58 THR CA C 13 57.972 0.03008 . 1 . . . . . 58 T CA . 50959 1
163 . 1 . 1 58 58 THR CB C 13 68.408 0.09342 . 1 . . . . . 58 T CB . 50959 1
164 . 1 . 1 58 58 THR CG2 C 13 22.804 0 . 1 . . . . . 58 T CG2 . 50959 1
165 . 1 . 1 58 58 THR N N 15 113.595 0.18237 . 1 . . . . . 58 T N . 50959 1
166 . 1 . 1 59 59 PRO HA H 1 4.721 0.00155 . 1 . . . . . 59 P HA . 50959 1
167 . 1 . 1 59 59 PRO C C 13 175.208 0.12598 . 1 . . . . . 59 P C . 50959 1
168 . 1 . 1 59 59 PRO CA C 13 63.370 0.01250 . 1 . . . . . 59 P CA . 50959 1
169 . 1 . 1 59 59 PRO CB C 13 31.834 0 . 1 . . . . . 59 P CB . 50959 1
170 . 1 . 1 60 60 THR H H 1 7.877 0.03553 . 1 . . . . . 60 T HN . 50959 1
171 . 1 . 1 60 60 THR HA H 1 5.074 0.04174 . 1 . . . . . 60 T HA . 50959 1
172 . 1 . 1 60 60 THR C C 13 171.933 0.08537 . 1 . . . . . 60 T C . 50959 1
173 . 1 . 1 60 60 THR CA C 13 61.833 0.06463 . 1 . . . . . 60 T CA . 50959 1
174 . 1 . 1 60 60 THR CB C 13 71.939 0.06332 . 1 . . . . . 60 T CB . 50959 1
175 . 1 . 1 60 60 THR CG2 C 13 22.154 0 . 1 . . . . . 60 T CG2 . 50959 1
176 . 1 . 1 60 60 THR N N 15 114.152 0.26689 . 1 . . . . . 60 T N . 50959 1
177 . 1 . 1 61 61 TRP H H 1 9.319 0.02242 . 1 . . . . . 61 W HN . 50959 1
178 . 1 . 1 61 61 TRP HA H 1 5.524 0.01933 . 1 . . . . . 61 W HA . 50959 1
179 . 1 . 1 61 61 TRP C C 13 174.459 0.05306 . 1 . . . . . 61 W C . 50959 1
180 . 1 . 1 61 61 TRP CA C 13 52.121 0.03699 . 1 . . . . . 61 W CA . 50959 1
181 . 1 . 1 61 61 TRP CB C 13 31.574 0.09692 . 1 . . . . . 61 W CB . 50959 1
182 . 1 . 1 61 61 TRP N N 15 128.227 0.13524 . 1 . . . . . 61 W N . 50959 1
183 . 1 . 1 62 62 ILE H H 1 9.014 0.01375 . 1 . . . . . 62 I HN . 50959 1
184 . 1 . 1 62 62 ILE HA H 1 4.119 0.02381 . 1 . . . . . 62 I HA . 50959 1
185 . 1 . 1 62 62 ILE C C 13 172.131 0.07051 . 1 . . . . . 62 I C . 50959 1
186 . 1 . 1 62 62 ILE CA C 13 60.753 0.03910 . 1 . . . . . 62 I CA . 50959 1
187 . 1 . 1 62 62 ILE CB C 13 39.384 0.18745 . 1 . . . . . 62 I CB . 50959 1
188 . 1 . 1 62 62 ILE N N 15 127.954 0.09584 . 1 . . . . . 62 I N . 50959 1
189 . 1 . 1 63 63 ASN H H 1 9.011 0.02178 . 1 . . . . . 63 N HN . 50959 1
190 . 1 . 1 63 63 ASN HA H 1 5.007 0.01509 . 1 . . . . . 63 N HA . 50959 1
191 . 1 . 1 63 63 ASN C C 13 173.716 0.05352 . 1 . . . . . 63 N C . 50959 1
192 . 1 . 1 63 63 ASN CA C 13 51.305 0.03344 . 1 . . . . . 63 N CA . 50959 1
193 . 1 . 1 63 63 ASN CB C 13 39.867 0.17393 . 1 . . . . . 63 N CB . 50959 1
194 . 1 . 1 63 63 ASN N N 15 126.566 0.15092 . 1 . . . . . 63 N N . 50959 1
195 . 1 . 1 64 64 ILE H H 1 9.245 0.02648 . 1 . . . . . 64 I HN . 50959 1
196 . 1 . 1 64 64 ILE HA H 1 3.753 0.01323 . 1 . . . . . 64 I HA . 50959 1
197 . 1 . 1 64 64 ILE C C 13 173.016 0.05971 . 1 . . . . . 64 I C . 50959 1
198 . 1 . 1 64 64 ILE CA C 13 61.610 0.02509 . 1 . . . . . 64 I CA . 50959 1
199 . 1 . 1 64 64 ILE CB C 13 38.003 0.14723 . 1 . . . . . 64 I CB . 50959 1
200 . 1 . 1 64 64 ILE N N 15 129.225 0.10478 . 1 . . . . . 64 I N . 50959 1
201 . 1 . 1 65 65 THR H H 1 8.540 0.03831 . 1 . . . . . 65 T HN . 50959 1
202 . 1 . 1 65 65 THR HA H 1 3.953 0.01017 . 1 . . . . . 65 T HA . 50959 1
203 . 1 . 1 65 65 THR C C 13 171.859 0.13499 . 1 . . . . . 65 T C . 50959 1
204 . 1 . 1 65 65 THR CA C 13 61.862 0.07882 . 1 . . . . . 65 T CA . 50959 1
205 . 1 . 1 65 65 THR CB C 13 68.328 0.05357 . 1 . . . . . 65 T CB . 50959 1
206 . 1 . 1 65 65 THR N N 15 123.860 0.14881 . 1 . . . . . 65 T N . 50959 1
207 . 1 . 1 66 66 GLY H H 1 7.982 0.02172 . 1 . . . . . 66 G HN . 50959 1
208 . 1 . 1 66 66 GLY HA2 H 1 4.862 0.02306 . 1 . . . . . 66 G HA1 . 50959 1
209 . 1 . 1 66 66 GLY C C 13 173.373 0.02938 . 1 . . . . . 66 G C . 50959 1
210 . 1 . 1 66 66 GLY CA C 13 46.177 0.03726 . 1 . . . . . 66 G CA . 50959 1
211 . 1 . 1 66 66 GLY N N 15 112.433 0.15036 . 1 . . . . . 66 G N . 50959 1
212 . 1 . 1 67 67 ILE H H 1 6.652 0.02979 . 1 . . . . . 67 I HN . 50959 1
213 . 1 . 1 67 67 ILE HA H 1 3.491 0.02244 . 1 . . . . . 67 I HA . 50959 1
214 . 1 . 1 67 67 ILE C C 13 172.615 0.06238 . 1 . . . . . 67 I C . 50959 1
215 . 1 . 1 67 67 ILE CA C 13 63.932 0.11388 . 1 . . . . . 67 I CA . 50959 1
216 . 1 . 1 67 67 ILE CB C 13 36.756 0.17593 . 1 . . . . . 67 I CB . 50959 1
217 . 1 . 1 67 67 ILE N N 15 114.452 0.10793 . 1 . . . . . 67 I N . 50959 1
218 . 1 . 1 68 68 HIS H H 1 7.206 0.02351 . 1 . . . . . 68 H HN . 50959 1
219 . 1 . 1 68 68 HIS HA H 1 3.816 0.03594 . 1 . . . . . 68 H HA . 50959 1
220 . 1 . 1 68 68 HIS C C 13 177.856 0.19067 . 1 . . . . . 68 H C . 50959 1
221 . 1 . 1 68 68 HIS CA C 13 57.361 0.15771 . 1 . . . . . 68 H CA . 50959 1
222 . 1 . 1 68 68 HIS N N 15 114.140 0.13129 . 1 . . . . . 68 H N . 50959 1
223 . 1 . 1 69 69 ARG H H 1 6.764 0.03983 . 1 . . . . . 69 R HN . 50959 1
224 . 1 . 1 69 69 ARG HA H 1 4.371 0.01756 . 1 . . . . . 69 R HA . 50959 1
225 . 1 . 1 69 69 ARG C C 13 176.606 0.05848 . 1 . . . . . 69 R C . 50959 1
226 . 1 . 1 69 69 ARG CA C 13 51.740 0.11015 . 1 . . . . . 69 R CA . 50959 1
227 . 1 . 1 69 69 ARG CB C 13 24.029 0.23485 . 1 . . . . . 69 R CB . 50959 1
228 . 1 . 1 69 69 ARG N N 15 121.839 0.24582 . 1 . . . . . 69 R N . 50959 1
229 . 1 . 1 70 70 THR H H 1 7.934 0.02834 . 1 . . . . . 70 T HN . 50959 1
230 . 1 . 1 70 70 THR HA H 1 3.568 0.02268 . 1 . . . . . 70 T HA . 50959 1
231 . 1 . 1 70 70 THR C C 13 175.506 0.07417 . 1 . . . . . 70 T C . 50959 1
232 . 1 . 1 70 70 THR CA C 13 65.429 0.05187 . 1 . . . . . 70 T CA . 50959 1
233 . 1 . 1 70 70 THR CB C 13 67.845 0.14913 . 1 . . . . . 70 T CB . 50959 1
234 . 1 . 1 70 70 THR N N 15 118.436 0.13754 . 1 . . . . . 70 T N . 50959 1
235 . 1 . 1 71 71 ASP H H 1 9.098 0.03549 . 1 . . . . . 71 D HN . 50959 1
236 . 1 . 1 71 71 ASP HA H 1 4.165 0.01917 . 1 . . . . . 71 D HA . 50959 1
237 . 1 . 1 71 71 ASP C C 13 178.613 0.04741 . 1 . . . . . 71 D C . 50959 1
238 . 1 . 1 71 71 ASP CA C 13 55.880 0.04277 . 1 . . . . . 71 D CA . 50959 1
239 . 1 . 1 71 71 ASP CB C 13 38.747 0.11343 . 1 . . . . . 71 D CB . 50959 1
240 . 1 . 1 71 71 ASP N N 15 120.108 0.17412 . 1 . . . . . 71 D N . 50959 1
241 . 1 . 1 72 72 VAL H H 1 7.117 0.05099 . 1 . . . . . 72 V HN . 50959 1
242 . 1 . 1 72 72 VAL HA H 1 3.502 0.01741 . 1 . . . . . 72 V HA . 50959 1
243 . 1 . 1 72 72 VAL C C 13 177.226 0.01999 . 1 . . . . . 72 V C . 50959 1
244 . 1 . 1 72 72 VAL CA C 13 66.090 0.05000 . 1 . . . . . 72 V CA . 50959 1
245 . 1 . 1 72 72 VAL CB C 13 31.319 0.15080 . 1 . . . . . 72 V CB . 50959 1
246 . 1 . 1 72 72 VAL N N 15 123.595 0.16248 . 1 . . . . . 72 V N . 50959 1
247 . 1 . 1 73 73 VAL H H 1 6.978 0.01070 . 1 . . . . . 73 V HN . 50959 1
248 . 1 . 1 73 73 VAL HA H 1 3.316 0.03479 . 1 . . . . . 73 V HA . 50959 1
249 . 1 . 1 73 73 VAL C C 13 177.554 0 . 1 . . . . . 73 V C . 50959 1
250 . 1 . 1 73 73 VAL CA C 13 67.545 0.12883 . 1 . . . . . 73 V CA . 50959 1
251 . 1 . 1 73 73 VAL CB C 13 31.246 0 . 1 . . . . . 73 V CB . 50959 1
252 . 1 . 1 73 73 VAL N N 15 118.997 0.14900 . 1 . . . . . 73 V N . 50959 1
253 . 1 . 1 74 74 GLN H H 1 8.359 0.00888 . 1 . . . . . 74 Q HN . 50959 1
254 . 1 . 1 74 74 GLN HA H 1 3.648 0.00501 . 1 . . . . . 74 Q HA . 50959 1
255 . 1 . 1 74 74 GLN C C 13 177.482 0.08196 . 1 . . . . . 74 Q C . 50959 1
256 . 1 . 1 74 74 GLN CA C 13 59.851 0.02167 . 1 . . . . . 74 Q CA . 50959 1
257 . 1 . 1 74 74 GLN CB C 13 28.176 0.02630 . 1 . . . . . 74 Q CB . 50959 1
258 . 1 . 1 74 74 GLN N N 15 118.510 0.07614 . 1 . . . . . 74 Q N . 50959 1
259 . 1 . 1 75 75 ARG H H 1 7.660 0.00975 . 1 . . . . . 75 R HN . 50959 1
260 . 1 . 1 75 75 ARG HA H 1 4.116 0 . 1 . . . . . 75 R HA . 50959 1
261 . 1 . 1 75 75 ARG CA C 13 58.194 0.06745 . 1 . . . . . 75 R CA . 50959 1
262 . 1 . 1 75 75 ARG N N 15 119.873 0.15524 . 1 . . . . . 75 R N . 50959 1
263 . 1 . 1 76 76 VAL H H 1 8.314 0.01849 . 1 . . . . . 76 V HN . 50959 1
264 . 1 . 1 76 76 VAL HA H 1 3.611 0.00947 . 1 . . . . . 76 V HA . 50959 1
265 . 1 . 1 76 76 VAL C C 13 177.922 0.03066 . 1 . . . . . 76 V C . 50959 1
266 . 1 . 1 76 76 VAL CA C 13 66.651 0.06400 . 1 . . . . . 76 V CA . 50959 1
267 . 1 . 1 76 76 VAL CB C 13 31.424 0.10548 . 1 . . . . . 76 V CB . 50959 1
268 . 1 . 1 76 76 VAL N N 15 118.085 0.17940 . 1 . . . . . 76 V N . 50959 1
269 . 1 . 1 77 77 GLY H H 1 8.613 0.04272 . 1 . . . . . 77 G HN . 50959 1
270 . 1 . 1 77 77 GLY HA2 H 1 3.509 0.14024 . 1 . . . . . 77 G HA1 . 50959 1
271 . 1 . 1 77 77 GLY HA3 H 1 3.656 0.00844 . 1 . . . . . 77 G HA2 . 50959 1
272 . 1 . 1 77 77 GLY C C 13 174.974 0.04233 . 1 . . . . . 77 G C . 50959 1
273 . 1 . 1 77 77 GLY CA C 13 47.816 0.09439 . 1 . . . . . 77 G CA . 50959 1
274 . 1 . 1 77 77 GLY N N 15 106.339 0.23731 . 1 . . . . . 77 G N . 50959 1
275 . 1 . 1 78 78 GLU H H 1 8.585 0.03884 . 1 . . . . . 78 E HN . 50959 1
276 . 1 . 1 78 78 GLU HA H 1 4.069 0.01221 . 1 . . . . . 78 E HA . 50959 1
277 . 1 . 1 78 78 GLU C C 13 179.742 0.03655 . 1 . . . . . 78 E C . 50959 1
278 . 1 . 1 78 78 GLU CA C 13 58.948 0.09792 . 1 . . . . . 78 E CA . 50959 1
279 . 1 . 1 78 78 GLU CB C 13 29.301 0.03016 . 1 . . . . . 78 E CB . 50959 1
280 . 1 . 1 78 78 GLU N N 15 121.362 0.18898 . 1 . . . . . 78 E N . 50959 1
281 . 1 . 1 79 79 PHE H H 1 8.211 0.05027 . 1 . . . . . 79 F HN . 50959 1
282 . 1 . 1 79 79 PHE HA H 1 4.149 0.00680 . 1 . . . . . 79 F HA . 50959 1
283 . 1 . 1 79 79 PHE C C 13 177.596 0.03866 . 1 . . . . . 79 F C . 50959 1
284 . 1 . 1 79 79 PHE CA C 13 61.947 0.05198 . 1 . . . . . 79 F CA . 50959 1
285 . 1 . 1 79 79 PHE CB C 13 40.671 0.13925 . 1 . . . . . 79 F CB . 50959 1
286 . 1 . 1 79 79 PHE N N 15 121.288 0.10887 . 1 . . . . . 79 F N . 50959 1
287 . 1 . 1 80 80 PHE H H 1 8.585 0.03917 . 1 . . . . . 80 F HN . 50959 1
288 . 1 . 1 80 80 PHE HA H 1 3.996 0.01596 . 1 . . . . . 80 F HA . 50959 1
289 . 1 . 1 80 80 PHE C C 13 175.029 0.07496 . 1 . . . . . 80 F C . 50959 1
290 . 1 . 1 80 80 PHE CA C 13 59.287 0.05608 . 1 . . . . . 80 F CA . 50959 1
291 . 1 . 1 80 80 PHE CB C 13 38.765 0 . 1 . . . . . 80 F CB . 50959 1
292 . 1 . 1 80 80 PHE N N 15 114.143 0.10488 . 1 . . . . . 80 F N . 50959 1
293 . 1 . 1 81 81 GLY H H 1 7.509 0.01195 . 1 . . . . . 81 G HN . 50959 1
294 . 1 . 1 81 81 GLY HA2 H 1 3.691 0.00971 . 1 . . . . . 81 G HA1 . 50959 1
295 . 1 . 1 81 81 GLY HA3 H 1 3.857 0.05374 . 1 . . . . . 81 G HA2 . 50959 1
296 . 1 . 1 81 81 GLY C C 13 174.188 0.00966 . 1 . . . . . 81 G C . 50959 1
297 . 1 . 1 81 81 GLY CA C 13 46.994 0.06088 . 1 . . . . . 81 G CA . 50959 1
298 . 1 . 1 81 81 GLY N N 15 109.707 0.09961 . 1 . . . . . 81 G N . 50959 1
299 . 1 . 1 82 82 ILE H H 1 8.339 0.00458 . 1 . . . . . 82 I HN . 50959 1
300 . 1 . 1 82 82 ILE HA H 1 3.356 0.01279 . 1 . . . . . 82 I HA . 50959 1
301 . 1 . 1 82 82 ILE C C 13 174.497 0.02651 . 1 . . . . . 82 I C . 50959 1
302 . 1 . 1 82 82 ILE CA C 13 58.748 0.03629 . 1 . . . . . 82 I CA . 50959 1
303 . 1 . 1 82 82 ILE CB C 13 36.708 0.17923 . 1 . . . . . 82 I CB . 50959 1
304 . 1 . 1 82 82 ILE N N 15 120.336 0.12077 . 1 . . . . . 82 I N . 50959 1
305 . 1 . 1 83 83 HIS H H 1 7.411 0.02574 . 1 . . . . . 83 H HN . 50959 1
306 . 1 . 1 83 83 HIS N N 15 128.193 0.10450 . 1 . . . . . 83 H N . 50959 1
307 . 1 . 1 106 106 VAL H H 1 9.007 0.02657 . 1 . . . . . 106 V HN . 50959 1
308 . 1 . 1 106 106 VAL HA H 1 4.677 0.02782 . 1 . . . . . 106 V HA . 50959 1
309 . 1 . 1 106 106 VAL HG11 H 1 0.962 0.13189 . 1 . . . . . 106 V QG1 . 50959 1
310 . 1 . 1 106 106 VAL HG12 H 1 0.962 0.13189 . 1 . . . . . 106 V QG1 . 50959 1
311 . 1 . 1 106 106 VAL HG13 H 1 0.962 0.13189 . 1 . . . . . 106 V QG1 . 50959 1
312 . 1 . 1 106 106 VAL C C 13 173.627 0.06592 . 1 . . . . . 106 V C . 50959 1
313 . 1 . 1 106 106 VAL CA C 13 61.232 0.08567 . 1 . . . . . 106 V CA . 50959 1
314 . 1 . 1 106 106 VAL CB C 13 31.771 0.10184 . 1 . . . . . 106 V CB . 50959 1
315 . 1 . 1 106 106 VAL CG1 C 13 22.387 0.01506 . 1 . . . . . 106 V CG1 . 50959 1
316 . 1 . 1 106 106 VAL N N 15 114.537 0 . 1 . . . . . 106 V N . 50959 1
317 . 1 . 1 107 107 PHE H H 1 9.074 0.02894 . 1 . . . . . 107 F HN . 50959 1
318 . 1 . 1 107 107 PHE HA H 1 5.926 0.02659 . 1 . . . . . 107 F HA . 50959 1
319 . 1 . 1 107 107 PHE C C 13 172.659 0.06005 . 1 . . . . . 107 F C . 50959 1
320 . 1 . 1 107 107 PHE CA C 13 54.231 0.03044 . 1 . . . . . 107 F CA . 50959 1
321 . 1 . 1 107 107 PHE CB C 13 42.834 0.09075 . 1 . . . . . 107 F CB . 50959 1
322 . 1 . 1 107 107 PHE N N 15 128.070 0.14670 . 1 . . . . . 107 F N . 50959 1
323 . 1 . 1 108 108 ILE H H 1 9.281 0.02414 . 1 . . . . . 108 I HN . 50959 1
324 . 1 . 1 108 108 ILE HA H 1 4.675 0.01906 . 1 . . . . . 108 I HA . 50959 1
325 . 1 . 1 108 108 ILE C C 13 173.203 0.08662 . 1 . . . . . 108 I C . 50959 1
326 . 1 . 1 108 108 ILE CA C 13 59.640 0.04021 . 1 . . . . . 108 I CA . 50959 1
327 . 1 . 1 108 108 ILE CB C 13 43.140 0.14489 . 1 . . . . . 108 I CB . 50959 1
328 . 1 . 1 108 108 ILE CG2 C 13 18.405 0 . 1 . . . . . 108 I CG2 . 50959 1
329 . 1 . 1 108 108 ILE N N 15 128.262 0.25508 . 1 . . . . . 108 I N . 50959 1
330 . 1 . 1 109 109 VAL H H 1 8.235 0.01353 . 1 . . . . . 109 V HN . 50959 1
331 . 1 . 1 109 109 VAL HA H 1 4.218 0.01357 . 1 . . . . . 109 V HA . 50959 1
332 . 1 . 1 109 109 VAL C C 13 174.216 0.06605 . 1 . . . . . 109 V C . 50959 1
333 . 1 . 1 109 109 VAL CA C 13 62.046 0.07710 . 1 . . . . . 109 V CA . 50959 1
334 . 1 . 1 109 109 VAL CB C 13 33.831 0.17285 . 1 . . . . . 109 V CB . 50959 1
335 . 1 . 1 109 109 VAL CG1 C 13 21.596 0.08343 . 1 . . . . . 109 V CG1 . 50959 1
336 . 1 . 1 109 109 VAL N N 15 126.148 0.16310 . 1 . . . . . 109 V N . 50959 1
337 . 1 . 1 110 110 LEU H H 1 8.659 0.04662 . 1 . . . . . 110 L HN . 50959 1
338 . 1 . 1 110 110 LEU HA H 1 4.614 0.01242 . 1 . . . . . 110 L HA . 50959 1
339 . 1 . 1 110 110 LEU C C 13 175.033 0.02417 . 1 . . . . . 110 L C . 50959 1
340 . 1 . 1 110 110 LEU CA C 13 52.537 0.06803 . 1 . . . . . 110 L CA . 50959 1
341 . 1 . 1 110 110 LEU CB C 13 46.460 0.16692 . 1 . . . . . 110 L CB . 50959 1
342 . 1 . 1 110 110 LEU CG C 13 26.749 0 . 1 . . . . . 110 L CG . 50959 1
343 . 1 . 1 110 110 LEU N N 15 122.106 0.16406 . 1 . . . . . 110 L N . 50959 1
344 . 1 . 1 127 127 VAL C C 13 173.698 0 . 1 . . . . . 127 V C . 50959 1
345 . 1 . 1 128 128 SER H H 1 8.526 0.02552 . 1 . . . . . 128 S HN . 50959 1
346 . 1 . 1 128 128 SER HA H 1 5.655 0.02327 . 1 . . . . . 128 S HA . 50959 1
347 . 1 . 1 128 128 SER C C 13 173.537 0.10153 . 1 . . . . . 128 S C . 50959 1
348 . 1 . 1 128 128 SER CA C 13 57.751 0.13313 . 1 . . . . . 128 S CA . 50959 1
349 . 1 . 1 128 128 SER CB C 13 66.193 0.13338 . 1 . . . . . 128 S CB . 50959 1
350 . 1 . 1 128 128 SER N N 15 121.294 0.17181 . 1 . . . . . 128 S N . 50959 1
351 . 1 . 1 129 129 LEU H H 1 9.770 0.03273 . 1 . . . . . 129 L HN . 50959 1
352 . 1 . 1 129 129 LEU HA H 1 5.743 0.02018 . 1 . . . . . 129 L HA . 50959 1
353 . 1 . 1 129 129 LEU C C 13 175.586 0.02922 . 1 . . . . . 129 L C . 50959 1
354 . 1 . 1 129 129 LEU CA C 13 53.606 0.09149 . 1 . . . . . 129 L CA . 50959 1
355 . 1 . 1 129 129 LEU CB C 13 46.158 0.07632 . 1 . . . . . 129 L CB . 50959 1
356 . 1 . 1 129 129 LEU CG C 13 26.687 0 . 1 . . . . . 129 L CG . 50959 1
357 . 1 . 1 129 129 LEU N N 15 123.019 0.17034 . 1 . . . . . 129 L N . 50959 1
358 . 1 . 1 130 130 ILE H H 1 9.463 0.03072 . 1 . . . . . 130 I HN . 50959 1
359 . 1 . 1 130 130 ILE HA H 1 5.534 0.02509 . 1 . . . . . 130 I HA . 50959 1
360 . 1 . 1 130 130 ILE HB H 1 1.312 0 . 1 . . . . . 130 I HB . 50959 1
361 . 1 . 1 130 130 ILE C C 13 175.128 0.02183 . 1 . . . . . 130 I C . 50959 1
362 . 1 . 1 130 130 ILE CA C 13 59.048 0.08713 . 1 . . . . . 130 I CA . 50959 1
363 . 1 . 1 130 130 ILE CB C 13 41.755 0.14587 . 1 . . . . . 130 I CB . 50959 1
364 . 1 . 1 130 130 ILE CG2 C 13 17.541 0 . 1 . . . . . 130 I CG2 . 50959 1
365 . 1 . 1 130 130 ILE N N 15 120.741 0.17521 . 1 . . . . . 130 I N . 50959 1
366 . 1 . 1 131 131 LEU H H 1 8.755 0.03104 . 1 . . . . . 131 L HN . 50959 1
367 . 1 . 1 131 131 LEU HA H 1 5.363 0.02202 . 1 . . . . . 131 L HA . 50959 1
368 . 1 . 1 131 131 LEU C C 13 175.448 0 . 1 . . . . . 131 L C . 50959 1
369 . 1 . 1 131 131 LEU CA C 13 53.499 0.04849 . 1 . . . . . 131 L CA . 50959 1
370 . 1 . 1 131 131 LEU CB C 13 45.301 0.15431 . 1 . . . . . 131 L CB . 50959 1
371 . 1 . 1 131 131 LEU N N 15 128.852 0.17449 . 1 . . . . . 131 L N . 50959 1
372 . 1 . 1 135 135 CYS HA H 1 4.051 0 . 1 . . . . . 135 C HA . 50959 1
373 . 1 . 1 135 135 CYS C C 13 174.067 0.12134 . 1 . . . . . 135 C C . 50959 1
374 . 1 . 1 135 135 CYS CA C 13 57.356 0.06710 . 1 . . . . . 135 C CA . 50959 1
375 . 1 . 1 136 136 VAL H H 1 8.674 0.02660 . 1 . . . . . 136 V HN . 50959 1
376 . 1 . 1 136 136 VAL HA H 1 4.863 0.04155 . 1 . . . . . 136 V HA . 50959 1
377 . 1 . 1 136 136 VAL C C 13 175.441 0.05633 . 1 . . . . . 136 V C . 50959 1
378 . 1 . 1 136 136 VAL CA C 13 62.211 0.06955 . 1 . . . . . 136 V CA . 50959 1
379 . 1 . 1 136 136 VAL CB C 13 33.447 0.09716 . 1 . . . . . 136 V CB . 50959 1
380 . 1 . 1 136 136 VAL CG1 C 13 21.775 0 . 1 . . . . . 136 V CG1 . 50959 1
381 . 1 . 1 136 136 VAL N N 15 119.353 0.09012 . 1 . . . . . 136 V N . 50959 1
382 . 1 . 1 137 137 LEU H H 1 9.369 0.03820 . 1 . . . . . 137 L HN . 50959 1
383 . 1 . 1 137 137 LEU HA H 1 4.621 0.02249 . 1 . . . . . 137 L HA . 50959 1
384 . 1 . 1 137 137 LEU C C 13 173.772 0.03782 . 1 . . . . . 137 L C . 50959 1
385 . 1 . 1 137 137 LEU CA C 13 53.247 0.08423 . 1 . . . . . 137 L CA . 50959 1
386 . 1 . 1 137 137 LEU CB C 13 43.549 0.09275 . 1 . . . . . 137 L CB . 50959 1
387 . 1 . 1 137 137 LEU CG C 13 27.571 0 . 1 . . . . . 137 L CG . 50959 1
388 . 1 . 1 137 137 LEU N N 15 127.145 0.09482 . 1 . . . . . 137 L N . 50959 1
389 . 1 . 1 138 138 MET H H 1 9.192 0.01387 . 1 . . . . . 138 M HN . 50959 1
390 . 1 . 1 138 138 MET HA H 1 5.311 0.02682 . 1 . . . . . 138 M HA . 50959 1
391 . 1 . 1 138 138 MET HB2 H 1 2.071 0 . 1 . . . . . 138 M HB2 . 50959 1
392 . 1 . 1 138 138 MET C C 13 172.250 0.01852 . 1 . . . . . 138 M C . 50959 1
393 . 1 . 1 138 138 MET CA C 13 52.996 0.06374 . 1 . . . . . 138 M CA . 50959 1
394 . 1 . 1 138 138 MET CB C 13 37.750 0.14214 . 1 . . . . . 138 M CB . 50959 1
395 . 1 . 1 138 138 MET CG C 13 32.446 0.10781 . 1 . . . . . 138 M CG . 50959 1
396 . 1 . 1 138 138 MET N N 15 125.013 0.12073 . 1 . . . . . 138 M N . 50959 1
397 . 1 . 1 139 139 PHE H H 1 9.156 0.02922 . 1 . . . . . 139 F HN . 50959 1
398 . 1 . 1 139 139 PHE HA H 1 5.390 0.02242 . 1 . . . . . 139 F HA . 50959 1
399 . 1 . 1 139 139 PHE C C 13 177.007 0 . 1 . . . . . 139 F C . 50959 1
400 . 1 . 1 139 139 PHE CA C 13 55.662 0.09413 . 1 . . . . . 139 F CA . 50959 1
401 . 1 . 1 139 139 PHE CB C 13 41.041 0.06477 . 1 . . . . . 139 F CB . 50959 1
402 . 1 . 1 139 139 PHE N N 15 123.452 0.10142 . 1 . . . . . 139 F N . 50959 1
403 . 1 . 1 142 142 LYS C C 13 176.145 0.06163 . 1 . . . . . 142 K C . 50959 1
404 . 1 . 1 143 143 ILE H H 1 8.780 0.04764 . 1 . . . . . 143 I HN . 50959 1
405 . 1 . 1 143 143 ILE HA H 1 3.478 0.01706 . 1 . . . . . 143 I HA . 50959 1
406 . 1 . 1 143 143 ILE C C 13 176.242 0.02595 . 1 . . . . . 143 I C . 50959 1
407 . 1 . 1 143 143 ILE CA C 13 63.121 0.03974 . 1 . . . . . 143 I CA . 50959 1
408 . 1 . 1 143 143 ILE CB C 13 37.649 0.25824 . 1 . . . . . 143 I CB . 50959 1
409 . 1 . 1 143 143 ILE N N 15 123.640 0.17315 . 1 . . . . . 143 I N . 50959 1
410 . 1 . 1 144 144 GLY H H 1 8.306 0.02839 . 1 . . . . . 144 G HN . 50959 1
411 . 1 . 1 144 144 GLY HA2 H 1 4.280 0.00341 . 1 . . . . . 144 G HA1 . 50959 1
412 . 1 . 1 144 144 GLY C C 13 172.997 0.03178 . 1 . . . . . 144 G C . 50959 1
413 . 1 . 1 144 144 GLY CA C 13 44.738 0.05877 . 1 . . . . . 144 G CA . 50959 1
414 . 1 . 1 144 144 GLY N N 15 119.070 0.21088 . 1 . . . . . 144 G N . 50959 1
415 . 1 . 1 145 145 ASP H H 1 8.330 0.01419 . 1 . . . . . 145 D HN . 50959 1
416 . 1 . 1 145 145 ASP HA H 1 4.603 0.02508 . 1 . . . . . 145 D HA . 50959 1
417 . 1 . 1 145 145 ASP C C 13 175.950 0 . 1 . . . . . 145 D C . 50959 1
418 . 1 . 1 145 145 ASP CA C 13 53.488 0.04349 . 1 . . . . . 145 D CA . 50959 1
419 . 1 . 1 145 145 ASP CB C 13 42.846 0.21801 . 1 . . . . . 145 D CB . 50959 1
420 . 1 . 1 145 145 ASP N N 15 122.973 0.20247 . 1 . . . . . 145 D N . 50959 1
421 . 1 . 1 149 149 PRO HA H 1 4.268 0.00355 . 1 . . . . . 149 P HA . 50959 1
422 . 1 . 1 149 149 PRO C C 13 179.395 0.03477 . 1 . . . . . 149 P C . 50959 1
423 . 1 . 1 149 149 PRO CA C 13 66.357 0.06790 . 1 . . . . . 149 P CA . 50959 1
424 . 1 . 1 149 149 PRO CB C 13 32.153 0.19104 . 1 . . . . . 149 P CB . 50959 1
425 . 1 . 1 150 150 VAL H H 1 7.112 0.04720 . 1 . . . . . 150 V HN . 50959 1
426 . 1 . 1 150 150 VAL HA H 1 3.291 0.02303 . 1 . . . . . 150 V HA . 50959 1
427 . 1 . 1 150 150 VAL C C 13 177.092 0.00240 . 1 . . . . . 150 V C . 50959 1
428 . 1 . 1 150 150 VAL CA C 13 66.204 0.05874 . 1 . . . . . 150 V CA . 50959 1
429 . 1 . 1 150 150 VAL CB C 13 31.375 0.18208 . 1 . . . . . 150 V CB . 50959 1
430 . 1 . 1 150 150 VAL N N 15 115.319 0.25077 . 1 . . . . . 150 V N . 50959 1
431 . 1 . 1 151 151 ARG H H 1 7.633 0.02599 . 1 . . . . . 151 R HN . 50959 1
432 . 1 . 1 151 151 ARG HA H 1 3.747 0.01762 . 1 . . . . . 151 R HA . 50959 1
433 . 1 . 1 151 151 ARG C C 13 178.611 0.03475 . 1 . . . . . 151 R C . 50959 1
434 . 1 . 1 151 151 ARG CA C 13 60.681 0.08489 . 1 . . . . . 151 R CA . 50959 1
435 . 1 . 1 151 151 ARG CB C 13 29.640 0.16578 . 1 . . . . . 151 R CB . 50959 1
436 . 1 . 1 151 151 ARG N N 15 118.016 0.20296 . 1 . . . . . 151 R N . 50959 1
437 . 1 . 1 152 152 GLU H H 1 8.358 0.03682 . 1 . . . . . 152 E HN . 50959 1
438 . 1 . 1 152 152 GLU HA H 1 3.740 0.01712 . 1 . . . . . 152 E HA . 50959 1
439 . 1 . 1 152 152 GLU C C 13 178.012 0.04313 . 1 . . . . . 152 E C . 50959 1
440 . 1 . 1 152 152 GLU CA C 13 59.275 0.16425 . 1 . . . . . 152 E CA . 50959 1
441 . 1 . 1 152 152 GLU CB C 13 29.828 0.05836 . 1 . . . . . 152 E CB . 50959 1
442 . 1 . 1 152 152 GLU N N 15 115.537 0.11592 . 1 . . . . . 152 E N . 50959 1
443 . 1 . 1 153 153 ARG H H 1 7.435 0.01762 . 1 . . . . . 153 R HN . 50959 1
444 . 1 . 1 153 153 ARG CA C 13 49.263 0 . 1 . . . . . 153 R CA . 50959 1
445 . 1 . 1 153 153 ARG CB C 13 29.729 0 . 1 . . . . . 153 R CB . 50959 1
446 . 1 . 1 153 153 ARG N N 15 118.160 0.03051 . 1 . . . . . 153 R N . 50959 1
447 . 1 . 1 164 164 LYS H H 1 7.081 0.000043 . 1 . . . . . 164 K HN . 50959 1
448 . 1 . 1 164 164 LYS HA H 1 4.613 0.01314 . 1 . . . . . 164 K HA . 50959 1
449 . 1 . 1 164 164 LYS CA C 13 52.868 0.07378 . 1 . . . . . 164 K CA . 50959 1
450 . 1 . 1 164 164 LYS CB C 13 34.735 0 . 1 . . . . . 164 K CB . 50959 1
451 . 1 . 1 164 164 LYS N N 15 119.336 0.11175 . 1 . . . . . 164 K N . 50959 1
452 . 1 . 1 165 165 ARG H H 1 8.613 0.02425 . 1 . . . . . 165 R HN . 50959 1
453 . 1 . 1 165 165 ARG HA H 1 4.553 0.01100 . 1 . . . . . 165 R HA . 50959 1
454 . 1 . 1 165 165 ARG C C 13 178.649 0.02682 . 1 . . . . . 165 R C . 50959 1
455 . 1 . 1 165 165 ARG CA C 13 56.068 0.07152 . 1 . . . . . 165 R CA . 50959 1
456 . 1 . 1 165 165 ARG CB C 13 30.280 0.12309 . 1 . . . . . 165 R CB . 50959 1
457 . 1 . 1 165 165 ARG N N 15 118.180 0.08147 . 1 . . . . . 165 R N . 50959 1
458 . 1 . 1 166 166 ALA H H 1 9.143 0.01759 . 1 . . . . . 166 A HN . 50959 1
459 . 1 . 1 166 166 ALA HA H 1 4.005 0.01656 . 1 . . . . . 166 A HA . 50959 1
460 . 1 . 1 166 166 ALA C C 13 177.285 0.03242 . 1 . . . . . 166 A C . 50959 1
461 . 1 . 1 166 166 ALA CA C 13 55.320 0.08309 . 1 . . . . . 166 A CA . 50959 1
462 . 1 . 1 166 166 ALA CB C 13 17.696 0.10612 . 1 . . . . . 166 A CB . 50959 1
463 . 1 . 1 166 166 ALA N N 15 123.159 0.18300 . 1 . . . . . 166 A N . 50959 1
464 . 1 . 1 167 167 ASP H H 1 9.148 0.03200 . 1 . . . . . 167 D HN . 50959 1
465 . 1 . 1 167 167 ASP HA H 1 4.194 0.00954 . 1 . . . . . 167 D HA . 50959 1
466 . 1 . 1 167 167 ASP C C 13 177.463 0.06051 . 1 . . . . . 167 D C . 50959 1
467 . 1 . 1 167 167 ASP CA C 13 56.947 0.05635 . 1 . . . . . 167 D CA . 50959 1
468 . 1 . 1 167 167 ASP CB C 13 40.385 0.14091 . 1 . . . . . 167 D CB . 50959 1
469 . 1 . 1 167 167 ASP N N 15 117.016 0.11900 . 1 . . . . . 167 D N . 50959 1
470 . 1 . 1 168 168 TYR H H 1 7.571 0.01795 . 1 . . . . . 168 Y HN . 50959 1
471 . 1 . 1 168 168 TYR HA H 1 3.957 0.02013 . 1 . . . . . 168 Y HA . 50959 1
472 . 1 . 1 168 168 TYR C C 13 178.468 0.04203 . 1 . . . . . 168 Y C . 50959 1
473 . 1 . 1 168 168 TYR CA C 13 61.217 0.03656 . 1 . . . . . 168 Y CA . 50959 1
474 . 1 . 1 168 168 TYR CB C 13 39.457 0.16997 . 1 . . . . . 168 Y CB . 50959 1
475 . 1 . 1 168 168 TYR N N 15 123.973 0.11846 . 1 . . . . . 168 Y N . 50959 1
476 . 1 . 1 169 169 LEU H H 1 7.317 0.03446 . 1 . . . . . 169 L HN . 50959 1
477 . 1 . 1 169 169 LEU HA H 1 3.742 0.00561 . 1 . . . . . 169 L HA . 50959 1
478 . 1 . 1 169 169 LEU C C 13 177.212 0.05648 . 1 . . . . . 169 L C . 50959 1
479 . 1 . 1 169 169 LEU CA C 13 58.487 0.10620 . 1 . . . . . 169 L CA . 50959 1
480 . 1 . 1 169 169 LEU CB C 13 38.577 0.09315 . 1 . . . . . 169 L CB . 50959 1
481 . 1 . 1 169 169 LEU N N 15 125.630 0.18922 . 1 . . . . . 169 L N . 50959 1
482 . 1 . 1 170 170 LEU H H 1 8.054 0.01275 . 1 . . . . . 170 L HN . 50959 1
483 . 1 . 1 170 170 LEU C C 13 177.951 0.05236 . 1 . . . . . 170 L C . 50959 1
484 . 1 . 1 170 170 LEU CA C 13 58.755 0.06329 . 1 . . . . . 170 L CA . 50959 1
485 . 1 . 1 170 170 LEU CB C 13 40.960 0.04500 . 1 . . . . . 170 L CB . 50959 1
486 . 1 . 1 170 170 LEU N N 15 118.561 0.10128 . 1 . . . . . 170 L N . 50959 1
487 . 1 . 1 171 171 TYR H H 1 7.710 0.03691 . 1 . . . . . 171 Y HN . 50959 1
488 . 1 . 1 171 171 TYR CA C 13 57.957 0 . 1 . . . . . 171 Y CA . 50959 1
489 . 1 . 1 171 171 TYR N N 15 120.922 0.05747 . 1 . . . . . 171 Y N . 50959 1
490 . 1 . 1 175 175 ASP H H 1 8.593 0 . 1 . . . . . 175 D HN . 50959 1
491 . 1 . 1 175 175 ASP HA H 1 4.320 0.02123 . 1 . . . . . 175 D HA . 50959 1
492 . 1 . 1 175 175 ASP C C 13 179.967 0 . 1 . . . . . 175 D C . 50959 1
493 . 1 . 1 175 175 ASP CA C 13 57.164 0.09658 . 1 . . . . . 175 D CA . 50959 1
494 . 1 . 1 175 175 ASP CB C 13 40.342 0 . 1 . . . . . 175 D CB . 50959 1
495 . 1 . 1 175 175 ASP N N 15 118.175 0.04612 . 1 . . . . . 175 D N . 50959 1
496 . 1 . 1 176 176 ALA H H 1 7.412 0.04569 . 1 . . . . . 176 A HN . 50959 1
497 . 1 . 1 176 176 ALA HA H 1 4.063 0.02554 . 1 . . . . . 176 A HA . 50959 1
498 . 1 . 1 176 176 ALA C C 13 180.112 0.02471 . 1 . . . . . 176 A C . 50959 1
499 . 1 . 1 176 176 ALA CA C 13 54.947 0.03888 . 1 . . . . . 176 A CA . 50959 1
500 . 1 . 1 176 176 ALA CB C 13 17.589 0.01684 . 1 . . . . . 176 A CB . 50959 1
501 . 1 . 1 176 176 ALA N N 15 119.552 0.17443 . 1 . . . . . 176 A N . 50959 1
502 . 1 . 1 177 177 LEU N N 15 120.336 0 . 1 . . . . . 177 L N . 50959 1
503 . 1 . 1 243 243 ILE H H 1 7.782 0.01243 . 1 . . . . . 243 I HN . 50959 1
504 . 1 . 1 243 243 ILE HA H 1 4.244 0.01440 . 1 . . . . . 243 I HA . 50959 1
505 . 1 . 1 243 243 ILE C C 13 175.611 0.06262 . 1 . . . . . 243 I C . 50959 1
506 . 1 . 1 243 243 ILE CA C 13 59.828 0.16722 . 1 . . . . . 243 I CA . 50959 1
507 . 1 . 1 243 243 ILE CB C 13 38.665 0 . 1 . . . . . 243 I CB . 50959 1
508 . 1 . 1 243 243 ILE N N 15 119.455 0.24619 . 1 . . . . . 243 I N . 50959 1
509 . 1 . 1 244 244 GLU H H 1 8.752 0.01445 . 1 . . . . . 244 E HN . 50959 1
510 . 1 . 1 244 244 GLU HA H 1 4.185 0.01131 . 1 . . . . . 244 E HA . 50959 1
511 . 1 . 1 244 244 GLU C C 13 178.931 0.08502 . 1 . . . . . 244 E C . 50959 1
512 . 1 . 1 244 244 GLU CA C 13 56.225 0.06074 . 1 . . . . . 244 E CA . 50959 1
513 . 1 . 1 244 244 GLU CB C 13 29.649 0.05118 . 1 . . . . . 244 E CB . 50959 1
514 . 1 . 1 244 244 GLU CG C 13 36.301 0 . 1 . . . . . 244 E CG . 50959 1
515 . 1 . 1 244 244 GLU N N 15 125.817 0.21504 . 1 . . . . . 244 E N . 50959 1
516 . 1 . 1 245 245 LYS H H 1 8.664 0.02187 . 1 . . . . . 245 K HN . 50959 1
517 . 1 . 1 245 245 LYS HA H 1 3.818 0 . 1 . . . . . 245 K HA . 50959 1
518 . 1 . 1 245 245 LYS C C 13 180.549 0 . 1 . . . . . 245 K C . 50959 1
519 . 1 . 1 245 245 LYS CA C 13 60.342 0.27358 . 1 . . . . . 245 K CA . 50959 1
520 . 1 . 1 245 245 LYS N N 15 122.367 0.08791 . 1 . . . . . 245 K N . 50959 1
521 . 1 . 1 246 246 GLU H H 1 8.709 0.03433 . 1 . . . . . 246 E HN . 50959 1
522 . 1 . 1 246 246 GLU HA H 1 4.192 0.01625 . 1 . . . . . 246 E HA . 50959 1
523 . 1 . 1 246 246 GLU C C 13 177.053 0.01315 . 1 . . . . . 246 E C . 50959 1
524 . 1 . 1 246 246 GLU CA C 13 58.751 0.04290 . 1 . . . . . 246 E CA . 50959 1
525 . 1 . 1 246 246 GLU N N 15 115.819 0.20461 . 1 . . . . . 246 E N . 50959 1
526 . 1 . 1 247 247 THR H H 1 8.133 0.02284 . 1 . . . . . 247 T HN . 50959 1
527 . 1 . 1 247 247 THR HA H 1 4.389 0.00843 . 1 . . . . . 247 T HA . 50959 1
528 . 1 . 1 247 247 THR C C 13 174.926 0 . 1 . . . . . 247 T C . 50959 1
529 . 1 . 1 247 247 THR CA C 13 62.821 0.04304 . 1 . . . . . 247 T CA . 50959 1
530 . 1 . 1 247 247 THR CB C 13 68.017 0.15237 . 1 . . . . . 247 T CB . 50959 1
531 . 1 . 1 248 248 VAL HA H 1 3.882 0.000 . 1 . . . . . 248 V HA . 50959 1
532 . 1 . 1 248 248 VAL C C 13 174.504 0 . 1 . . . . . 248 V C . 50959 1
533 . 1 . 1 248 248 VAL CB C 13 29.861 0.000 . 1 . . . . . 248 V CB . 50959 1
534 . 1 . 1 261 261 ILE H H 1 8.399 0.000 . 1 . . . . . 261 I HN . 50959 1
535 . 1 . 1 261 261 ILE C C 13 177.257 0.000 . 1 . . . . . 261 I C . 50959 1
536 . 1 . 1 261 261 ILE CA C 13 64.947 0.000 . 1 . . . . . 261 I CA . 50959 1
537 . 1 . 1 261 261 ILE CB C 13 37.202 0.000 . 1 . . . . . 261 I CB . 50959 1
538 . 1 . 1 261 261 ILE N N 15 121.365 0.000 . 1 . . . . . 261 I N . 50959 1
539 . 1 . 1 262 262 ALA H H 1 8.268 0.000 . 1 . . . . . 262 A HN . 50959 1
540 . 1 . 1 262 262 ALA C C 13 179.111 0.000 . 1 . . . . . 262 A C . 50959 1
541 . 1 . 1 262 262 ALA CA C 13 55.239 0.000 . 1 . . . . . 262 A CA . 50959 1
542 . 1 . 1 262 262 ALA CB C 13 16.442 0.000 . 1 . . . . . 262 A CB . 50959 1
543 . 1 . 1 262 262 ALA N N 15 123.210 0.000 . 1 . . . . . 262 A N . 50959 1
544 . 1 . 1 263 263 ASP H H 1 8.788 0.000 . 1 . . . . . 263 D HN . 50959 1
545 . 1 . 1 263 263 ASP C C 13 180.097 0.000 . 1 . . . . . 263 D C . 50959 1
546 . 1 . 1 263 263 ASP CA C 13 56.812 0.000 . 1 . . . . . 263 D CA . 50959 1
547 . 1 . 1 263 263 ASP CB C 13 39.712 0.000 . 1 . . . . . 263 D CB . 50959 1
548 . 1 . 1 263 263 ASP N N 15 117.880 0.000 . 1 . . . . . 263 D N . 50959 1
549 . 1 . 1 264 264 THR H H 1 8.074 0.000 . 1 . . . . . 264 T HN . 50959 1
550 . 1 . 1 264 264 THR CA C 13 56.762 0.000 . 1 . . . . . 264 T CA . 50959 1
551 . 1 . 1 264 264 THR N N 15 118.176 0.000 . 1 . . . . . 264 T N . 50959 1
552 . 1 . 1 265 265 VAL H H 1 8.249 0.000 . 1 . . . . . 265 V HN . 50959 1
553 . 1 . 1 265 265 VAL C C 13 177.390 0.000 . 1 . . . . . 265 V C . 50959 1
554 . 1 . 1 265 265 VAL CA C 13 65.921 0.000 . 1 . . . . . 265 V CA . 50959 1
555 . 1 . 1 265 265 VAL CB C 13 30.399 0.000 . 1 . . . . . 265 V CB . 50959 1
556 . 1 . 1 265 265 VAL N N 15 121.051 0.000 . 1 . . . . . 265 V N . 50959 1
557 . 1 . 1 266 266 GLU H H 1 7.790 0.000 . 1 . . . . . 266 E HN . 50959 1
558 . 1 . 1 266 266 GLU C C 13 179.689 0.000 . 1 . . . . . 266 E C . 50959 1
559 . 1 . 1 266 266 GLU CA C 13 58.785 0.000 . 1 . . . . . 266 E CA . 50959 1
560 . 1 . 1 266 266 GLU CB C 13 28.090 0.000 . 1 . . . . . 266 E CB . 50959 1
561 . 1 . 1 266 266 GLU N N 15 121.662 0.000 . 1 . . . . . 266 E N . 50959 1
562 . 1 . 1 267 267 THR H H 1 7.843 0.000 . 1 . . . . . 267 T HN . 50959 1
563 . 1 . 1 267 267 THR CA C 13 66.036 0.000 . 1 . . . . . 267 T CA . 50959 1
564 . 1 . 1 267 267 THR N N 15 114.755 0.000 . 1 . . . . . 267 T N . 50959 1
565 . 1 . 1 298 298 ALA H H 1 8.882 0.03000 . 1 . . . . . 298 A HN . 50959 1
566 . 1 . 1 298 298 ALA HA H 1 4.254 0.02354 . 1 . . . . . 298 A HA . 50959 1
567 . 1 . 1 298 298 ALA HB1 H 1 2.129 0.15497 . 1 . . . . . 298 A HB# . 50959 1
568 . 1 . 1 298 298 ALA HB2 H 1 2.129 0.15497 . 1 . . . . . 298 A HB# . 50959 1
569 . 1 . 1 298 298 ALA HB3 H 1 2.129 0.15497 . 1 . . . . . 298 A HB# . 50959 1
570 . 1 . 1 298 298 ALA C C 13 179.577 0 . 1 . . . . . 298 A C . 50959 1
571 . 1 . 1 298 298 ALA CA C 13 55.751 0.08988 . 1 . . . . . 298 A CA . 50959 1
572 . 1 . 1 298 298 ALA CB C 13 18.635 0.17263 . 1 . . . . . 298 A CB . 50959 1
573 . 1 . 1 298 298 ALA N N 15 121.371 0 . 1 . . . . . 298 A N . 50959 1
574 . 1 . 1 305 305 THR H H 1 8.296 0.02414 . 1 . . . . . 305 T HN . 50959 1
575 . 1 . 1 305 305 THR HA H 1 4.074 0.01354 . 1 . . . . . 305 T HA . 50959 1
576 . 1 . 1 305 305 THR C C 13 176.751 0.08419 . 1 . . . . . 305 T C . 50959 1
577 . 1 . 1 305 305 THR CA C 13 67.776 0.05612 . 1 . . . . . 305 T CA . 50959 1
578 . 1 . 1 305 305 THR CB C 13 68.750 0.13087 . 1 . . . . . 305 T CB . 50959 1
579 . 1 . 1 305 305 THR N N 15 116.249 0.12560 . 1 . . . . . 305 T N . 50959 1
580 . 1 . 1 306 306 PHE H H 1 7.788 0.02682 . 1 . . . . . 306 F HN . 50959 1
581 . 1 . 1 306 306 PHE HA H 1 4.449 0.02002 . 1 . . . . . 306 F HA . 50959 1
582 . 1 . 1 306 306 PHE C C 13 175.355 0.01844 . 1 . . . . . 306 F C . 50959 1
583 . 1 . 1 306 306 PHE CA C 13 60.931 0.05296 . 1 . . . . . 306 F CA . 50959 1
584 . 1 . 1 306 306 PHE CB C 13 39.568 0 . 1 . . . . . 306 F CB . 50959 1
585 . 1 . 1 306 306 PHE N N 15 124.167 0.10520 . 1 . . . . . 306 F N . 50959 1
586 . 1 . 1 307 307 ILE H H 1 7.828 0.03588 . 1 . . . . . 307 I HN . 50959 1
587 . 1 . 1 307 307 ILE HA H 1 3.057 0.01217 . 1 . . . . . 307 I HA . 50959 1
588 . 1 . 1 307 307 ILE C C 13 177.065 0.04713 . 1 . . . . . 307 I C . 50959 1
589 . 1 . 1 307 307 ILE CA C 13 65.969 0.12779 . 1 . . . . . 307 I CA . 50959 1
590 . 1 . 1 307 307 ILE CB C 13 37.739 0.09365 . 1 . . . . . 307 I CB . 50959 1
591 . 1 . 1 307 307 ILE N N 15 119.575 0.12570 . 1 . . . . . 307 I N . 50959 1
592 . 1 . 1 308 308 ALA H H 1 7.787 0.02723 . 1 . . . . . 308 A HN . 50959 1
593 . 1 . 1 308 308 ALA HA H 1 4.334 0.02231 . 1 . . . . . 308 A HA . 50959 1
594 . 1 . 1 308 308 ALA C C 13 181.074 0.05691 . 1 . . . . . 308 A C . 50959 1
595 . 1 . 1 308 308 ALA CA C 13 54.859 0.02418 . 1 . . . . . 308 A CA . 50959 1
596 . 1 . 1 308 308 ALA CB C 13 16.020 0.16492 . 1 . . . . . 308 A CB . 50959 1
597 . 1 . 1 308 308 ALA N N 15 118.550 0.16784 . 1 . . . . . 308 A N . 50959 1
598 . 1 . 1 309 309 GLY H H 1 8.248 0.06045 . 1 . . . . . 309 G HN . 50959 1
599 . 1 . 1 309 309 GLY HA2 H 1 3.610 0.01186 . 1 . . . . . 309 G HA1 . 50959 1
600 . 1 . 1 309 309 GLY HA3 H 1 3.511 0.01661 . 1 . . . . . 309 G HA2 . 50959 1
601 . 1 . 1 309 309 GLY C C 13 177.518 0.06615 . 1 . . . . . 309 G C . 50959 1
602 . 1 . 1 309 309 GLY CA C 13 47.315 0.17603 . 1 . . . . . 309 G CA . 50959 1
603 . 1 . 1 309 309 GLY N N 15 108.485 0.18791 . 1 . . . . . 309 G N . 50959 1
604 . 1 . 1 310 310 ILE H H 1 8.108 0.02464 . 1 . . . . . 310 I HN . 50959 1
605 . 1 . 1 310 310 ILE HA H 1 3.405 0.03029 . 1 . . . . . 310 I HA . 50959 1
606 . 1 . 1 310 310 ILE C C 13 177.793 0.01328 . 1 . . . . . 310 I C . 50959 1
607 . 1 . 1 310 310 ILE CA C 13 64.620 0.08953 . 1 . . . . . 310 I CA . 50959 1
608 . 1 . 1 310 310 ILE CB C 13 36.416 0.12446 . 1 . . . . . 310 I CB . 50959 1
609 . 1 . 1 310 310 ILE N N 15 126.107 0.17077 . 1 . . . . . 310 I N . 50959 1
610 . 1 . 1 311 311 TYR H H 1 6.618 0.02329 . 1 . . . . . 311 Y HN . 50959 1
611 . 1 . 1 311 311 TYR HA H 1 4.161 0.02560 . 1 . . . . . 311 Y HA . 50959 1
612 . 1 . 1 311 311 TYR C C 13 175.214 0.04499 . 1 . . . . . 311 Y C . 50959 1
613 . 1 . 1 311 311 TYR CA C 13 61.165 0.04195 . 1 . . . . . 311 Y CA . 50959 1
614 . 1 . 1 311 311 TYR CB C 13 37.632 0.00383 . 1 . . . . . 311 Y CB . 50959 1
615 . 1 . 1 311 311 TYR N N 15 113.029 0.09690 . 1 . . . . . 311 Y N . 50959 1
616 . 1 . 1 312 312 GLY H H 1 7.637 0.02254 . 1 . . . . . 312 G HN . 50959 1
617 . 1 . 1 312 312 GLY HA2 H 1 4.387 0.02998 . 1 . . . . . 312 G HA1 . 50959 1
618 . 1 . 1 312 312 GLY C C 13 174.486 0.01761 . 1 . . . . . 312 G C . 50959 1
619 . 1 . 1 312 312 GLY CA C 13 44.505 0.03302 . 1 . . . . . 312 G CA . 50959 1
620 . 1 . 1 312 312 GLY N N 15 107.457 0.22861 . 1 . . . . . 312 G N . 50959 1
621 . 1 . 1 313 313 MET H H 1 7.345 0.01428 . 1 . . . . . 313 M HN . 50959 1
622 . 1 . 1 313 313 MET HA H 1 3.852 0.02595 . 1 . . . . . 313 M HA . 50959 1
623 . 1 . 1 313 313 MET C C 13 176.767 0.06547 . 1 . . . . . 313 M C . 50959 1
624 . 1 . 1 313 313 MET CA C 13 57.857 0.11293 . 1 . . . . . 313 M CA . 50959 1
625 . 1 . 1 313 313 MET CB C 13 34.270 0.16947 . 1 . . . . . 313 M CB . 50959 1
626 . 1 . 1 313 313 MET N N 15 119.563 0.14410 . 1 . . . . . 313 M N . 50959 1
627 . 1 . 1 314 314 ASN H H 1 8.023 0.01016 . 1 . . . . . 314 N HN . 50959 1
628 . 1 . 1 314 314 ASN HA H 1 4.863 0.02742 . 1 . . . . . 314 N HA . 50959 1
629 . 1 . 1 314 314 ASN C C 13 174.996 0.04734 . 1 . . . . . 314 N C . 50959 1
630 . 1 . 1 314 314 ASN CA C 13 53.377 0.05954 . 1 . . . . . 314 N CA . 50959 1
631 . 1 . 1 314 314 ASN CB C 13 39.725 0.08941 . 1 . . . . . 314 N CB . 50959 1
632 . 1 . 1 314 314 ASN N N 15 114.211 0.08257 . 1 . . . . . 314 N N . 50959 1
633 . 1 . 1 315 315 PHE H H 1 6.554 0.03510 . 1 . . . . . 315 F HN . 50959 1
634 . 1 . 1 315 315 PHE HA H 1 4.643 0.02220 . 1 . . . . . 315 F HA . 50959 1
635 . 1 . 1 315 315 PHE C C 13 175.479 0.04226 . 1 . . . . . 315 F C . 50959 1
636 . 1 . 1 315 315 PHE CA C 13 61.192 0.10454 . 1 . . . . . 315 F CA . 50959 1
637 . 1 . 1 315 315 PHE CB C 13 35.229 0 . 1 . . . . . 315 F CB . 50959 1
638 . 1 . 1 315 315 PHE N N 15 117.577 0.12566 . 1 . . . . . 315 F N . 50959 1
639 . 1 . 1 316 316 GLU H H 1 6.785 0.02225 . 1 . . . . . 316 E HN . 50959 1
640 . 1 . 1 316 316 GLU HA H 1 3.912 0.03975 . 1 . . . . . 316 E HA . 50959 1
641 . 1 . 1 316 316 GLU C C 13 174.422 0.03792 . 1 . . . . . 316 E C . 50959 1
642 . 1 . 1 316 316 GLU CA C 13 58.529 0.04931 . 1 . . . . . 316 E CA . 50959 1
643 . 1 . 1 316 316 GLU N N 15 119.538 0.15863 . 1 . . . . . 316 E N . 50959 1
644 . 1 . 1 328 328 PRO HA H 1 4.213 0.00194 . 1 . . . . . 328 P HA . 50959 1
645 . 1 . 1 328 328 PRO C C 13 179.603 0 . 1 . . . . . 328 P C . 50959 1
646 . 1 . 1 328 328 PRO CA C 13 65.384 0.02045 . 1 . . . . . 328 P CA . 50959 1
647 . 1 . 1 328 328 PRO CB C 13 31.003 0 . 1 . . . . . 328 P CB . 50959 1
648 . 1 . 1 329 329 VAL H H 1 7.391 0.01306 . 1 . . . . . 329 V HN . 50959 1
649 . 1 . 1 329 329 VAL HA H 1 3.463 0.03504 . 1 . . . . . 329 V HA . 50959 1
650 . 1 . 1 329 329 VAL C C 13 176.777 0.01645 . 1 . . . . . 329 V C . 50959 1
651 . 1 . 1 329 329 VAL CA C 13 67.597 0.08322 . 1 . . . . . 329 V CA . 50959 1
652 . 1 . 1 329 329 VAL CB C 13 30.866 0.13277 . 1 . . . . . 329 V CB . 50959 1
653 . 1 . 1 329 329 VAL N N 15 114.477 0.24601 . 1 . . . . . 329 V N . 50959 1
654 . 1 . 1 330 330 VAL H H 1 7.903 0.03068 . 1 . . . . . 330 V HN . 50959 1
655 . 1 . 1 330 330 VAL HA H 1 3.670 0.01315 . 1 . . . . . 330 V HA . 50959 1
656 . 1 . 1 330 330 VAL C C 13 178.822 0 . 1 . . . . . 330 V C . 50959 1
657 . 1 . 1 330 330 VAL CA C 13 66.929 0.10011 . 1 . . . . . 330 V CA . 50959 1
658 . 1 . 1 330 330 VAL CB C 13 30.440 0 . 1 . . . . . 330 V CB . 50959 1
659 . 1 . 1 330 330 VAL N N 15 121.246 0.12209 . 1 . . . . . 330 V N . 50959 1
660 . 1 . 1 331 331 LEU H H 1 7.587 0.00615 . 1 . . . . . 331 L HN . 50959 1
661 . 1 . 1 331 331 LEU HA H 1 4.049 0.00335 . 1 . . . . . 331 L HA . 50959 1
662 . 1 . 1 331 331 LEU C C 13 178.941 0.17772 . 1 . . . . . 331 L C . 50959 1
663 . 1 . 1 331 331 LEU CA C 13 57.976 0.16599 . 1 . . . . . 331 L CA . 50959 1
664 . 1 . 1 331 331 LEU CB C 13 42.000 0.06985 . 1 . . . . . 331 L CB . 50959 1
665 . 1 . 1 331 331 LEU N N 15 120.212 0.16724 . 1 . . . . . 331 L N . 50959 1
666 . 1 . 1 332 332 ALA H H 1 8.035 0.02209 . 1 . . . . . 332 A HN . 50959 1
667 . 1 . 1 332 332 ALA HA H 1 3.874 0.01929 . 1 . . . . . 332 A HA . 50959 1
668 . 1 . 1 332 332 ALA C C 13 179.129 0.07141 . 1 . . . . . 332 A C . 50959 1
669 . 1 . 1 332 332 ALA CA C 13 55.328 0.04910 . 1 . . . . . 332 A CA . 50959 1
670 . 1 . 1 332 332 ALA CB C 13 18.019 0 . 1 . . . . . 332 A CB . 50959 1
671 . 1 . 1 332 332 ALA N N 15 120.693 0.22261 . 1 . . . . . 332 A N . 50959 1
672 . 1 . 1 333 333 VAL H H 1 8.464 0.01911 . 1 . . . . . 333 V HN . 50959 1
673 . 1 . 1 333 333 VAL HA H 1 3.267 0.05082 . 1 . . . . . 333 V HA . 50959 1
674 . 1 . 1 333 333 VAL C C 13 177.660 0.00858 . 1 . . . . . 333 V C . 50959 1
675 . 1 . 1 333 333 VAL CA C 13 67.533 0.08066 . 1 . . . . . 333 V CA . 50959 1
676 . 1 . 1 333 333 VAL CB C 13 31.370 0 . 1 . . . . . 333 V CB . 50959 1
677 . 1 . 1 333 333 VAL N N 15 118.336 0.08984 . 1 . . . . . 333 V N . 50959 1
678 . 1 . 1 334 334 MET H H 1 8.514 0.02098 . 1 . . . . . 334 M HN . 50959 1
679 . 1 . 1 334 334 MET HA H 1 3.724 0.03200 . 1 . . . . . 334 M HA . 50959 1
680 . 1 . 1 334 334 MET C C 13 177.612 0.00250 . 1 . . . . . 334 M C . 50959 1
681 . 1 . 1 334 334 MET CA C 13 60.436 0.08302 . 1 . . . . . 334 M CA . 50959 1
682 . 1 . 1 334 334 MET CB C 13 32.407 0 . 1 . . . . . 334 M CB . 50959 1
683 . 1 . 1 334 334 MET N N 15 118.236 0.18132 . 1 . . . . . 334 M N . 50959 1
684 . 1 . 1 335 335 GLY H H 1 8.592 0.01673 . 1 . . . . . 335 G HN . 50959 1
685 . 1 . 1 335 335 GLY CA C 13 47.763 0.11629 . 1 . . . . . 335 G CA . 50959 1
686 . 1 . 1 335 335 GLY N N 15 105.506 0.23100 . 1 . . . . . 335 G N . 50959 1
687 . 1 . 1 336 336 VAL H H 1 8.538 0.01126 . 1 . . . . . 336 V HN . 50959 1
688 . 1 . 1 336 336 VAL HA H 1 3.407 0.00593 . 1 . . . . . 336 V HA . 50959 1
689 . 1 . 1 336 336 VAL C C 13 177.473 0.000998 . 1 . . . . . 336 V C . 50959 1
690 . 1 . 1 336 336 VAL CA C 13 67.333 0.04974 . 1 . . . . . 336 V CA . 50959 1
691 . 1 . 1 336 336 VAL CB C 13 29.127 0 . 1 . . . . . 336 V CB . 50959 1
692 . 1 . 1 336 336 VAL N N 15 121.393 0.11223 . 1 . . . . . 336 V N . 50959 1
693 . 1 . 1 337 337 ILE H H 1 8.247 0.00972 . 1 . . . . . 337 I HN . 50959 1
694 . 1 . 1 337 337 ILE HA H 1 3.391 0.01501 . 1 . . . . . 337 I HA . 50959 1
695 . 1 . 1 337 337 ILE C C 13 177.073 0.06509 . 1 . . . . . 337 I C . 50959 1
696 . 1 . 1 337 337 ILE CA C 13 66.202 0.08114 . 1 . . . . . 337 I CA . 50959 1
697 . 1 . 1 337 337 ILE CB C 13 37.602 0 . 1 . . . . . 337 I CB . 50959 1
698 . 1 . 1 337 337 ILE N N 15 119.200 0.06659 . 1 . . . . . 337 I N . 50959 1
699 . 1 . 1 338 338 ALA H H 1 7.999 0.04821 . 1 . . . . . 338 A HN . 50959 1
700 . 1 . 1 338 338 ALA HA H 1 3.758 0.01595 . 1 . . . . . 338 A HA . 50959 1
701 . 1 . 1 338 338 ALA C C 13 178.945 0.09059 . 1 . . . . . 338 A C . 50959 1
702 . 1 . 1 338 338 ALA CA C 13 55.826 0.04726 . 1 . . . . . 338 A CA . 50959 1
703 . 1 . 1 338 338 ALA CB C 13 18.115 0.16672 . 1 . . . . . 338 A CB . 50959 1
704 . 1 . 1 338 338 ALA N N 15 120.139 0.14729 . 1 . . . . . 338 A N . 50959 1
705 . 1 . 1 339 339 VAL H H 1 8.125 0.03036 . 1 . . . . . 339 V HN . 50959 1
706 . 1 . 1 339 339 VAL HA H 1 3.360 0.01571 . 1 . . . . . 339 V HA . 50959 1
707 . 1 . 1 339 339 VAL C C 13 177.452 0.07715 . 1 . . . . . 339 V C . 50959 1
708 . 1 . 1 339 339 VAL CA C 13 67.429 0.03540 . 1 . . . . . 339 V CA . 50959 1
709 . 1 . 1 339 339 VAL CB C 13 31.416 0 . 1 . . . . . 339 V CB . 50959 1
710 . 1 . 1 339 339 VAL N N 15 115.861 0.18437 . 1 . . . . . 339 V N . 50959 1
711 . 1 . 1 340 340 ILE H H 1 8.201 0 . 1 . . . . . 340 I HN . 50959 1
712 . 1 . 1 340 340 ILE N N 15 119.084 0.04977 . 1 . . . . . 340 I N . 50959 1
713 . 1 . 1 341 341 MET HA H 1 4.162 0.05206 . 1 . . . . . 341 M HA . 50959 1
714 . 1 . 1 341 341 MET C C 13 176.931 0.05738 . 1 . . . . . 341 M C . 50959 1
715 . 1 . 1 341 341 MET CA C 13 58.730 0.09040 . 1 . . . . . 341 M CA . 50959 1
716 . 1 . 1 341 341 MET CB C 13 29.409 0.06323 . 1 . . . . . 341 M CB . 50959 1
717 . 1 . 1 342 342 VAL H H 1 8.196 0.06554 . 1 . . . . . 342 V HN . 50959 1
718 . 1 . 1 342 342 VAL HA H 1 3.624 0.01809 . 1 . . . . . 342 V HA . 50959 1
719 . 1 . 1 342 342 VAL C C 13 177.300 0.05985 . 1 . . . . . 342 V C . 50959 1
720 . 1 . 1 342 342 VAL CA C 13 66.102 0.10032 . 1 . . . . . 342 V CA . 50959 1
721 . 1 . 1 342 342 VAL CB C 13 31.277 0.05572 . 1 . . . . . 342 V CB . 50959 1
722 . 1 . 1 342 342 VAL N N 15 121.670 0.11297 . 1 . . . . . 342 V N . 50959 1
723 . 1 . 1 343 343 VAL H H 1 7.145 0.01273 . 1 . . . . . 343 V HN . 50959 1
724 . 1 . 1 343 343 VAL HA H 1 3.297 0.01853 . 1 . . . . . 343 V HA . 50959 1
725 . 1 . 1 343 343 VAL CA C 13 67.656 0.03986 . 1 . . . . . 343 V CA . 50959 1
726 . 1 . 1 343 343 VAL CB C 13 31.326 0 . 1 . . . . . 343 V CB . 50959 1
727 . 1 . 1 343 343 VAL N N 15 119.049 0.05348 . 1 . . . . . 343 V N . 50959 1
stop_
save_