Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 27830
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 27830 1
2 '2D 1H-13C HSQC' . . . 27830 1
3 '3D CBCA(CO)NH' . . . 27830 1
4 '3D HNCA' . . . 27830 1
5 '3D HNCACB' . . . 27830 1
6 '3D HBHA(CO)NH' . . . 27830 1
7 '3D HCCH-TOCSY' . . . 27830 1
8 '3D CCH-TOCSY' . . . 27830 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 $SPARKY . . 27830 1
2 $NMRPipe . . 27830 1
3 $AutoAssign . . 27830 1
4 $X-PLOR_NIH . . 27830 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 3 3 ARG H H 1 8.461 0.026 . 1 . . . . . 6 R H . 27830 1
2 . 1 . 1 3 3 ARG HA H 1 4.697 0.005 . 1 . . . . . 6 R HA . 27830 1
3 . 1 . 1 3 3 ARG HB2 H 1 1.760 0.012 . 2 . . . . . 6 R HB2 . 27830 1
4 . 1 . 1 3 3 ARG HB3 H 1 1.842 0.010 . 2 . . . . . 6 R HB3 . 27830 1
5 . 1 . 1 3 3 ARG HG2 H 1 1.680 0.016 . 2 . . . . . 6 R HG2 . 27830 1
6 . 1 . 1 3 3 ARG HD2 H 1 3.212 0.009 . 2 . . . . . 6 R HD2 . 27830 1
7 . 1 . 1 3 3 ARG CA C 13 54.057 0.091 . 1 . . . . . 6 R CA . 27830 1
8 . 1 . 1 3 3 ARG CB C 13 30.499 0.091 . 1 . . . . . 6 R CB . 27830 1
9 . 1 . 1 3 3 ARG CG C 13 26.890 0.089 . 1 . . . . . 6 R CG . 27830 1
10 . 1 . 1 3 3 ARG CD C 13 43.518 0.070 . 1 . . . . . 6 R CD . 27830 1
11 . 1 . 1 3 3 ARG N N 15 123.674 0.026 . 1 . . . . . 6 R N . 27830 1
12 . 1 . 1 4 4 PRO HA H 1 4.421 0.007 . 1 . . . . . 7 P HA . 27830 1
13 . 1 . 1 4 4 PRO HB2 H 1 1.948 0.009 . 2 . . . . . 7 P HB2 . 27830 1
14 . 1 . 1 4 4 PRO HB3 H 1 2.369 0.010 . 2 . . . . . 7 P HB3 . 27830 1
15 . 1 . 1 4 4 PRO HG2 H 1 2.054 0.007 . 2 . . . . . 7 P HG2 . 27830 1
16 . 1 . 1 4 4 PRO HG3 H 1 2.033 0.009 . 2 . . . . . 7 P HG3 . 27830 1
17 . 1 . 1 4 4 PRO HD2 H 1 3.841 0.036 . 2 . . . . . 7 P HD2 . 27830 1
18 . 1 . 1 4 4 PRO HD3 H 1 3.643 0.036 . 2 . . . . . 7 P HD3 . 27830 1
19 . 1 . 1 4 4 PRO C C 13 176.193 0.000 . 1 . . . . . 7 P C . 27830 1
20 . 1 . 1 4 4 PRO CA C 13 63.184 0.108 . 1 . . . . . 7 P CA . 27830 1
21 . 1 . 1 4 4 PRO CB C 13 32.253 0.079 . 1 . . . . . 7 P CB . 27830 1
22 . 1 . 1 4 4 PRO CG C 13 27.527 0.080 . 1 . . . . . 7 P CG . 27830 1
23 . 1 . 1 4 4 PRO CD C 13 50.778 0.091 . 1 . . . . . 7 P CD . 27830 1
24 . 1 . 1 5 5 ALA H H 1 8.484 0.011 . 1 . . . . . 8 A H . 27830 1
25 . 1 . 1 5 5 ALA HA H 1 4.265 0.009 . 1 . . . . . 8 A HA . 27830 1
26 . 1 . 1 5 5 ALA HB1 H 1 1.374 0.010 . 1 . . . . . 8 A MB . 27830 1
27 . 1 . 1 5 5 ALA HB2 H 1 1.374 0.010 . 1 . . . . . 8 A MB . 27830 1
28 . 1 . 1 5 5 ALA HB3 H 1 1.374 0.010 . 1 . . . . . 8 A MB . 27830 1
29 . 1 . 1 5 5 ALA C C 13 175.867 0.015 . 1 . . . . . 8 A C . 27830 1
30 . 1 . 1 5 5 ALA CA C 13 52.419 0.098 . 1 . . . . . 8 A CA . 27830 1
31 . 1 . 1 5 5 ALA CB C 13 19.375 0.151 . 1 . . . . . 8 A CB . 27830 1
32 . 1 . 1 5 5 ALA N N 15 124.624 0.019 . 1 . . . . . 8 A N . 27830 1
33 . 1 . 1 6 6 ASP H H 1 8.258 0.096 . 1 . . . . . 9 D H . 27830 1
34 . 1 . 1 6 6 ASP HA H 1 4.867 0.007 . 1 . . . . . 9 D HA . 27830 1
35 . 1 . 1 6 6 ASP HB2 H 1 2.755 0.007 . 2 . . . . . 9 D HB2 . 27830 1
36 . 1 . 1 6 6 ASP HB3 H 1 2.484 0.008 . 2 . . . . . 9 D HB3 . 27830 1
37 . 1 . 1 6 6 ASP C C 13 174.255 0.000 . 1 . . . . . 9 D C . 27830 1
38 . 1 . 1 6 6 ASP CA C 13 52.652 0.086 . 1 . . . . . 9 D CA . 27830 1
39 . 1 . 1 6 6 ASP CB C 13 40.648 0.123 . 1 . . . . . 9 D CB . 27830 1
40 . 1 . 1 6 6 ASP N N 15 121.194 0.039 . 1 . . . . . 9 D N . 27830 1
41 . 1 . 1 7 7 PRO HA H 1 4.360 0.002 . 1 . . . . . 10 P HA . 27830 1
42 . 1 . 1 7 7 PRO HB2 H 1 1.587 0.007 . 2 . . . . . 10 P HB2 . 27830 1
43 . 1 . 1 7 7 PRO HG2 H 1 1.768 0.004 . 2 . . . . . 10 P HG2 . 27830 1
44 . 1 . 1 7 7 PRO HG3 H 1 1.454 0.009 . 2 . . . . . 10 P HG3 . 27830 1
45 . 1 . 1 7 7 PRO HD2 H 1 3.565 0.003 . 2 . . . . . 10 P HD2 . 27830 1
46 . 1 . 1 7 7 PRO HD3 H 1 3.667 0.003 . 2 . . . . . 10 P HD3 . 27830 1
47 . 1 . 1 7 7 PRO C C 13 176.236 0.000 . 1 . . . . . 10 P C . 27830 1
48 . 1 . 1 7 7 PRO CA C 13 62.177 0.045 . 1 . . . . . 10 P CA . 27830 1
49 . 1 . 1 7 7 PRO CB C 13 32.124 0.086 . 1 . . . . . 10 P CB . 27830 1
50 . 1 . 1 7 7 PRO CG C 13 26.995 0.101 . 1 . . . . . 10 P CG . 27830 1
51 . 1 . 1 7 7 PRO CD C 13 50.095 0.029 . 1 . . . . . 10 P CD . 27830 1
52 . 1 . 1 8 8 GLU H H 1 9.082 0.009 . 1 . . . . . 11 E H . 27830 1
53 . 1 . 1 8 8 GLU HA H 1 4.489 0.007 . 1 . . . . . 11 E HA . 27830 1
54 . 1 . 1 8 8 GLU HB2 H 1 2.161 0.029 . 2 . . . . . 11 E HB2 . 27830 1
55 . 1 . 1 8 8 GLU HB3 H 1 2.159 0.041 . 2 . . . . . 11 E HB3 . 27830 1
56 . 1 . 1 8 8 GLU C C 13 174.091 0.000 . 1 . . . . . 11 E C . 27830 1
57 . 1 . 1 8 8 GLU CA C 13 56.277 0.050 . 1 . . . . . 11 E CA . 27830 1
58 . 1 . 1 8 8 GLU CB C 13 30.883 0.112 . 1 . . . . . 11 E CB . 27830 1
59 . 1 . 1 8 8 GLU N N 15 123.979 0.070 . 1 . . . . . 11 E N . 27830 1
60 . 1 . 1 9 9 ILE CA C 13 60.366 0.094 . 1 . . . . . 12 I CA . 27830 1
61 . 1 . 1 9 9 ILE CB C 13 42.567 0.089 . 1 . . . . . 12 I CB . 27830 1
62 . 1 . 1 10 10 VAL H H 1 9.396 0.006 . 1 . . . . . 13 V H . 27830 1
63 . 1 . 1 10 10 VAL HA H 1 4.330 0.011 . 1 . . . . . 13 V HA . 27830 1
64 . 1 . 1 10 10 VAL HB H 1 2.077 0.011 . 1 . . . . . 13 V HB . 27830 1
65 . 1 . 1 10 10 VAL C C 13 174.884 0.000 . 1 . . . . . 13 V C . 27830 1
66 . 1 . 1 10 10 VAL CA C 13 62.868 0.111 . 1 . . . . . 13 V CA . 27830 1
67 . 1 . 1 10 10 VAL CB C 13 33.545 0.094 . 1 . . . . . 13 V CB . 27830 1
68 . 1 . 1 10 10 VAL N N 15 128.725 0.036 . 1 . . . . . 13 V N . 27830 1
69 . 1 . 1 11 11 GLU H H 1 8.573 0.009 . 1 . . . . . 14 E H . 27830 1
70 . 1 . 1 11 11 GLU HA H 1 4.899 0.004 . 1 . . . . . 14 E HA . 27830 1
71 . 1 . 1 11 11 GLU HB2 H 1 2.104 0.078 . 2 . . . . . 14 E HB2 . 27830 1
72 . 1 . 1 11 11 GLU HB3 H 1 2.247 0.092 . 2 . . . . . 14 E HB3 . 27830 1
73 . 1 . 1 11 11 GLU HG2 H 1 2.312 0.029 . 2 . . . . . 14 E HG2 . 27830 1
74 . 1 . 1 11 11 GLU HG3 H 1 2.329 0.022 . 2 . . . . . 14 E HG3 . 27830 1
75 . 1 . 1 11 11 GLU C C 13 176.399 0.000 . 1 . . . . . 14 E C . 27830 1
76 . 1 . 1 11 11 GLU CA C 13 55.152 0.091 . 1 . . . . . 14 E CA . 27830 1
77 . 1 . 1 11 11 GLU CB C 13 32.523 0.109 . 1 . . . . . 14 E CB . 27830 1
78 . 1 . 1 11 11 GLU CG C 13 37.307 0.087 . 1 . . . . . 14 E CG . 27830 1
79 . 1 . 1 11 11 GLU N N 15 124.606 0.038 . 1 . . . . . 14 E N . 27830 1
80 . 1 . 1 12 12 GLY H H 1 8.758 0.006 . 1 . . . . . 15 G H . 27830 1
81 . 1 . 1 12 12 GLY HA2 H 1 4.085 0.013 . 2 . . . . . 15 G HA2 . 27830 1
82 . 1 . 1 12 12 GLY HA3 H 1 3.783 0.011 . 2 . . . . . 15 G HA3 . 27830 1
83 . 1 . 1 12 12 GLY C C 13 173.896 0.000 . 1 . . . . . 15 G C . 27830 1
84 . 1 . 1 12 12 GLY CA C 13 46.756 0.067 . 1 . . . . . 15 G CA . 27830 1
85 . 1 . 1 12 12 GLY N N 15 109.517 0.027 . 1 . . . . . 15 G N . 27830 1
86 . 1 . 1 13 13 LEU H H 1 7.246 0.003 . 1 . . . . . 16 L H . 27830 1
87 . 1 . 1 13 13 LEU HA H 1 4.177 0.006 . 1 . . . . . 16 L HA . 27830 1
88 . 1 . 1 13 13 LEU HB2 H 1 1.217 0.026 . 2 . . . . . 16 L HB2 . 27830 1
89 . 1 . 1 13 13 LEU HB3 H 1 1.565 0.013 . 2 . . . . . 16 L HB3 . 27830 1
90 . 1 . 1 13 13 LEU C C 13 174.410 0.000 . 1 . . . . . 16 L C . 27830 1
91 . 1 . 1 13 13 LEU CA C 13 52.211 0.076 . 1 . . . . . 16 L CA . 27830 1
92 . 1 . 1 13 13 LEU CB C 13 44.226 0.087 . 1 . . . . . 16 L CB . 27830 1
93 . 1 . 1 13 13 LEU N N 15 117.904 0.016 . 1 . . . . . 16 L N . 27830 1
94 . 1 . 1 14 14 PRO C C 13 174.781 0.000 . 1 . . . . . 17 P C . 27830 1
95 . 1 . 1 14 14 PRO CA C 13 61.629 0.028 . 1 . . . . . 17 P CA . 27830 1
96 . 1 . 1 14 14 PRO CB C 13 34.728 0.000 . 1 . . . . . 17 P CB . 27830 1
97 . 1 . 1 15 15 ILE H H 1 9.549 0.002 . 1 . . . . . 18 I H . 27830 1
98 . 1 . 1 15 15 ILE HA H 1 4.584 0.000 . 1 . . . . . 18 I HA . 27830 1
99 . 1 . 1 15 15 ILE CA C 13 57.987 0.294 . 1 . . . . . 18 I CA . 27830 1
100 . 1 . 1 15 15 ILE CB C 13 35.528 0.000 . 1 . . . . . 18 I CB . 27830 1
101 . 1 . 1 15 15 ILE N N 15 123.850 0.041 . 1 . . . . . 18 I N . 27830 1
102 . 1 . 1 16 16 PRO HA H 1 5.055 0.003 . 1 . . . . . 19 P HA . 27830 1
103 . 1 . 1 16 16 PRO HB2 H 1 1.834 0.009 . 2 . . . . . 19 P HB2 . 27830 1
104 . 1 . 1 16 16 PRO HB3 H 1 1.971 0.013 . 2 . . . . . 19 P HB3 . 27830 1
105 . 1 . 1 16 16 PRO HG2 H 1 1.930 0.008 . 2 . . . . . 19 P HG2 . 27830 1
106 . 1 . 1 16 16 PRO HG3 H 1 2.252 0.048 . 2 . . . . . 19 P HG3 . 27830 1
107 . 1 . 1 16 16 PRO HD2 H 1 3.735 0.006 . 2 . . . . . 19 P HD2 . 27830 1
108 . 1 . 1 16 16 PRO HD3 H 1 4.011 0.005 . 2 . . . . . 19 P HD3 . 27830 1
109 . 1 . 1 16 16 PRO C C 13 177.239 0.000 . 1 . . . . . 19 P C . 27830 1
110 . 1 . 1 16 16 PRO CA C 13 61.426 0.087 . 1 . . . . . 19 P CA . 27830 1
111 . 1 . 1 16 16 PRO CB C 13 31.568 0.088 . 1 . . . . . 19 P CB . 27830 1
112 . 1 . 1 16 16 PRO CG C 13 27.682 0.114 . 1 . . . . . 19 P CG . 27830 1
113 . 1 . 1 16 16 PRO CD C 13 50.674 0.102 . 1 . . . . . 19 P CD . 27830 1
114 . 1 . 1 17 17 LEU H H 1 8.949 0.011 . 1 . . . . . 20 L H . 27830 1
115 . 1 . 1 17 17 LEU HA H 1 4.736 0.016 . 1 . . . . . 20 L HA . 27830 1
116 . 1 . 1 17 17 LEU HB2 H 1 1.465 0.002 . 2 . . . . . 20 L HB2 . 27830 1
117 . 1 . 1 17 17 LEU C C 13 175.707 0.000 . 1 . . . . . 20 L C . 27830 1
118 . 1 . 1 17 17 LEU CA C 13 53.572 0.038 . 1 . . . . . 20 L CA . 27830 1
119 . 1 . 1 17 17 LEU CB C 13 44.279 0.059 . 1 . . . . . 20 L CB . 27830 1
120 . 1 . 1 17 17 LEU N N 15 127.124 0.048 . 1 . . . . . 20 L N . 27830 1
121 . 1 . 1 18 18 ALA H H 1 8.378 0.005 . 1 . . . . . 21 A H . 27830 1
122 . 1 . 1 18 18 ALA HA H 1 4.443 0.006 . 1 . . . . . 21 A HA . 27830 1
123 . 1 . 1 18 18 ALA HB1 H 1 1.296 0.004 . 1 . . . . . 21 A MB . 27830 1
124 . 1 . 1 18 18 ALA HB2 H 1 1.296 0.004 . 1 . . . . . 21 A MB . 27830 1
125 . 1 . 1 18 18 ALA HB3 H 1 1.296 0.004 . 1 . . . . . 21 A MB . 27830 1
126 . 1 . 1 18 18 ALA C C 13 177.253 0.000 . 1 . . . . . 21 A C . 27830 1
127 . 1 . 1 18 18 ALA CA C 13 52.429 0.088 . 1 . . . . . 21 A CA . 27830 1
128 . 1 . 1 18 18 ALA CB C 13 18.504 0.178 . 1 . . . . . 21 A CB . 27830 1
129 . 1 . 1 18 18 ALA N N 15 126.095 0.041 . 1 . . . . . 21 A N . 27830 1
130 . 1 . 1 19 19 VAL H H 1 8.151 0.005 . 1 . . . . . 22 V H . 27830 1
131 . 1 . 1 19 19 VAL HA H 1 4.113 0.006 . 1 . . . . . 22 V HA . 27830 1
132 . 1 . 1 19 19 VAL C C 13 175.268 0.000 . 1 . . . . . 22 V C . 27830 1
133 . 1 . 1 19 19 VAL CA C 13 60.925 0.034 . 1 . . . . . 22 V CA . 27830 1
134 . 1 . 1 19 19 VAL CB C 13 34.984 0.000 . 1 . . . . . 22 V CB . 27830 1
135 . 1 . 1 19 19 VAL CG1 C 13 23.666 0.000 . 2 . . . . . 22 V CG1 . 27830 1
136 . 1 . 1 19 19 VAL CG2 C 13 22.184 0.000 . 2 . . . . . 22 V CG2 . 27830 1
137 . 1 . 1 19 19 VAL N N 15 122.317 0.052 . 1 . . . . . 22 V N . 27830 1
138 . 1 . 1 20 20 ALA H H 1 8.911 0.002 . 1 . . . . . 23 A H . 27830 1
139 . 1 . 1 20 20 ALA HA H 1 4.172 0.000 . 1 . . . . . 23 A HA . 27830 1
140 . 1 . 1 20 20 ALA HB1 H 1 1.505 0.000 . 1 . . . . . 23 A MB . 27830 1
141 . 1 . 1 20 20 ALA HB2 H 1 1.505 0.000 . 1 . . . . . 23 A MB . 27830 1
142 . 1 . 1 20 20 ALA HB3 H 1 1.505 0.000 . 1 . . . . . 23 A MB . 27830 1
143 . 1 . 1 20 20 ALA CA C 13 54.508 0.024 . 1 . . . . . 23 A CA . 27830 1
144 . 1 . 1 20 20 ALA CB C 13 18.110 0.000 . 1 . . . . . 23 A CB . 27830 1
145 . 1 . 1 20 20 ALA N N 15 131.432 0.033 . 1 . . . . . 23 A N . 27830 1
146 . 1 . 1 21 21 GLY C C 13 173.730 0.000 . 1 . . . . . 24 G C . 27830 1
147 . 1 . 1 21 21 GLY CA C 13 45.844 0.008 . 1 . . . . . 24 G CA . 27830 1
148 . 1 . 1 22 22 HIS H H 1 8.164 0.003 . 1 . . . . . 25 H H . 27830 1
149 . 1 . 1 22 22 HIS C C 13 175.780 0.000 . 1 . . . . . 25 H C . 27830 1
150 . 1 . 1 22 22 HIS CA C 13 56.335 0.089 . 1 . . . . . 25 H CA . 27830 1
151 . 1 . 1 22 22 HIS CB C 13 28.016 0.068 . 1 . . . . . 25 H CB . 27830 1
152 . 1 . 1 22 22 HIS N N 15 119.840 0.047 . 1 . . . . . 25 H N . 27830 1
153 . 1 . 1 23 23 HIS H H 1 7.820 0.004 . 1 . . . . . 26 H H . 27830 1
154 . 1 . 1 23 23 HIS C C 13 175.305 0.000 . 1 . . . . . 26 H C . 27830 1
155 . 1 . 1 23 23 HIS CA C 13 58.430 0.030 . 1 . . . . . 26 H CA . 27830 1
156 . 1 . 1 23 23 HIS CB C 13 30.639 0.000 . 1 . . . . . 26 H CB . 27830 1
157 . 1 . 1 23 23 HIS N N 15 123.774 0.068 . 1 . . . . . 26 H N . 27830 1
158 . 1 . 1 24 24 GLN H H 1 8.357 0.005 . 1 . . . . . 27 Q H . 27830 1
159 . 1 . 1 24 24 GLN CA C 13 52.863 0.010 . 1 . . . . . 27 Q CA . 27830 1
160 . 1 . 1 24 24 GLN CB C 13 29.501 0.000 . 1 . . . . . 27 Q CB . 27830 1
161 . 1 . 1 24 24 GLN N N 15 117.282 0.028 . 1 . . . . . 27 Q N . 27830 1
162 . 1 . 1 25 25 PRO HA H 1 4.416 0.007 . 1 . . . . . 28 P HA . 27830 1
163 . 1 . 1 25 25 PRO C C 13 175.639 0.000 . 1 . . . . . 28 P C . 27830 1
164 . 1 . 1 25 25 PRO CA C 13 63.690 0.053 . 1 . . . . . 28 P CA . 27830 1
165 . 1 . 1 25 25 PRO CB C 13 32.074 0.024 . 1 . . . . . 28 P CB . 27830 1
166 . 1 . 1 25 25 PRO CG C 13 27.456 0.000 . 1 . . . . . 28 P CG . 27830 1
167 . 1 . 1 25 25 PRO CD C 13 50.685 0.000 . 1 . . . . . 28 P CD . 27830 1
168 . 1 . 1 26 26 ALA H H 1 8.921 0.003 . 1 . . . . . 29 A H . 27830 1
169 . 1 . 1 26 26 ALA HA H 1 5.059 0.010 . 1 . . . . . 29 A HA . 27830 1
170 . 1 . 1 26 26 ALA HB1 H 1 1.440 0.006 . 1 . . . . . 29 A MB . 27830 1
171 . 1 . 1 26 26 ALA HB2 H 1 1.440 0.006 . 1 . . . . . 29 A MB . 27830 1
172 . 1 . 1 26 26 ALA HB3 H 1 1.440 0.006 . 1 . . . . . 29 A MB . 27830 1
173 . 1 . 1 26 26 ALA CA C 13 49.485 0.145 . 1 . . . . . 29 A CA . 27830 1
174 . 1 . 1 26 26 ALA CB C 13 19.405 0.126 . 1 . . . . . 29 A CB . 27830 1
175 . 1 . 1 26 26 ALA N N 15 129.535 0.064 . 1 . . . . . 29 A N . 27830 1
176 . 1 . 1 27 27 PRO HA H 1 4.350 0.009 . 1 . . . . . 30 P HA . 27830 1
177 . 1 . 1 27 27 PRO HB2 H 1 1.943 0.000 . 2 . . . . . 30 P HB2 . 27830 1
178 . 1 . 1 27 27 PRO HB3 H 1 2.101 0.000 . 2 . . . . . 30 P HB3 . 27830 1
179 . 1 . 1 27 27 PRO C C 13 175.009 0.000 . 1 . . . . . 30 P C . 27830 1
180 . 1 . 1 27 27 PRO CA C 13 61.407 0.086 . 1 . . . . . 30 P CA . 27830 1
181 . 1 . 1 27 27 PRO CB C 13 30.344 0.089 . 1 . . . . . 30 P CB . 27830 1
182 . 1 . 1 27 27 PRO CG C 13 27.685 0.000 . 1 . . . . . 30 P CG . 27830 1
183 . 1 . 1 27 27 PRO CD C 13 50.740 0.000 . 1 . . . . . 30 P CD . 27830 1
184 . 1 . 1 28 28 PHE H H 1 8.890 0.012 . 1 . . . . . 31 F H . 27830 1
185 . 1 . 1 28 28 PHE HA H 1 4.632 0.003 . 1 . . . . . 31 F HA . 27830 1
186 . 1 . 1 28 28 PHE HB2 H 1 2.438 0.006 . 2 . . . . . 31 F HB2 . 27830 1
187 . 1 . 1 28 28 PHE HB3 H 1 3.355 0.012 . 2 . . . . . 31 F HB3 . 27830 1
188 . 1 . 1 28 28 PHE C C 13 175.855 0.000 . 1 . . . . . 31 F C . 27830 1
189 . 1 . 1 28 28 PHE CA C 13 58.977 0.072 . 1 . . . . . 31 F CA . 27830 1
190 . 1 . 1 28 28 PHE CB C 13 40.225 0.089 . 1 . . . . . 31 F CB . 27830 1
191 . 1 . 1 28 28 PHE N N 15 124.039 0.070 . 1 . . . . . 31 F N . 27830 1
192 . 1 . 1 29 29 TYR H H 1 8.850 0.009 . 1 . . . . . 32 Y H . 27830 1
193 . 1 . 1 29 29 TYR HA H 1 4.456 0.004 . 1 . . . . . 32 Y HA . 27830 1
194 . 1 . 1 29 29 TYR HB2 H 1 2.273 0.006 . 2 . . . . . 32 Y HB2 . 27830 1
195 . 1 . 1 29 29 TYR HB3 H 1 2.902 0.008 . 2 . . . . . 32 Y HB3 . 27830 1
196 . 1 . 1 29 29 TYR C C 13 172.767 0.000 . 1 . . . . . 32 Y C . 27830 1
197 . 1 . 1 29 29 TYR CA C 13 59.719 0.084 . 1 . . . . . 32 Y CA . 27830 1
198 . 1 . 1 29 29 TYR CB C 13 41.174 0.086 . 1 . . . . . 32 Y CB . 27830 1
199 . 1 . 1 29 29 TYR N N 15 118.733 0.062 . 1 . . . . . 32 Y N . 27830 1
200 . 1 . 1 30 30 LEU H H 1 7.608 0.003 . 1 . . . . . 33 L H . 27830 1
201 . 1 . 1 30 30 LEU HA H 1 5.193 0.007 . 1 . . . . . 33 L HA . 27830 1
202 . 1 . 1 30 30 LEU HB2 H 1 1.339 0.021 . 2 . . . . . 33 L HB2 . 27830 1
203 . 1 . 1 30 30 LEU HB3 H 1 1.598 0.010 . 2 . . . . . 33 L HB3 . 27830 1
204 . 1 . 1 30 30 LEU C C 13 177.341 0.000 . 1 . . . . . 33 L C . 27830 1
205 . 1 . 1 30 30 LEU CA C 13 53.602 0.081 . 1 . . . . . 33 L CA . 27830 1
206 . 1 . 1 30 30 LEU CB C 13 44.392 0.068 . 1 . . . . . 33 L CB . 27830 1
207 . 1 . 1 30 30 LEU N N 15 110.782 0.040 . 1 . . . . . 33 L N . 27830 1
208 . 1 . 1 31 31 THR H H 1 8.225 0.005 . 1 . . . . . 34 T H . 27830 1
209 . 1 . 1 31 31 THR HA H 1 5.035 0.013 . 1 . . . . . 34 T HA . 27830 1
210 . 1 . 1 31 31 THR HB H 1 4.303 0.011 . 1 . . . . . 34 T HB . 27830 1
211 . 1 . 1 31 31 THR HG21 H 1 0.928 0.010 . 1 . . . . . 34 T MG . 27830 1
212 . 1 . 1 31 31 THR HG22 H 1 0.928 0.010 . 1 . . . . . 34 T MG . 27830 1
213 . 1 . 1 31 31 THR HG23 H 1 0.928 0.010 . 1 . . . . . 34 T MG . 27830 1
214 . 1 . 1 31 31 THR C C 13 175.475 0.000 . 1 . . . . . 34 T C . 27830 1
215 . 1 . 1 31 31 THR CA C 13 59.393 0.049 . 1 . . . . . 34 T CA . 27830 1
216 . 1 . 1 31 31 THR CB C 13 70.705 0.045 . 1 . . . . . 34 T CB . 27830 1
217 . 1 . 1 31 31 THR CG2 C 13 22.677 0.022 . 1 . . . . . 34 T CG . 27830 1
218 . 1 . 1 31 31 THR N N 15 111.683 0.049 . 1 . . . . . 34 T N . 27830 1
219 . 1 . 1 32 32 ALA H H 1 8.626 0.011 . 1 . . . . . 35 A H . 27830 1
220 . 1 . 1 32 32 ALA HA H 1 4.056 0.006 . 1 . . . . . 35 A HA . 27830 1
221 . 1 . 1 32 32 ALA HB1 H 1 1.293 0.005 . 1 . . . . . 35 A MB . 27830 1
222 . 1 . 1 32 32 ALA HB2 H 1 1.293 0.005 . 1 . . . . . 35 A MB . 27830 1
223 . 1 . 1 32 32 ALA HB3 H 1 1.293 0.005 . 1 . . . . . 35 A MB . 27830 1
224 . 1 . 1 32 32 ALA C C 13 176.807 0.000 . 1 . . . . . 35 A C . 27830 1
225 . 1 . 1 32 32 ALA CA C 13 54.552 0.098 . 1 . . . . . 35 A CA . 27830 1
226 . 1 . 1 32 32 ALA CB C 13 18.690 0.122 . 1 . . . . . 35 A CB . 27830 1
227 . 1 . 1 32 32 ALA N N 15 120.015 0.019 . 1 . . . . . 35 A N . 27830 1
228 . 1 . 1 33 33 ASP H H 1 8.574 0.003 . 1 . . . . . 36 D H . 27830 1
229 . 1 . 1 33 33 ASP HA H 1 4.433 0.003 . 1 . . . . . 36 D HA . 27830 1
230 . 1 . 1 33 33 ASP HB2 H 1 2.560 0.030 . 2 . . . . . 36 D HB2 . 27830 1
231 . 1 . 1 33 33 ASP HB3 H 1 2.678 0.086 . 2 . . . . . 36 D HB3 . 27830 1
232 . 1 . 1 33 33 ASP C C 13 176.630 0.000 . 1 . . . . . 36 D C . 27830 1
233 . 1 . 1 33 33 ASP CA C 13 53.223 0.099 . 1 . . . . . 36 D CA . 27830 1
234 . 1 . 1 33 33 ASP CB C 13 40.630 0.086 . 1 . . . . . 36 D CB . 27830 1
235 . 1 . 1 33 33 ASP N N 15 111.832 0.026 . 1 . . . . . 36 D N . 27830 1
236 . 1 . 1 34 34 MET H H 1 7.434 0.004 . 1 . . . . . 37 M H . 27830 1
237 . 1 . 1 34 34 MET HA H 1 3.635 0.003 . 1 . . . . . 37 M HA . 27830 1
238 . 1 . 1 34 34 MET HB2 H 1 1.863 0.008 . 2 . . . . . 37 M HB2 . 27830 1
239 . 1 . 1 34 34 MET HB3 H 1 2.046 0.013 . 2 . . . . . 37 M HB3 . 27830 1
240 . 1 . 1 34 34 MET C C 13 176.285 0.000 . 1 . . . . . 37 M C . 27830 1
241 . 1 . 1 34 34 MET CA C 13 58.007 0.108 . 1 . . . . . 37 M CA . 27830 1
242 . 1 . 1 34 34 MET CB C 13 33.226 0.145 . 1 . . . . . 37 M CB . 27830 1
243 . 1 . 1 34 34 MET N N 15 121.485 0.037 . 1 . . . . . 37 M N . 27830 1
244 . 1 . 1 35 35 PHE H H 1 8.569 0.006 . 1 . . . . . 38 F H . 27830 1
245 . 1 . 1 35 35 PHE HA H 1 4.317 0.005 . 1 . . . . . 38 F HA . 27830 1
246 . 1 . 1 35 35 PHE HB2 H 1 3.085 0.008 . 2 . . . . . 38 F HB2 . 27830 1
247 . 1 . 1 35 35 PHE HB3 H 1 3.222 0.007 . 2 . . . . . 38 F HB3 . 27830 1
248 . 1 . 1 35 35 PHE C C 13 176.148 0.000 . 1 . . . . . 38 F C . 27830 1
249 . 1 . 1 35 35 PHE CA C 13 57.508 0.109 . 1 . . . . . 38 F CA . 27830 1
250 . 1 . 1 35 35 PHE CB C 13 36.268 0.080 . 1 . . . . . 38 F CB . 27830 1
251 . 1 . 1 35 35 PHE N N 15 114.105 0.042 . 1 . . . . . 38 F N . 27830 1
252 . 1 . 1 36 36 GLY H H 1 8.085 0.005 . 1 . . . . . 39 G H . 27830 1
253 . 1 . 1 36 36 GLY HA2 H 1 4.208 0.009 . 2 . . . . . 39 G HA2 . 27830 1
254 . 1 . 1 36 36 GLY HA3 H 1 3.757 0.030 . 2 . . . . . 39 G HA3 . 27830 1
255 . 1 . 1 36 36 GLY C C 13 174.453 0.000 . 1 . . . . . 39 G C . 27830 1
256 . 1 . 1 36 36 GLY CA C 13 45.561 0.185 . 1 . . . . . 39 G CA . 27830 1
257 . 1 . 1 36 36 GLY N N 15 106.048 0.041 . 1 . . . . . 39 G N . 27830 1
258 . 1 . 1 37 37 GLY H H 1 8.093 0.049 . 1 . . . . . 40 G H . 27830 1
259 . 1 . 1 37 37 GLY HA2 H 1 4.362 0.003 . 2 . . . . . 40 G HA2 . 27830 1
260 . 1 . 1 37 37 GLY HA3 H 1 4.103 0.011 . 2 . . . . . 40 G HA3 . 27830 1
261 . 1 . 1 37 37 GLY C C 13 173.243 0.000 . 1 . . . . . 40 G C . 27830 1
262 . 1 . 1 37 37 GLY CA C 13 44.923 0.099 . 1 . . . . . 40 G CA . 27830 1
263 . 1 . 1 37 37 GLY N N 15 112.612 0.027 . 1 . . . . . 40 G N . 27830 1
264 . 1 . 1 38 38 LEU H H 1 8.842 0.005 . 1 . . . . . 41 L H . 27830 1
265 . 1 . 1 38 38 LEU HA H 1 5.060 0.007 . 1 . . . . . 41 L HA . 27830 1
266 . 1 . 1 38 38 LEU HB2 H 1 1.211 0.007 . 2 . . . . . 41 L HB2 . 27830 1
267 . 1 . 1 38 38 LEU HB3 H 1 2.097 0.007 . 2 . . . . . 41 L HB3 . 27830 1
268 . 1 . 1 38 38 LEU C C 13 176.830 0.000 . 1 . . . . . 41 L C . 27830 1
269 . 1 . 1 38 38 LEU CA C 13 51.221 0.047 . 1 . . . . . 41 L CA . 27830 1
270 . 1 . 1 38 38 LEU CB C 13 46.362 0.074 . 1 . . . . . 41 L CB . 27830 1
271 . 1 . 1 38 38 LEU N N 15 126.809 0.049 . 1 . . . . . 41 L N . 27830 1
272 . 1 . 1 39 39 PRO HA H 1 4.594 0.010 . 1 . . . . . 42 P HA . 27830 1
273 . 1 . 1 39 39 PRO HB2 H 1 1.941 0.006 . 2 . . . . . 42 P HB2 . 27830 1
274 . 1 . 1 39 39 PRO HB3 H 1 2.190 0.016 . 2 . . . . . 42 P HB3 . 27830 1
275 . 1 . 1 39 39 PRO HG2 H 1 1.570 0.004 . 2 . . . . . 42 P HG2 . 27830 1
276 . 1 . 1 39 39 PRO HG3 H 1 2.362 0.000 . 2 . . . . . 42 P HG3 . 27830 1
277 . 1 . 1 39 39 PRO C C 13 175.220 0.000 . 1 . . . . . 42 P C . 27830 1
278 . 1 . 1 39 39 PRO CA C 13 62.941 0.123 . 1 . . . . . 42 P CA . 27830 1
279 . 1 . 1 39 39 PRO CB C 13 32.369 0.059 . 1 . . . . . 42 P CB . 27830 1
280 . 1 . 1 39 39 PRO CG C 13 26.358 0.000 . 1 . . . . . 42 P CG . 27830 1
281 . 1 . 1 39 39 PRO CD C 13 49.953 0.000 . 1 . . . . . 42 P CD . 27830 1
282 . 1 . 1 40 40 VAL H H 1 6.603 0.003 . 1 . . . . . 43 V H . 27830 1
283 . 1 . 1 40 40 VAL HA H 1 5.077 0.023 . 1 . . . . . 43 V HA . 27830 1
284 . 1 . 1 40 40 VAL HB H 1 2.123 0.010 . 1 . . . . . 43 V HB . 27830 1
285 . 1 . 1 40 40 VAL HG11 H 1 0.367 0.058 . 1 . . . . . 43 V MG1 . 27830 1
286 . 1 . 1 40 40 VAL HG12 H 1 0.367 0.058 . 1 . . . . . 43 V MG1 . 27830 1
287 . 1 . 1 40 40 VAL HG13 H 1 0.367 0.058 . 1 . . . . . 43 V MG1 . 27830 1
288 . 1 . 1 40 40 VAL HG21 H 1 0.672 0.065 . 1 . . . . . 43 V MG2 . 27830 1
289 . 1 . 1 40 40 VAL HG22 H 1 0.672 0.065 . 1 . . . . . 43 V MG2 . 27830 1
290 . 1 . 1 40 40 VAL HG23 H 1 0.672 0.065 . 1 . . . . . 43 V MG2 . 27830 1
291 . 1 . 1 40 40 VAL C C 13 172.756 0.000 . 1 . . . . . 43 V C . 27830 1
292 . 1 . 1 40 40 VAL CA C 13 57.603 0.089 . 1 . . . . . 43 V CA . 27830 1
293 . 1 . 1 40 40 VAL CB C 13 35.514 0.104 . 1 . . . . . 43 V CB . 27830 1
294 . 1 . 1 40 40 VAL CG1 C 13 16.882 0.099 . 2 . . . . . 43 V CG1 . 27830 1
295 . 1 . 1 40 40 VAL CG2 C 13 22.912 0.098 . 2 . . . . . 43 V CG2 . 27830 1
296 . 1 . 1 40 40 VAL N N 15 107.141 0.032 . 1 . . . . . 43 V N . 27830 1
297 . 1 . 1 41 41 GLN H H 1 8.227 0.004 . 1 . . . . . 44 Q H . 27830 1
298 . 1 . 1 41 41 GLN HA H 1 4.556 0.008 . 1 . . . . . 44 Q HA . 27830 1
299 . 1 . 1 41 41 GLN HB2 H 1 2.111 0.001 . 2 . . . . . 44 Q HB2 . 27830 1
300 . 1 . 1 41 41 GLN HB3 H 1 2.577 0.000 . 2 . . . . . 44 Q HB3 . 27830 1
301 . 1 . 1 41 41 GLN C C 13 174.249 0.000 . 1 . . . . . 44 Q C . 27830 1
302 . 1 . 1 41 41 GLN CA C 13 54.725 0.046 . 1 . . . . . 44 Q CA . 27830 1
303 . 1 . 1 41 41 GLN CB C 13 33.901 0.053 . 1 . . . . . 44 Q CB . 27830 1
304 . 1 . 1 41 41 GLN CG C 13 35.479 0.000 . 1 . . . . . 44 Q CG . 27830 1
305 . 1 . 1 41 41 GLN N N 15 111.065 0.041 . 1 . . . . . 44 Q N . 27830 1
306 . 1 . 1 42 42 LEU H H 1 9.311 0.005 . 1 . . . . . 45 L H . 27830 1
307 . 1 . 1 42 42 LEU HA H 1 5.217 0.020 . 1 . . . . . 45 L HA . 27830 1
308 . 1 . 1 42 42 LEU HB2 H 1 1.273 0.008 . 2 . . . . . 45 L HB2 . 27830 1
309 . 1 . 1 42 42 LEU HB3 H 1 1.501 0.008 . 2 . . . . . 45 L HB3 . 27830 1
310 . 1 . 1 42 42 LEU HG H 1 1.328 0.008 . 1 . . . . . 45 L HG . 27830 1
311 . 1 . 1 42 42 LEU HD11 H 1 0.224 0.007 . 1 . . . . . 45 L MD1 . 27830 1
312 . 1 . 1 42 42 LEU HD12 H 1 0.224 0.007 . 1 . . . . . 45 L MD1 . 27830 1
313 . 1 . 1 42 42 LEU HD13 H 1 0.224 0.007 . 1 . . . . . 45 L MD1 . 27830 1
314 . 1 . 1 42 42 LEU HD21 H 1 0.311 0.020 . 1 . . . . . 45 L MD2 . 27830 1
315 . 1 . 1 42 42 LEU HD22 H 1 0.311 0.020 . 1 . . . . . 45 L MD2 . 27830 1
316 . 1 . 1 42 42 LEU HD23 H 1 0.311 0.020 . 1 . . . . . 45 L MD2 . 27830 1
317 . 1 . 1 42 42 LEU C C 13 173.169 0.000 . 1 . . . . . 45 L C . 27830 1
318 . 1 . 1 42 42 LEU CA C 13 56.181 0.066 . 1 . . . . . 45 L CA . 27830 1
319 . 1 . 1 42 42 LEU CB C 13 47.496 0.091 . 1 . . . . . 45 L CB . 27830 1
320 . 1 . 1 42 42 LEU CG C 13 28.188 0.076 . 1 . . . . . 45 L CG . 27830 1
321 . 1 . 1 42 42 LEU CD1 C 13 26.237 0.178 . 2 . . . . . 45 L CD1 . 27830 1
322 . 1 . 1 42 42 LEU CD2 C 13 26.055 0.000 . 2 . . . . . 45 L CD2 . 27830 1
323 . 1 . 1 42 42 LEU N N 15 124.117 0.030 . 1 . . . . . 45 L N . 27830 1
324 . 1 . 1 43 43 ALA H H 1 8.788 0.006 . 1 . . . . . 46 A H . 27830 1
325 . 1 . 1 43 43 ALA HA H 1 5.064 0.004 . 1 . . . . . 46 A HA . 27830 1
326 . 1 . 1 43 43 ALA HB1 H 1 -0.042 0.003 . 1 . . . . . 46 A MB . 27830 1
327 . 1 . 1 43 43 ALA HB2 H 1 -0.042 0.003 . 1 . . . . . 46 A MB . 27830 1
328 . 1 . 1 43 43 ALA HB3 H 1 -0.042 0.003 . 1 . . . . . 46 A MB . 27830 1
329 . 1 . 1 43 43 ALA C C 13 175.959 0.000 . 1 . . . . . 46 A C . 27830 1
330 . 1 . 1 43 43 ALA CA C 13 49.811 0.055 . 1 . . . . . 46 A CA . 27830 1
331 . 1 . 1 43 43 ALA CB C 13 20.611 0.108 . 1 . . . . . 46 A CB . 27830 1
332 . 1 . 1 43 43 ALA N N 15 131.915 0.077 . 1 . . . . . 46 A N . 27830 1
333 . 1 . 1 44 44 GLY H H 1 7.985 0.005 . 1 . . . . . 47 G H . 27830 1
334 . 1 . 1 44 44 GLY CA C 13 45.457 0.027 . 1 . . . . . 47 G CA . 27830 1
335 . 1 . 1 44 44 GLY N N 15 103.906 0.005 . 1 . . . . . 47 G N . 27830 1
336 . 1 . 1 45 45 GLY H H 1 7.020 0.010 . 1 . . . . . 48 G H . 27830 1
337 . 1 . 1 45 45 GLY HA2 H 1 4.371 0.000 . 2 . . . . . 48 G HA2 . 27830 1
338 . 1 . 1 45 45 GLY HA3 H 1 4.109 0.005 . 2 . . . . . 48 G HA3 . 27830 1
339 . 1 . 1 45 45 GLY C C 13 180.732 0.000 . 1 . . . . . 48 G C . 27830 1
340 . 1 . 1 45 45 GLY CA C 13 45.645 0.037 . 1 . . . . . 48 G CA . 27830 1
341 . 1 . 1 45 45 GLY N N 15 103.283 0.015 . 1 . . . . . 48 G N . 27830 1
342 . 1 . 1 46 46 GLU H H 1 8.279 0.005 . 1 . . . . . 49 E H . 27830 1
343 . 1 . 1 46 46 GLU HA H 1 4.044 0.002 . 1 . . . . . 49 E HA . 27830 1
344 . 1 . 1 46 46 GLU HB2 H 1 1.290 0.006 . 2 . . . . . 49 E HB2 . 27830 1
345 . 1 . 1 46 46 GLU HB3 H 1 2.087 0.004 . 2 . . . . . 49 E HB3 . 27830 1
346 . 1 . 1 46 46 GLU C C 13 180.063 0.000 . 1 . . . . . 49 E C . 27830 1
347 . 1 . 1 46 46 GLU CA C 13 55.983 0.062 . 1 . . . . . 49 E CA . 27830 1
348 . 1 . 1 46 46 GLU CB C 13 29.754 0.113 . 1 . . . . . 49 E CB . 27830 1
349 . 1 . 1 46 46 GLU CG C 13 36.322 0.082 . 1 . . . . . 49 E CG . 27830 1
350 . 1 . 1 46 46 GLU N N 15 124.759 0.043 . 1 . . . . . 49 E N . 27830 1
351 . 1 . 1 47 47 LEU H H 1 8.402 0.007 . 1 . . . . . 50 L H . 27830 1
352 . 1 . 1 47 47 LEU HA H 1 4.242 0.010 . 1 . . . . . 50 L HA . 27830 1
353 . 1 . 1 47 47 LEU HB2 H 1 1.214 0.009 . 2 . . . . . 50 L HB2 . 27830 1
354 . 1 . 1 47 47 LEU HB3 H 1 1.848 0.025 . 2 . . . . . 50 L HB3 . 27830 1
355 . 1 . 1 47 47 LEU HG H 1 0.594 0.003 . 1 . . . . . 50 L HG . 27830 1
356 . 1 . 1 47 47 LEU HD11 H 1 0.593 0.000 . 1 . . . . . 50 L MD1 . 27830 1
357 . 1 . 1 47 47 LEU HD12 H 1 0.593 0.000 . 1 . . . . . 50 L MD1 . 27830 1
358 . 1 . 1 47 47 LEU HD13 H 1 0.593 0.000 . 1 . . . . . 50 L MD1 . 27830 1
359 . 1 . 1 47 47 LEU HD21 H 1 0.864 0.009 . 1 . . . . . 50 L MD2 . 27830 1
360 . 1 . 1 47 47 LEU HD22 H 1 0.864 0.009 . 1 . . . . . 50 L MD2 . 27830 1
361 . 1 . 1 47 47 LEU HD23 H 1 0.864 0.009 . 1 . . . . . 50 L MD2 . 27830 1
362 . 1 . 1 47 47 LEU C C 13 179.296 0.000 . 1 . . . . . 50 L C . 27830 1
363 . 1 . 1 47 47 LEU CA C 13 55.919 0.052 . 1 . . . . . 50 L CA . 27830 1
364 . 1 . 1 47 47 LEU CB C 13 43.675 0.105 . 1 . . . . . 50 L CB . 27830 1
365 . 1 . 1 47 47 LEU CG C 13 25.061 0.128 . 1 . . . . . 50 L CG . 27830 1
366 . 1 . 1 47 47 LEU CD1 C 13 24.985 0.000 . 2 . . . . . 50 L CD1 . 27830 1
367 . 1 . 1 47 47 LEU CD2 C 13 21.588 0.106 . 2 . . . . . 50 L CD2 . 27830 1
368 . 1 . 1 47 47 LEU N N 15 120.296 0.048 . 1 . . . . . 50 L N . 27830 1
369 . 1 . 1 48 48 SER H H 1 8.569 0.003 . 1 . . . . . 51 S H . 27830 1
370 . 1 . 1 48 48 SER HA H 1 3.950 0.005 . 1 . . . . . 51 S HA . 27830 1
371 . 1 . 1 48 48 SER HB2 H 1 3.997 0.009 . 2 . . . . . 51 S HB2 . 27830 1
372 . 1 . 1 48 48 SER C C 13 177.066 0.000 . 1 . . . . . 51 S C . 27830 1
373 . 1 . 1 48 48 SER CA C 13 63.612 0.083 . 1 . . . . . 51 S CA . 27830 1
374 . 1 . 1 48 48 SER CB C 13 61.591 0.043 . 1 . . . . . 51 S CB . 27830 1
375 . 1 . 1 48 48 SER N N 15 117.219 0.037 . 1 . . . . . 51 S N . 27830 1
376 . 1 . 1 49 49 THR H H 1 7.862 0.009 . 1 . . . . . 52 T H . 27830 1
377 . 1 . 1 49 49 THR HA H 1 4.567 0.016 . 1 . . . . . 52 T HA . 27830 1
378 . 1 . 1 49 49 THR HB H 1 4.497 0.003 . 1 . . . . . 52 T HB . 27830 1
379 . 1 . 1 49 49 THR HG21 H 1 1.263 0.002 . 1 . . . . . 52 T MG . 27830 1
380 . 1 . 1 49 49 THR HG22 H 1 1.263 0.002 . 1 . . . . . 52 T MG . 27830 1
381 . 1 . 1 49 49 THR HG23 H 1 1.263 0.002 . 1 . . . . . 52 T MG . 27830 1
382 . 1 . 1 49 49 THR C C 13 175.226 0.000 . 1 . . . . . 52 T C . 27830 1
383 . 1 . 1 49 49 THR CA C 13 62.104 0.091 . 1 . . . . . 52 T CA . 27830 1
384 . 1 . 1 49 49 THR CB C 13 69.109 0.113 . 1 . . . . . 52 T CB . 27830 1
385 . 1 . 1 49 49 THR CG2 C 13 21.446 0.247 . 1 . . . . . 52 T CG2 . 27830 1
386 . 1 . 1 49 49 THR N N 15 110.195 0.032 . 1 . . . . . 52 T N . 27830 1
387 . 1 . 1 50 50 LEU H H 1 7.885 0.004 . 1 . . . . . 53 L H . 27830 1
388 . 1 . 1 50 50 LEU HA H 1 4.516 0.003 . 1 . . . . . 53 L HA . 27830 1
389 . 1 . 1 50 50 LEU HD11 H 1 0.890 0.005 . 2 . . . . . 53 L MD1 . 27830 1
390 . 1 . 1 50 50 LEU HD12 H 1 0.890 0.005 . 2 . . . . . 53 L MD1 . 27830 1
391 . 1 . 1 50 50 LEU HD13 H 1 0.890 0.005 . 2 . . . . . 53 L MD1 . 27830 1
392 . 1 . 1 50 50 LEU HD21 H 1 0.800 0.012 . 2 . . . . . 53 L MD2 . 27830 1
393 . 1 . 1 50 50 LEU HD22 H 1 0.800 0.012 . 2 . . . . . 53 L MD2 . 27830 1
394 . 1 . 1 50 50 LEU HD23 H 1 0.800 0.012 . 2 . . . . . 53 L MD2 . 27830 1
395 . 1 . 1 50 50 LEU C C 13 177.013 0.000 . 1 . . . . . 53 L C . 27830 1
396 . 1 . 1 50 50 LEU CA C 13 54.203 0.067 . 1 . . . . . 53 L CA . 27830 1
397 . 1 . 1 50 50 LEU CB C 13 42.772 0.052 . 1 . . . . . 53 L CB . 27830 1
398 . 1 . 1 50 50 LEU CD1 C 13 25.725 0.054 . 2 . . . . . 53 L CD1 . 27830 1
399 . 1 . 1 50 50 LEU CD2 C 13 23.029 0.080 . 2 . . . . . 53 L CD2 . 27830 1
400 . 1 . 1 50 50 LEU N N 15 121.682 0.042 . 1 . . . . . 53 L N . 27830 1
401 . 1 . 1 51 51 VAL H H 1 7.274 0.003 . 1 . . . . . 54 V H . 27830 1
402 . 1 . 1 51 51 VAL HA H 1 3.246 0.008 . 1 . . . . . 54 V HA . 27830 1
403 . 1 . 1 51 51 VAL HB H 1 1.951 0.013 . 1 . . . . . 54 V HB . 27830 1
404 . 1 . 1 51 51 VAL HG11 H 1 0.778 0.007 . 2 . . . . . 54 V MG1 . 27830 1
405 . 1 . 1 51 51 VAL HG12 H 1 0.778 0.007 . 2 . . . . . 54 V MG1 . 27830 1
406 . 1 . 1 51 51 VAL HG13 H 1 0.778 0.007 . 2 . . . . . 54 V MG1 . 27830 1
407 . 1 . 1 51 51 VAL HG21 H 1 0.954 0.007 . 2 . . . . . 54 V MG2 . 27830 1
408 . 1 . 1 51 51 VAL HG22 H 1 0.954 0.007 . 2 . . . . . 54 V MG2 . 27830 1
409 . 1 . 1 51 51 VAL HG23 H 1 0.954 0.007 . 2 . . . . . 54 V MG2 . 27830 1
410 . 1 . 1 51 51 VAL C C 13 178.182 0.000 . 1 . . . . . 54 V C . 27830 1
411 . 1 . 1 51 51 VAL CA C 13 65.425 0.105 . 1 . . . . . 54 V CA . 27830 1
412 . 1 . 1 51 51 VAL CB C 13 31.014 0.117 . 1 . . . . . 54 V CB . 27830 1
413 . 1 . 1 51 51 VAL CG1 C 13 21.252 0.026 . 2 . . . . . 54 V CG1 . 27830 1
414 . 1 . 1 51 51 VAL CG2 C 13 22.377 0.115 . 2 . . . . . 54 V CG2 . 27830 1
415 . 1 . 1 51 51 VAL N N 15 121.756 0.041 . 1 . . . . . 54 V N . 27830 1
416 . 1 . 1 52 52 GLY H H 1 8.694 0.010 . 1 . . . . . 55 G H . 27830 1
417 . 1 . 1 52 52 GLY HA2 H 1 4.130 0.013 . 2 . . . . . 55 G HA2 . 27830 1
418 . 1 . 1 52 52 GLY HA3 H 1 3.730 0.012 . 2 . . . . . 55 G HA3 . 27830 1
419 . 1 . 1 52 52 GLY C C 13 173.554 0.000 . 1 . . . . . 55 G C . 27830 1
420 . 1 . 1 52 52 GLY CA C 13 46.277 0.032 . 1 . . . . . 55 G CA . 27830 1
421 . 1 . 1 52 52 GLY N N 15 115.042 0.139 . 1 . . . . . 55 G N . 27830 1
422 . 1 . 1 53 53 LYS H H 1 7.974 0.004 . 1 . . . . . 56 K H . 27830 1
423 . 1 . 1 53 53 LYS CA C 13 52.611 0.008 . 1 . . . . . 56 K CA . 27830 1
424 . 1 . 1 53 53 LYS CB C 13 33.594 0.000 . 1 . . . . . 56 K CB . 27830 1
425 . 1 . 1 53 53 LYS N N 15 122.535 0.039 . 1 . . . . . 56 K N . 27830 1
426 . 1 . 1 55 55 VAL HA H 1 4.164 0.006 . 1 . . . . . 58 V HA . 27830 1
427 . 1 . 1 55 55 VAL HB H 1 2.159 0.000 . 1 . . . . . 58 V HB . 27830 1
428 . 1 . 1 55 55 VAL HG11 H 1 0.455 0.003 . 2 . . . . . 58 V MG1 . 27830 1
429 . 1 . 1 55 55 VAL HG12 H 1 0.455 0.003 . 2 . . . . . 58 V MG1 . 27830 1
430 . 1 . 1 55 55 VAL HG13 H 1 0.455 0.003 . 2 . . . . . 58 V MG1 . 27830 1
431 . 1 . 1 55 55 VAL HG21 H 1 0.107 0.004 . 2 . . . . . 58 V MG2 . 27830 1
432 . 1 . 1 55 55 VAL HG22 H 1 0.107 0.004 . 2 . . . . . 58 V MG2 . 27830 1
433 . 1 . 1 55 55 VAL HG23 H 1 0.107 0.004 . 2 . . . . . 58 V MG2 . 27830 1
434 . 1 . 1 55 55 VAL C C 13 176.447 0.000 . 1 . . . . . 58 V C . 27830 1
435 . 1 . 1 55 55 VAL CA C 13 61.906 0.146 . 1 . . . . . 58 V CA . 27830 1
436 . 1 . 1 55 55 VAL CB C 13 31.518 0.000 . 1 . . . . . 58 V CB . 27830 1
437 . 1 . 1 55 55 VAL CG1 C 13 21.308 0.056 . 2 . . . . . 58 V CG1 . 27830 1
438 . 1 . 1 55 55 VAL CG2 C 13 17.638 0.121 . 2 . . . . . 58 V CG2 . 27830 1
439 . 1 . 1 56 56 ALA H H 1 7.953 0.006 . 1 . . . . . 59 A H . 27830 1
440 . 1 . 1 56 56 ALA HA H 1 4.152 0.006 . 1 . . . . . 59 A HA . 27830 1
441 . 1 . 1 56 56 ALA HB1 H 1 0.377 0.005 . 1 . . . . . 59 A MB . 27830 1
442 . 1 . 1 56 56 ALA HB2 H 1 0.377 0.005 . 1 . . . . . 59 A MB . 27830 1
443 . 1 . 1 56 56 ALA HB3 H 1 0.377 0.005 . 1 . . . . . 59 A MB . 27830 1
444 . 1 . 1 56 56 ALA C C 13 177.377 0.000 . 1 . . . . . 59 A C . 27830 1
445 . 1 . 1 56 56 ALA CA C 13 52.374 0.000 . 1 . . . . . 59 A CA . 27830 1
446 . 1 . 1 56 56 ALA CB C 13 19.283 0.000 . 1 . . . . . 59 A CB . 27830 1
447 . 1 . 1 56 56 ALA N N 15 121.088 0.006 . 1 . . . . . 59 A N . 27830 1
448 . 1 . 1 57 57 ALA H H 1 8.235 0.001 . 1 . . . . . 60 A H . 27830 1
449 . 1 . 1 57 57 ALA HA H 1 4.528 0.003 . 1 . . . . . 60 A HA . 27830 1
450 . 1 . 1 57 57 ALA HB1 H 1 1.351 0.000 . 1 . . . . . 60 A MB . 27830 1
451 . 1 . 1 57 57 ALA HB2 H 1 1.351 0.000 . 1 . . . . . 60 A MB . 27830 1
452 . 1 . 1 57 57 ALA HB3 H 1 1.351 0.000 . 1 . . . . . 60 A MB . 27830 1
453 . 1 . 1 57 57 ALA CA C 13 50.481 0.007 . 1 . . . . . 60 A CA . 27830 1
454 . 1 . 1 57 57 ALA CB C 13 17.332 0.013 . 1 . . . . . 60 A CB . 27830 1
455 . 1 . 1 57 57 ALA N N 15 121.204 0.037 . 1 . . . . . 60 A N . 27830 1
456 . 1 . 1 58 58 PRO CA C 13 61.545 0.000 . 1 . . . . . 61 P CA . 27830 1
457 . 1 . 1 58 58 PRO CB C 13 35.052 0.000 . 1 . . . . . 61 P CB . 27830 1
458 . 1 . 1 59 59 HIS H H 1 8.828 0.003 . 1 . . . . . 62 H H . 27830 1
459 . 1 . 1 59 59 HIS HA H 1 5.074 0.007 . 1 . . . . . 62 H HA . 27830 1
460 . 1 . 1 59 59 HIS HB2 H 1 2.784 0.009 . 2 . . . . . 62 H HB2 . 27830 1
461 . 1 . 1 59 59 HIS HB3 H 1 3.237 0.005 . 2 . . . . . 62 H HB3 . 27830 1
462 . 1 . 1 59 59 HIS CA C 13 54.949 0.113 . 1 . . . . . 62 H CA . 27830 1
463 . 1 . 1 59 59 HIS CB C 13 31.518 0.071 . 1 . . . . . 62 H CB . 27830 1
464 . 1 . 1 59 59 HIS N N 15 127.101 0.042 . 1 . . . . . 62 H N . 27830 1
465 . 1 . 1 60 60 THR H H 1 8.430 0.003 . 1 . . . . . 63 T H . 27830 1
466 . 1 . 1 60 60 THR HA H 1 4.880 0.106 . 1 . . . . . 63 T HA . 27830 1
467 . 1 . 1 60 60 THR HB H 1 3.940 0.004 . 1 . . . . . 63 T HB . 27830 1
468 . 1 . 1 60 60 THR HG21 H 1 0.901 0.001 . 1 . . . . . 63 T MG . 27830 1
469 . 1 . 1 60 60 THR HG22 H 1 0.901 0.001 . 1 . . . . . 63 T MG . 27830 1
470 . 1 . 1 60 60 THR HG23 H 1 0.901 0.001 . 1 . . . . . 63 T MG . 27830 1
471 . 1 . 1 60 60 THR C C 13 173.351 0.000 . 1 . . . . . 63 T C . 27830 1
472 . 1 . 1 60 60 THR CA C 13 58.903 0.213 . 1 . . . . . 63 T CA . 27830 1
473 . 1 . 1 60 60 THR CB C 13 71.073 0.117 . 1 . . . . . 63 T CB . 27830 1
474 . 1 . 1 60 60 THR CG2 C 13 21.247 0.000 . 1 . . . . . 63 T CG2 . 27830 1
475 . 1 . 1 60 60 THR N N 15 109.104 0.016 . 1 . . . . . 63 T N . 27830 1
476 . 1 . 1 61 61 HIS H H 1 8.857 0.028 . 1 . . . . . 64 H H . 27830 1
477 . 1 . 1 61 61 HIS HA H 1 5.418 0.003 . 1 . . . . . 64 H HA . 27830 1
478 . 1 . 1 61 61 HIS HB2 H 1 3.077 0.007 . 2 . . . . . 64 H HB2 . 27830 1
479 . 1 . 1 61 61 HIS HB3 H 1 3.205 0.013 . 2 . . . . . 64 H HB3 . 27830 1
480 . 1 . 1 61 61 HIS C C 13 174.329 0.000 . 1 . . . . . 64 H C . 27830 1
481 . 1 . 1 61 61 HIS CA C 13 53.188 0.053 . 1 . . . . . 64 H CA . 27830 1
482 . 1 . 1 61 61 HIS CB C 13 31.440 0.021 . 1 . . . . . 64 H CB . 27830 1
483 . 1 . 1 61 61 HIS N N 15 115.899 0.033 . 1 . . . . . 64 H N . 27830 1
484 . 1 . 1 62 62 PRO HA H 1 4.599 0.005 . 1 . . . . . 65 P HA . 27830 1
485 . 1 . 1 62 62 PRO HB2 H 1 2.119 0.007 . 2 . . . . . 65 P HB2 . 27830 1
486 . 1 . 1 62 62 PRO HB3 H 1 2.579 0.003 . 2 . . . . . 65 P HB3 . 27830 1
487 . 1 . 1 62 62 PRO HG2 H 1 1.935 0.002 . 2 . . . . . 65 P HG2 . 27830 1
488 . 1 . 1 62 62 PRO HG3 H 1 1.984 0.000 . 2 . . . . . 65 P HG3 . 27830 1
489 . 1 . 1 62 62 PRO HD2 H 1 3.517 0.000 . 2 . . . . . 65 P HD2 . 27830 1
490 . 1 . 1 62 62 PRO HD3 H 1 3.624 0.000 . 2 . . . . . 65 P HD3 . 27830 1
491 . 1 . 1 62 62 PRO C C 13 177.796 0.000 . 1 . . . . . 65 P C . 27830 1
492 . 1 . 1 62 62 PRO CA C 13 62.465 0.053 . 1 . . . . . 65 P CA . 27830 1
493 . 1 . 1 62 62 PRO CB C 13 34.864 0.100 . 1 . . . . . 65 P CB . 27830 1
494 . 1 . 1 62 62 PRO CG C 13 24.991 0.109 . 1 . . . . . 65 P CG . 27830 1
495 . 1 . 1 62 62 PRO CD C 13 50.395 0.083 . 1 . . . . . 65 P CD . 27830 1
496 . 1 . 1 64 64 ASP H H 1 9.548 0.004 . 1 . . . . . 67 D H . 27830 1
497 . 1 . 1 64 64 ASP CA C 13 58.309 0.000 . 1 . . . . . 67 D CA . 27830 1
498 . 1 . 1 64 64 ASP CB C 13 39.772 0.000 . 1 . . . . . 67 D CB . 27830 1
499 . 1 . 1 64 64 ASP N N 15 123.859 0.042 . 1 . . . . . 67 D N . 27830 1
500 . 1 . 1 66 66 LEU H H 1 7.868 0.011 . 1 . . . . . 69 L H . 27830 1
501 . 1 . 1 66 66 LEU N N 15 128.118 0.050 . 1 . . . . . 69 L N . 27830 1
502 . 1 . 1 67 67 TYR HA H 1 4.346 0.000 . 1 . . . . . 70 Y HA . 27830 1
503 . 1 . 1 67 67 TYR HB2 H 1 2.517 0.000 . 2 . . . . . 70 Y HB2 . 27830 1
504 . 1 . 1 67 67 TYR C C 13 174.463 0.000 . 1 . . . . . 70 Y C . 27830 1
505 . 1 . 1 67 67 TYR CA C 13 57.780 0.032 . 1 . . . . . 70 Y CA . 27830 1
506 . 1 . 1 67 67 TYR CB C 13 39.047 0.000 . 1 . . . . . 70 Y CB . 27830 1
507 . 1 . 1 68 68 LEU H H 1 9.100 0.003 . 1 . . . . . 71 L H . 27830 1
508 . 1 . 1 68 68 LEU HA H 1 4.998 0.005 . 1 . . . . . 71 L HA . 27830 1
509 . 1 . 1 68 68 LEU HB2 H 1 1.069 0.006 . 2 . . . . . 71 L HB2 . 27830 1
510 . 1 . 1 68 68 LEU HB3 H 1 1.796 0.007 . 2 . . . . . 71 L HB3 . 27830 1
511 . 1 . 1 68 68 LEU C C 13 172.687 0.000 . 1 . . . . . 71 L C . 27830 1
512 . 1 . 1 68 68 LEU CA C 13 53.554 0.069 . 1 . . . . . 71 L CA . 27830 1
513 . 1 . 1 68 68 LEU CB C 13 44.783 0.142 . 1 . . . . . 71 L CB . 27830 1
514 . 1 . 1 68 68 LEU N N 15 124.133 0.066 . 1 . . . . . 71 L N . 27830 1
515 . 1 . 1 69 69 LEU H H 1 9.004 0.108 . 1 . . . . . 72 L H . 27830 1
516 . 1 . 1 69 69 LEU HA H 1 5.319 0.006 . 1 . . . . . 72 L HA . 27830 1
517 . 1 . 1 69 69 LEU HB2 H 1 0.860 0.012 . 2 . . . . . 72 L HB2 . 27830 1
518 . 1 . 1 69 69 LEU HB3 H 1 1.866 0.007 . 2 . . . . . 72 L HB3 . 27830 1
519 . 1 . 1 69 69 LEU C C 13 174.631 0.000 . 1 . . . . . 72 L C . 27830 1
520 . 1 . 1 69 69 LEU CA C 13 53.128 0.085 . 1 . . . . . 72 L CA . 27830 1
521 . 1 . 1 69 69 LEU CB C 13 45.857 0.092 . 1 . . . . . 72 L CB . 27830 1
522 . 1 . 1 69 69 LEU N N 15 130.364 0.076 . 1 . . . . . 72 L N . 27830 1
523 . 1 . 1 70 70 VAL H H 1 8.567 0.003 . 1 . . . . . 73 V H . 27830 1
524 . 1 . 1 70 70 VAL HA H 1 4.752 0.006 . 1 . . . . . 73 V HA . 27830 1
525 . 1 . 1 70 70 VAL HB H 1 1.951 0.009 . 1 . . . . . 73 V HB . 27830 1
526 . 1 . 1 70 70 VAL HG11 H 1 0.430 0.001 . 2 . . . . . 73 V MG1 . 27830 1
527 . 1 . 1 70 70 VAL HG12 H 1 0.430 0.001 . 2 . . . . . 73 V MG1 . 27830 1
528 . 1 . 1 70 70 VAL HG13 H 1 0.430 0.001 . 2 . . . . . 73 V MG1 . 27830 1
529 . 1 . 1 70 70 VAL HG21 H 1 0.347 0.002 . 2 . . . . . 73 V MG2 . 27830 1
530 . 1 . 1 70 70 VAL HG22 H 1 0.347 0.002 . 2 . . . . . 73 V MG2 . 27830 1
531 . 1 . 1 70 70 VAL HG23 H 1 0.347 0.002 . 2 . . . . . 73 V MG2 . 27830 1
532 . 1 . 1 70 70 VAL C C 13 172.765 0.000 . 1 . . . . . 73 V C . 27830 1
533 . 1 . 1 70 70 VAL CA C 13 59.444 0.036 . 1 . . . . . 73 V CA . 27830 1
534 . 1 . 1 70 70 VAL CB C 13 36.101 0.086 . 1 . . . . . 73 V CB . 27830 1
535 . 1 . 1 70 70 VAL CG1 C 13 20.958 0.105 . 2 . . . . . 73 V CG1 . 27830 1
536 . 1 . 1 70 70 VAL CG2 C 13 19.122 0.133 . 2 . . . . . 73 V CG2 . 27830 1
537 . 1 . 1 70 70 VAL N N 15 117.684 0.051 . 1 . . . . . 73 V N . 27830 1
538 . 1 . 1 71 71 SER H H 1 7.813 0.007 . 1 . . . . . 74 S H . 27830 1
539 . 1 . 1 71 71 SER CA C 13 58.302 0.012 . 1 . . . . . 74 S CA . 27830 1
540 . 1 . 1 71 71 SER CB C 13 64.090 0.000 . 1 . . . . . 74 S CB . 27830 1
541 . 1 . 1 71 71 SER N N 15 115.325 0.044 . 1 . . . . . 74 S N . 27830 1
542 . 1 . 1 72 72 PRO HA H 1 4.044 0.011 . 1 . . . . . 75 P HA . 27830 1
543 . 1 . 1 72 72 PRO HB2 H 1 1.872 0.000 . 2 . . . . . 75 P HB2 . 27830 1
544 . 1 . 1 72 72 PRO HB3 H 1 2.267 0.000 . 2 . . . . . 75 P HB3 . 27830 1
545 . 1 . 1 72 72 PRO C C 13 176.848 0.000 . 1 . . . . . 75 P C . 27830 1
546 . 1 . 1 72 72 PRO CA C 13 66.782 0.096 . 1 . . . . . 75 P CA . 27830 1
547 . 1 . 1 72 72 PRO CB C 13 32.564 0.051 . 1 . . . . . 75 P CB . 27830 1
548 . 1 . 1 72 72 PRO CG C 13 28.270 0.000 . 1 . . . . . 75 P CG . 27830 1
549 . 1 . 1 72 72 PRO CD C 13 50.180 0.000 . 1 . . . . . 75 P CD . 27830 1
550 . 1 . 1 73 73 ASN H H 1 9.912 0.003 . 1 . . . . . 76 N H . 27830 1
551 . 1 . 1 73 73 ASN HA H 1 4.992 0.014 . 1 . . . . . 76 N HA . 27830 1
552 . 1 . 1 73 73 ASN HB2 H 1 2.378 0.002 . 2 . . . . . 76 N HB2 . 27830 1
553 . 1 . 1 73 73 ASN HB3 H 1 2.978 0.016 . 2 . . . . . 76 N HB3 . 27830 1
554 . 1 . 1 73 73 ASN C C 13 175.364 0.000 . 1 . . . . . 76 N C . 27830 1
555 . 1 . 1 73 73 ASN CA C 13 52.058 0.069 . 1 . . . . . 76 N CA . 27830 1
556 . 1 . 1 73 73 ASN CB C 13 40.948 0.074 . 1 . . . . . 76 N CB . 27830 1
557 . 1 . 1 73 73 ASN N N 15 114.850 0.037 . 1 . . . . . 76 N N . 27830 1
558 . 1 . 1 74 74 LYS H H 1 9.005 0.006 . 1 . . . . . 77 K H . 27830 1
559 . 1 . 1 74 74 LYS HA H 1 4.079 0.006 . 1 . . . . . 77 K HA . 27830 1
560 . 1 . 1 74 74 LYS HB2 H 1 1.854 0.005 . 2 . . . . . 77 K HB2 . 27830 1
561 . 1 . 1 74 74 LYS HB3 H 1 1.946 0.001 . 2 . . . . . 77 K HB3 . 27830 1
562 . 1 . 1 74 74 LYS HG2 H 1 1.450 0.002 . 2 . . . . . 77 K HG2 . 27830 1
563 . 1 . 1 74 74 LYS HG3 H 1 1.721 0.006 . 2 . . . . . 77 K HG3 . 27830 1
564 . 1 . 1 74 74 LYS HD2 H 1 1.819 0.013 . 2 . . . . . 77 K HD2 . 27830 1
565 . 1 . 1 74 74 LYS HD3 H 1 1.874 0.006 . 2 . . . . . 77 K HD3 . 27830 1
566 . 1 . 1 74 74 LYS HE2 H 1 3.143 0.008 . 2 . . . . . 77 K HE2 . 27830 1
567 . 1 . 1 74 74 LYS HE3 H 1 3.171 0.013 . 2 . . . . . 77 K HE3 . 27830 1
568 . 1 . 1 74 74 LYS C C 13 177.810 0.000 . 1 . . . . . 77 K C . 27830 1
569 . 1 . 1 74 74 LYS CA C 13 58.848 0.083 . 1 . . . . . 77 K CA . 27830 1
570 . 1 . 1 74 74 LYS CB C 13 32.097 0.070 . 1 . . . . . 77 K CB . 27830 1
571 . 1 . 1 74 74 LYS CG C 13 25.182 0.052 . 1 . . . . . 77 K CG . 27830 1
572 . 1 . 1 74 74 LYS CD C 13 29.703 0.086 . 1 . . . . . 77 K CD . 27830 1
573 . 1 . 1 74 74 LYS CE C 13 42.434 0.084 . 1 . . . . . 77 K CE . 27830 1
574 . 1 . 1 74 74 LYS N N 15 126.484 0.063 . 1 . . . . . 77 K N . 27830 1
575 . 1 . 1 75 75 GLY H H 1 8.959 0.007 . 1 . . . . . 78 G H . 27830 1
576 . 1 . 1 75 75 GLY HA2 H 1 4.124 0.004 . 2 . . . . . 78 G HA2 . 27830 1
577 . 1 . 1 75 75 GLY HA3 H 1 3.743 0.004 . 2 . . . . . 78 G HA3 . 27830 1
578 . 1 . 1 75 75 GLY C C 13 174.281 0.000 . 1 . . . . . 78 G C . 27830 1
579 . 1 . 1 75 75 GLY CA C 13 45.873 0.076 . 1 . . . . . 78 G CA . 27830 1
580 . 1 . 1 75 75 GLY N N 15 116.622 0.012 . 1 . . . . . 78 G N . 27830 1
581 . 1 . 1 76 76 GLY H H 1 8.046 0.003 . 1 . . . . . 79 G H . 27830 1
582 . 1 . 1 76 76 GLY HA2 H 1 3.905 0.061 . 2 . . . . . 79 G HA2 . 27830 1
583 . 1 . 1 76 76 GLY HA3 H 1 3.798 0.032 . 2 . . . . . 79 G HA3 . 27830 1
584 . 1 . 1 76 76 GLY C C 13 172.881 0.000 . 1 . . . . . 79 G C . 27830 1
585 . 1 . 1 76 76 GLY CA C 13 45.413 0.043 . 1 . . . . . 79 G CA . 27830 1
586 . 1 . 1 76 76 GLY N N 15 106.787 0.024 . 1 . . . . . 79 G N . 27830 1
587 . 1 . 1 77 77 ALA H H 1 7.816 0.004 . 1 . . . . . 80 A H . 27830 1
588 . 1 . 1 77 77 ALA HA H 1 4.931 0.007 . 1 . . . . . 80 A HA . 27830 1
589 . 1 . 1 77 77 ALA HB1 H 1 1.394 0.005 . 1 . . . . . 80 A MB . 27830 1
590 . 1 . 1 77 77 ALA HB2 H 1 1.394 0.005 . 1 . . . . . 80 A MB . 27830 1
591 . 1 . 1 77 77 ALA HB3 H 1 1.394 0.005 . 1 . . . . . 80 A MB . 27830 1
592 . 1 . 1 77 77 ALA C C 13 174.369 0.000 . 1 . . . . . 80 A C . 27830 1
593 . 1 . 1 77 77 ALA CA C 13 50.433 0.081 . 1 . . . . . 80 A CA . 27830 1
594 . 1 . 1 77 77 ALA CB C 13 21.868 0.092 . 1 . . . . . 80 A CB . 27830 1
595 . 1 . 1 77 77 ALA N N 15 121.502 0.212 . 1 . . . . . 80 A N . 27830 1
596 . 1 . 1 78 78 ARG H H 1 8.883 0.006 . 1 . . . . . 81 R H . 27830 1
597 . 1 . 1 78 78 ARG HA H 1 5.498 0.006 . 1 . . . . . 81 R HA . 27830 1
598 . 1 . 1 78 78 ARG C C 13 176.026 0.000 . 1 . . . . . 81 R C . 27830 1
599 . 1 . 1 78 78 ARG CA C 13 54.723 0.077 . 1 . . . . . 81 R CA . 27830 1
600 . 1 . 1 78 78 ARG CB C 13 35.618 0.077 . 1 . . . . . 81 R CB . 27830 1
601 . 1 . 1 78 78 ARG CG C 13 27.885 0.083 . 1 . . . . . 81 R CG . 27830 1
602 . 1 . 1 78 78 ARG CD C 13 43.463 0.069 . 1 . . . . . 81 R CD . 27830 1
603 . 1 . 1 78 78 ARG N N 15 120.816 0.033 . 1 . . . . . 81 R N . 27830 1
604 . 1 . 1 79 79 ILE H H 1 9.021 0.005 . 1 . . . . . 82 I H . 27830 1
605 . 1 . 1 79 79 ILE HA H 1 5.338 0.007 . 1 . . . . . 82 I HA . 27830 1
606 . 1 . 1 79 79 ILE HB H 1 1.989 0.003 . 1 . . . . . 82 I HB . 27830 1
607 . 1 . 1 79 79 ILE HD11 H 1 0.343 0.005 . 1 . . . . . 82 I MD . 27830 1
608 . 1 . 1 79 79 ILE HD12 H 1 0.343 0.005 . 1 . . . . . 82 I MD . 27830 1
609 . 1 . 1 79 79 ILE HD13 H 1 0.343 0.005 . 1 . . . . . 82 I MD . 27830 1
610 . 1 . 1 79 79 ILE C C 13 172.764 0.000 . 1 . . . . . 82 I C . 27830 1
611 . 1 . 1 79 79 ILE CA C 13 58.598 0.087 . 1 . . . . . 82 I CA . 27830 1
612 . 1 . 1 79 79 ILE CB C 13 41.430 0.071 . 1 . . . . . 82 I CB . 27830 1
613 . 1 . 1 79 79 ILE CG1 C 13 25.337 0.033 . 1 . . . . . 82 I CG1 . 27830 1
614 . 1 . 1 79 79 ILE CG2 C 13 17.072 0.004 . 1 . . . . . 82 I CG2 . 27830 1
615 . 1 . 1 79 79 ILE CD1 C 13 12.655 0.132 . 1 . . . . . 82 I CD1 . 27830 1
616 . 1 . 1 79 79 ILE N N 15 117.809 0.041 . 1 . . . . . 82 I N . 27830 1
617 . 1 . 1 80 80 GLU H H 1 9.475 0.009 . 1 . . . . . 83 E H . 27830 1
618 . 1 . 1 80 80 GLU HA H 1 5.253 0.000 . 1 . . . . . 83 E HA . 27830 1
619 . 1 . 1 80 80 GLU C C 13 175.841 0.000 . 1 . . . . . 83 E C . 27830 1
620 . 1 . 1 80 80 GLU CA C 13 54.114 0.012 . 1 . . . . . 83 E CA . 27830 1
621 . 1 . 1 80 80 GLU CB C 13 33.568 0.000 . 1 . . . . . 83 E CB . 27830 1
622 . 1 . 1 80 80 GLU N N 15 121.720 0.047 . 1 . . . . . 83 E N . 27830 1
623 . 1 . 1 81 81 VAL H H 1 9.677 0.009 . 1 . . . . . 84 V H . 27830 1
624 . 1 . 1 81 81 VAL HA H 1 4.929 0.000 . 1 . . . . . 84 V HA . 27830 1
625 . 1 . 1 81 81 VAL HB H 1 1.925 0.000 . 1 . . . . . 84 V HB . 27830 1
626 . 1 . 1 81 81 VAL C C 13 175.679 0.000 . 1 . . . . . 84 V C . 27830 1
627 . 1 . 1 81 81 VAL CA C 13 61.437 0.008 . 1 . . . . . 84 V CA . 27830 1
628 . 1 . 1 81 81 VAL CB C 13 34.847 0.000 . 1 . . . . . 84 V CB . 27830 1
629 . 1 . 1 81 81 VAL N N 15 128.293 0.042 . 1 . . . . . 84 V N . 27830 1
630 . 1 . 1 82 82 GLN H H 1 8.824 0.009 . 1 . . . . . 85 Q H . 27830 1
631 . 1 . 1 82 82 GLN HA H 1 5.129 0.008 . 1 . . . . . 85 Q HA . 27830 1
632 . 1 . 1 82 82 GLN HB2 H 1 2.021 0.009 . 2 . . . . . 85 Q HB2 . 27830 1
633 . 1 . 1 82 82 GLN C C 13 175.066 0.000 . 1 . . . . . 85 Q C . 27830 1
634 . 1 . 1 82 82 GLN CA C 13 54.477 0.072 . 1 . . . . . 85 Q CA . 27830 1
635 . 1 . 1 82 82 GLN CB C 13 29.757 0.104 . 1 . . . . . 85 Q CB . 27830 1
636 . 1 . 1 82 82 GLN N N 15 127.361 0.064 . 1 . . . . . 85 Q N . 27830 1
637 . 1 . 1 83 83 LEU H H 1 9.070 0.010 . 1 . . . . . 86 L H . 27830 1
638 . 1 . 1 83 83 LEU HA H 1 5.047 0.002 . 1 . . . . . 86 L HA . 27830 1
639 . 1 . 1 83 83 LEU HB2 H 1 1.334 0.002 . 2 . . . . . 86 L HB2 . 27830 1
640 . 1 . 1 83 83 LEU HB3 H 1 1.942 0.000 . 2 . . . . . 86 L HB3 . 27830 1
641 . 1 . 1 83 83 LEU C C 13 175.885 0.000 . 1 . . . . . 86 L C . 27830 1
642 . 1 . 1 83 83 LEU CA C 13 54.373 0.140 . 1 . . . . . 86 L CA . 27830 1
643 . 1 . 1 83 83 LEU CB C 13 45.227 0.071 . 1 . . . . . 86 L CB . 27830 1
644 . 1 . 1 83 83 LEU N N 15 124.895 0.041 . 1 . . . . . 86 L N . 27830 1
645 . 1 . 1 84 84 ASP H H 1 9.559 0.007 . 1 . . . . . 87 D H . 27830 1
646 . 1 . 1 84 84 ASP HA H 1 4.449 0.006 . 1 . . . . . 87 D HA . 27830 1
647 . 1 . 1 84 84 ASP HB2 H 1 2.666 0.004 . 2 . . . . . 87 D HB2 . 27830 1
648 . 1 . 1 84 84 ASP HB3 H 1 3.010 0.003 . 2 . . . . . 87 D HB3 . 27830 1
649 . 1 . 1 84 84 ASP C C 13 175.771 0.000 . 1 . . . . . 87 D C . 27830 1
650 . 1 . 1 84 84 ASP CA C 13 56.152 0.111 . 1 . . . . . 87 D CA . 27830 1
651 . 1 . 1 84 84 ASP CB C 13 40.491 0.099 . 1 . . . . . 87 D CB . 27830 1
652 . 1 . 1 84 84 ASP N N 15 128.266 0.082 . 1 . . . . . 87 D N . 27830 1
653 . 1 . 1 85 85 GLY H H 1 8.729 0.003 . 1 . . . . . 88 G H . 27830 1
654 . 1 . 1 85 85 GLY HA2 H 1 3.638 0.003 . 2 . . . . . 88 G HA2 . 27830 1
655 . 1 . 1 85 85 GLY HA3 H 1 4.185 0.007 . 2 . . . . . 88 G HA3 . 27830 1
656 . 1 . 1 85 85 GLY C C 13 174.091 0.000 . 1 . . . . . 88 G C . 27830 1
657 . 1 . 1 85 85 GLY CA C 13 45.661 0.088 . 1 . . . . . 88 G CA . 27830 1
658 . 1 . 1 85 85 GLY N N 15 103.536 0.052 . 1 . . . . . 88 G N . 27830 1
659 . 1 . 1 86 86 ARG H H 1 7.886 0.006 . 1 . . . . . 89 R H . 27830 1
660 . 1 . 1 86 86 ARG HA H 1 4.579 0.003 . 1 . . . . . 89 R HA . 27830 1
661 . 1 . 1 86 86 ARG HB2 H 1 1.740 0.020 . 2 . . . . . 89 R HB2 . 27830 1
662 . 1 . 1 86 86 ARG HB3 H 1 1.911 0.006 . 2 . . . . . 89 R HB3 . 27830 1
663 . 1 . 1 86 86 ARG HG2 H 1 1.556 0.018 . 2 . . . . . 89 R HG2 . 27830 1
664 . 1 . 1 86 86 ARG HG3 H 1 1.672 0.006 . 2 . . . . . 89 R HG3 . 27830 1
665 . 1 . 1 86 86 ARG HD2 H 1 3.290 0.000 . 2 . . . . . 89 R HD2 . 27830 1
666 . 1 . 1 86 86 ARG HD3 H 1 3.307 0.000 . 2 . . . . . 89 R HD3 . 27830 1
667 . 1 . 1 86 86 ARG C C 13 174.490 0.000 . 1 . . . . . 89 R C . 27830 1
668 . 1 . 1 86 86 ARG CA C 13 54.780 0.095 . 1 . . . . . 89 R CA . 27830 1
669 . 1 . 1 86 86 ARG CB C 13 32.571 0.090 . 1 . . . . . 89 R CB . 27830 1
670 . 1 . 1 86 86 ARG CG C 13 27.270 0.138 . 1 . . . . . 89 R CG . 27830 1
671 . 1 . 1 86 86 ARG CD C 13 43.571 0.062 . 1 . . . . . 89 R CD . 27830 1
672 . 1 . 1 86 86 ARG N N 15 121.008 0.038 . 1 . . . . . 89 R N . 27830 1
673 . 1 . 1 87 87 ARG H H 1 8.212 0.005 . 1 . . . . . 90 R H . 27830 1
674 . 1 . 1 87 87 ARG HA H 1 4.946 0.002 . 1 . . . . . 90 R HA . 27830 1
675 . 1 . 1 87 87 ARG C C 13 175.090 0.000 . 1 . . . . . 90 R C . 27830 1
676 . 1 . 1 87 87 ARG CA C 13 55.218 0.103 . 1 . . . . . 90 R CA . 27830 1
677 . 1 . 1 87 87 ARG CB C 13 32.397 0.044 . 1 . . . . . 90 R CB . 27830 1
678 . 1 . 1 87 87 ARG CG C 13 27.847 0.000 . 1 . . . . . 90 R CG . 27830 1
679 . 1 . 1 87 87 ARG CD C 13 43.114 0.000 . 1 . . . . . 90 R CD . 27830 1
680 . 1 . 1 87 87 ARG N N 15 120.709 0.040 . 1 . . . . . 90 R N . 27830 1
681 . 1 . 1 88 88 HIS H H 1 8.965 0.007 . 1 . . . . . 91 H H . 27830 1
682 . 1 . 1 88 88 HIS C C 13 174.105 0.000 . 1 . . . . . 91 H C . 27830 1
683 . 1 . 1 88 88 HIS CA C 13 55.188 0.037 . 1 . . . . . 91 H CA . 27830 1
684 . 1 . 1 88 88 HIS CB C 13 34.140 0.011 . 1 . . . . . 91 H CB . 27830 1
685 . 1 . 1 88 88 HIS N N 15 122.781 0.100 . 1 . . . . . 91 H N . 27830 1
686 . 1 . 1 89 89 GLU H H 1 8.943 0.004 . 1 . . . . . 92 E H . 27830 1
687 . 1 . 1 89 89 GLU HA H 1 5.246 0.004 . 1 . . . . . 92 E HA . 27830 1
688 . 1 . 1 89 89 GLU HB2 H 1 1.921 0.007 . 2 . . . . . 92 E HB2 . 27830 1
689 . 1 . 1 89 89 GLU HG2 H 1 1.982 0.004 . 2 . . . . . 92 E HG2 . 27830 1
690 . 1 . 1 89 89 GLU HG3 H 1 2.215 0.005 . 2 . . . . . 92 E HG3 . 27830 1
691 . 1 . 1 89 89 GLU C C 13 175.139 0.000 . 1 . . . . . 92 E C . 27830 1
692 . 1 . 1 89 89 GLU CA C 13 55.840 0.095 . 1 . . . . . 92 E CA . 27830 1
693 . 1 . 1 89 89 GLU CB C 13 32.301 0.096 . 1 . . . . . 92 E CB . 27830 1
694 . 1 . 1 89 89 GLU CG C 13 37.316 0.115 . 1 . . . . . 92 E CG . 27830 1
695 . 1 . 1 89 89 GLU N N 15 123.171 0.099 . 1 . . . . . 92 E N . 27830 1
696 . 1 . 1 90 90 LEU H H 1 9.004 0.013 . 1 . . . . . 93 L H . 27830 1
697 . 1 . 1 90 90 LEU HA H 1 4.754 0.008 . 1 . . . . . 93 L HA . 27830 1
698 . 1 . 1 90 90 LEU HB2 H 1 1.333 0.010 . 2 . . . . . 93 L HB2 . 27830 1
699 . 1 . 1 90 90 LEU C C 13 173.950 0.000 . 1 . . . . . 93 L C . 27830 1
700 . 1 . 1 90 90 LEU CA C 13 53.863 0.061 . 1 . . . . . 93 L CA . 27830 1
701 . 1 . 1 90 90 LEU CB C 13 45.858 0.112 . 1 . . . . . 93 L CB . 27830 1
702 . 1 . 1 90 90 LEU N N 15 124.660 0.065 . 1 . . . . . 93 L N . 27830 1
703 . 1 . 1 91 91 LEU H H 1 8.497 0.006 . 1 . . . . . 94 L H . 27830 1
704 . 1 . 1 91 91 LEU HA H 1 5.159 0.005 . 1 . . . . . 94 L HA . 27830 1
705 . 1 . 1 91 91 LEU HB2 H 1 1.592 0.010 . 2 . . . . . 94 L HB2 . 27830 1
706 . 1 . 1 91 91 LEU HB3 H 1 1.673 0.018 . 2 . . . . . 94 L HB3 . 27830 1
707 . 1 . 1 91 91 LEU C C 13 176.695 0.000 . 1 . . . . . 94 L C . 27830 1
708 . 1 . 1 91 91 LEU CA C 13 52.980 0.101 . 1 . . . . . 94 L CA . 27830 1
709 . 1 . 1 91 91 LEU CB C 13 45.593 0.092 . 1 . . . . . 94 L CB . 27830 1
710 . 1 . 1 91 91 LEU N N 15 124.530 0.052 . 1 . . . . . 94 L N . 27830 1
711 . 1 . 1 92 92 SER H H 1 8.572 0.007 . 1 . . . . . 95 S H . 27830 1
712 . 1 . 1 92 92 SER HA H 1 4.200 0.009 . 1 . . . . . 95 S HA . 27830 1
713 . 1 . 1 92 92 SER HB2 H 1 3.730 0.011 . 2 . . . . . 95 S HB2 . 27830 1
714 . 1 . 1 92 92 SER HB3 H 1 4.012 0.007 . 2 . . . . . 95 S HB3 . 27830 1
715 . 1 . 1 92 92 SER C C 13 173.011 0.000 . 1 . . . . . 95 S C . 27830 1
716 . 1 . 1 92 92 SER CA C 13 56.296 0.074 . 1 . . . . . 95 S CA . 27830 1
717 . 1 . 1 92 92 SER CB C 13 62.776 0.033 . 1 . . . . . 95 S CB . 27830 1
718 . 1 . 1 92 92 SER N N 15 116.031 0.047 . 1 . . . . . 95 S N . 27830 1
719 . 1 . 1 93 93 PRO HA H 1 5.567 0.005 . 1 . . . . . 96 P HA . 27830 1
720 . 1 . 1 93 93 PRO HB2 H 1 2.092 0.010 . 2 . . . . . 96 P HB2 . 27830 1
721 . 1 . 1 93 93 PRO HB3 H 1 2.815 0.014 . 2 . . . . . 96 P HB3 . 27830 1
722 . 1 . 1 93 93 PRO HG2 H 1 2.239 0.006 . 2 . . . . . 96 P HG2 . 27830 1
723 . 1 . 1 93 93 PRO HG3 H 1 2.386 0.008 . 2 . . . . . 96 P HG3 . 27830 1
724 . 1 . 1 93 93 PRO HD2 H 1 3.843 0.006 . 2 . . . . . 96 P HD2 . 27830 1
725 . 1 . 1 93 93 PRO HD3 H 1 4.056 0.006 . 2 . . . . . 96 P HD3 . 27830 1
726 . 1 . 1 93 93 PRO C C 13 174.865 0.000 . 1 . . . . . 96 P C . 27830 1
727 . 1 . 1 93 93 PRO CA C 13 61.736 0.094 . 1 . . . . . 96 P CA . 27830 1
728 . 1 . 1 93 93 PRO CB C 13 34.395 0.082 . 1 . . . . . 96 P CB . 27830 1
729 . 1 . 1 93 93 PRO CG C 13 25.132 0.138 . 1 . . . . . 96 P CG . 27830 1
730 . 1 . 1 93 93 PRO CD C 13 50.738 0.053 . 1 . . . . . 96 P CD . 27830 1
731 . 1 . 1 94 94 ALA H H 1 8.812 0.005 . 1 . . . . . 97 A H . 27830 1
732 . 1 . 1 94 94 ALA HA H 1 5.057 0.015 . 1 . . . . . 97 A HA . 27830 1
733 . 1 . 1 94 94 ALA HB1 H 1 1.537 0.008 . 1 . . . . . 97 A MB . 27830 1
734 . 1 . 1 94 94 ALA HB2 H 1 1.537 0.008 . 1 . . . . . 97 A MB . 27830 1
735 . 1 . 1 94 94 ALA HB3 H 1 1.537 0.008 . 1 . . . . . 97 A MB . 27830 1
736 . 1 . 1 94 94 ALA C C 13 175.036 0.000 . 1 . . . . . 97 A C . 27830 1
737 . 1 . 1 94 94 ALA CA C 13 52.360 0.064 . 1 . . . . . 97 A CA . 27830 1
738 . 1 . 1 94 94 ALA CB C 13 24.541 0.073 . 1 . . . . . 97 A CB . 27830 1
739 . 1 . 1 94 94 ALA N N 15 121.074 0.043 . 1 . . . . . 97 A N . 27830 1
740 . 1 . 1 95 95 VAL H H 1 8.289 0.006 . 1 . . . . . 98 V H . 27830 1
741 . 1 . 1 95 95 VAL HA H 1 5.805 0.007 . 1 . . . . . 98 V HA . 27830 1
742 . 1 . 1 95 95 VAL HB H 1 2.051 0.005 . 1 . . . . . 98 V HB . 27830 1
743 . 1 . 1 95 95 VAL HG11 H 1 1.145 0.010 . 2 . . . . . 98 V MG1 . 27830 1
744 . 1 . 1 95 95 VAL HG12 H 1 1.145 0.010 . 2 . . . . . 98 V MG1 . 27830 1
745 . 1 . 1 95 95 VAL HG13 H 1 1.145 0.010 . 2 . . . . . 98 V MG1 . 27830 1
746 . 1 . 1 95 95 VAL HG21 H 1 1.184 0.003 . 2 . . . . . 98 V MG2 . 27830 1
747 . 1 . 1 95 95 VAL HG22 H 1 1.184 0.003 . 2 . . . . . 98 V MG2 . 27830 1
748 . 1 . 1 95 95 VAL HG23 H 1 1.184 0.003 . 2 . . . . . 98 V MG2 . 27830 1
749 . 1 . 1 95 95 VAL C C 13 173.550 0.000 . 1 . . . . . 98 V C . 27830 1
750 . 1 . 1 95 95 VAL CA C 13 59.419 0.099 . 1 . . . . . 98 V CA . 27830 1
751 . 1 . 1 95 95 VAL CB C 13 36.052 0.100 . 1 . . . . . 98 V CB . 27830 1
752 . 1 . 1 95 95 VAL CG1 C 13 22.774 0.142 . 2 . . . . . 98 V CG1 . 27830 1
753 . 1 . 1 95 95 VAL CG2 C 13 21.743 0.107 . 2 . . . . . 98 V CG2 . 27830 1
754 . 1 . 1 95 95 VAL N N 15 116.544 0.022 . 1 . . . . . 98 V N . 27830 1
755 . 1 . 1 96 96 MET H H 1 8.715 0.010 . 1 . . . . . 99 M H . 27830 1
756 . 1 . 1 96 96 MET HA H 1 5.553 0.007 . 1 . . . . . 99 M HA . 27830 1
757 . 1 . 1 96 96 MET HB2 H 1 1.786 0.006 . 2 . . . . . 99 M HB2 . 27830 1
758 . 1 . 1 96 96 MET HB3 H 1 1.981 0.015 . 2 . . . . . 99 M HB3 . 27830 1
759 . 1 . 1 96 96 MET HG2 H 1 2.171 0.004 . 2 . . . . . 99 M HG2 . 27830 1
760 . 1 . 1 96 96 MET HG3 H 1 2.384 0.003 . 2 . . . . . 99 M HG3 . 27830 1
761 . 1 . 1 96 96 MET C C 13 173.634 0.000 . 1 . . . . . 99 M C . 27830 1
762 . 1 . 1 96 96 MET CA C 13 53.632 0.085 . 1 . . . . . 99 M CA . 27830 1
763 . 1 . 1 96 96 MET CB C 13 38.515 0.067 . 1 . . . . . 99 M CB . 27830 1
764 . 1 . 1 96 96 MET CG C 13 32.611 0.116 . 1 . . . . . 99 M CG . 27830 1
765 . 1 . 1 96 96 MET N N 15 125.895 0.062 . 1 . . . . . 99 M N . 27830 1
766 . 1 . 1 97 97 ARG H H 1 8.150 0.004 . 1 . . . . . 100 R H . 27830 1
767 . 1 . 1 97 97 ARG HA H 1 4.925 0.000 . 1 . . . . . 100 R HA . 27830 1
768 . 1 . 1 97 97 ARG HB2 H 1 1.522 0.002 . 2 . . . . . 100 R HB2 . 27830 1
769 . 1 . 1 97 97 ARG C C 13 173.060 0.000 . 1 . . . . . 100 R C . 27830 1
770 . 1 . 1 97 97 ARG CA C 13 55.330 0.082 . 1 . . . . . 100 R CA . 27830 1
771 . 1 . 1 97 97 ARG CB C 13 30.288 0.000 . 1 . . . . . 100 R CB . 27830 1
772 . 1 . 1 97 97 ARG N N 15 126.246 0.075 . 1 . . . . . 100 R N . 27830 1
773 . 1 . 1 98 98 ILE H H 1 9.002 0.006 . 1 . . . . . 101 I H . 27830 1
774 . 1 . 1 98 98 ILE N N 15 123.073 0.059 . 1 . . . . . 101 I N . 27830 1
775 . 1 . 1 99 99 PRO HA H 1 4.093 0.009 . 1 . . . . . 102 P HA . 27830 1
776 . 1 . 1 99 99 PRO C C 13 175.956 0.000 . 1 . . . . . 102 P C . 27830 1
777 . 1 . 1 99 99 PRO CA C 13 62.691 0.158 . 1 . . . . . 102 P CA . 27830 1
778 . 1 . 1 99 99 PRO CB C 13 32.390 0.026 . 1 . . . . . 102 P CB . 27830 1
779 . 1 . 1 99 99 PRO CG C 13 27.525 0.000 . 1 . . . . . 102 P CG . 27830 1
780 . 1 . 1 99 99 PRO CD C 13 51.292 0.000 . 1 . . . . . 102 P CD . 27830 1
781 . 1 . 1 100 100 ALA H H 1 8.740 0.005 . 1 . . . . . 103 A H . 27830 1
782 . 1 . 1 100 100 ALA HA H 1 3.961 0.005 . 1 . . . . . 103 A HA . 27830 1
783 . 1 . 1 100 100 ALA HB1 H 1 1.088 0.001 . 1 . . . . . 103 A MB . 27830 1
784 . 1 . 1 100 100 ALA HB2 H 1 1.088 0.001 . 1 . . . . . 103 A MB . 27830 1
785 . 1 . 1 100 100 ALA HB3 H 1 1.088 0.001 . 1 . . . . . 103 A MB . 27830 1
786 . 1 . 1 100 100 ALA CA C 13 53.549 0.103 . 1 . . . . . 103 A CA . 27830 1
787 . 1 . 1 100 100 ALA CB C 13 18.695 0.116 . 1 . . . . . 103 A CB . 27830 1
788 . 1 . 1 100 100 ALA N N 15 124.872 0.080 . 1 . . . . . 103 A N . 27830 1
789 . 1 . 1 101 101 GLY H H 1 8.262 0.007 . 1 . . . . . 104 G H . 27830 1
790 . 1 . 1 101 101 GLY C C 13 174.163 0.000 . 1 . . . . . 104 G C . 27830 1
791 . 1 . 1 101 101 GLY CA C 13 45.452 0.035 . 1 . . . . . 104 G CA . 27830 1
792 . 1 . 1 101 101 GLY N N 15 111.717 0.051 . 1 . . . . . 104 G N . 27830 1
793 . 1 . 1 102 102 SER H H 1 8.037 0.005 . 1 . . . . . 105 S H . 27830 1
794 . 1 . 1 102 102 SER HA H 1 4.505 0.005 . 1 . . . . . 105 S HA . 27830 1
795 . 1 . 1 102 102 SER HB2 H 1 3.703 0.193 . 2 . . . . . 105 S HB2 . 27830 1
796 . 1 . 1 102 102 SER HB3 H 1 4.514 0.000 . 2 . . . . . 105 S HB3 . 27830 1
797 . 1 . 1 102 102 SER C C 13 174.083 0.000 . 1 . . . . . 105 S C . 27830 1
798 . 1 . 1 102 102 SER CA C 13 58.614 0.386 . 1 . . . . . 105 S CA . 27830 1
799 . 1 . 1 102 102 SER CB C 13 64.018 0.221 . 1 . . . . . 105 S CB . 27830 1
800 . 1 . 1 102 102 SER N N 15 116.511 0.070 . 1 . . . . . 105 S N . 27830 1
801 . 1 . 1 103 103 GLU H H 1 8.348 0.083 . 1 . . . . . 106 E H . 27830 1
802 . 1 . 1 103 103 GLU CA C 13 53.549 0.022 . 1 . . . . . 106 E CA . 27830 1
803 . 1 . 1 103 103 GLU CB C 13 31.593 0.000 . 1 . . . . . 106 E CB . 27830 1
804 . 1 . 1 103 103 GLU N N 15 121.836 0.053 . 1 . . . . . 106 E N . 27830 1
805 . 1 . 1 105 105 CYS CA C 13 57.684 0.018 . 1 . . . . . 108 C CA . 27830 1
806 . 1 . 1 105 105 CYS CB C 13 32.167 0.030 . 1 . . . . . 108 C CB . 27830 1
807 . 1 . 1 106 106 PHE H H 1 9.103 0.006 . 1 . . . . . 109 F H . 27830 1
808 . 1 . 1 106 106 PHE CA C 13 55.415 0.054 . 1 . . . . . 109 F CA . 27830 1
809 . 1 . 1 106 106 PHE CB C 13 41.327 0.000 . 1 . . . . . 109 F CB . 27830 1
810 . 1 . 1 106 106 PHE N N 15 123.526 0.074 . 1 . . . . . 109 F N . 27830 1
811 . 1 . 1 107 107 LEU H H 1 7.962 0.000 . 1 . . . . . 110 L H . 27830 1
812 . 1 . 1 107 107 LEU CA C 13 53.898 0.000 . 1 . . . . . 110 L CA . 27830 1
813 . 1 . 1 107 107 LEU N N 15 123.783 0.000 . 1 . . . . . 110 L N . 27830 1
814 . 1 . 1 108 108 THR H H 1 9.040 0.008 . 1 . . . . . 111 T H . 27830 1
815 . 1 . 1 108 108 THR HA H 1 4.114 0.006 . 1 . . . . . 111 T HA . 27830 1
816 . 1 . 1 108 108 THR HB H 1 4.100 0.006 . 1 . . . . . 111 T HB . 27830 1
817 . 1 . 1 108 108 THR HG21 H 1 1.077 0.007 . 1 . . . . . 111 T MG . 27830 1
818 . 1 . 1 108 108 THR HG22 H 1 1.077 0.007 . 1 . . . . . 111 T MG . 27830 1
819 . 1 . 1 108 108 THR HG23 H 1 1.077 0.007 . 1 . . . . . 111 T MG . 27830 1
820 . 1 . 1 108 108 THR C C 13 173.711 0.000 . 1 . . . . . 111 T C . 27830 1
821 . 1 . 1 108 108 THR CA C 13 65.951 0.104 . 1 . . . . . 111 T CA . 27830 1
822 . 1 . 1 108 108 THR CB C 13 67.529 0.075 . 1 . . . . . 111 T CB . 27830 1
823 . 1 . 1 108 108 THR CG2 C 13 22.720 0.064 . 1 . . . . . 111 T CG2 . 27830 1
824 . 1 . 1 108 108 THR N N 15 125.930 0.072 . 1 . . . . . 111 T N . 27830 1
825 . 1 . 1 109 109 LEU H H 1 8.827 0.009 . 1 . . . . . 112 L H . 27830 1
826 . 1 . 1 109 109 LEU HA H 1 4.532 0.009 . 1 . . . . . 112 L HA . 27830 1
827 . 1 . 1 109 109 LEU HB2 H 1 1.493 0.010 . 2 . . . . . 112 L HB2 . 27830 1
828 . 1 . 1 109 109 LEU HB3 H 1 1.625 0.004 . 2 . . . . . 112 L HB3 . 27830 1
829 . 1 . 1 109 109 LEU C C 13 176.879 0.000 . 1 . . . . . 112 L C . 27830 1
830 . 1 . 1 109 109 LEU CA C 13 55.731 0.054 . 1 . . . . . 112 L CA . 27830 1
831 . 1 . 1 109 109 LEU CB C 13 42.476 0.078 . 1 . . . . . 112 L CB . 27830 1
832 . 1 . 1 109 109 LEU N N 15 128.629 0.074 . 1 . . . . . 112 L N . 27830 1
833 . 1 . 1 110 110 GLU H H 1 8.041 0.004 . 1 . . . . . 113 E H . 27830 1
834 . 1 . 1 110 110 GLU HA H 1 4.326 0.005 . 1 . . . . . 113 E HA . 27830 1
835 . 1 . 1 110 110 GLU HB2 H 1 1.873 0.005 . 2 . . . . . 113 E HB2 . 27830 1
836 . 1 . 1 110 110 GLU HB3 H 1 1.983 0.004 . 2 . . . . . 113 E HB3 . 27830 1
837 . 1 . 1 110 110 GLU HG2 H 1 2.127 0.010 . 2 . . . . . 113 E HG2 . 27830 1
838 . 1 . 1 110 110 GLU HG3 H 1 2.186 0.006 . 2 . . . . . 113 E HG3 . 27830 1
839 . 1 . 1 110 110 GLU C C 13 174.030 0.000 . 1 . . . . . 113 E C . 27830 1
840 . 1 . 1 110 110 GLU CA C 13 55.961 0.084 . 1 . . . . . 113 E CA . 27830 1
841 . 1 . 1 110 110 GLU CB C 13 33.532 0.102 . 1 . . . . . 113 E CB . 27830 1
842 . 1 . 1 110 110 GLU CG C 13 36.292 0.089 . 1 . . . . . 113 E CG . 27830 1
843 . 1 . 1 110 110 GLU N N 15 117.734 0.028 . 1 . . . . . 113 E N . 27830 1
844 . 1 . 1 111 111 ALA H H 1 8.962 0.005 . 1 . . . . . 114 A H . 27830 1
845 . 1 . 1 111 111 ALA HA H 1 4.758 0.004 . 1 . . . . . 114 A HA . 27830 1
846 . 1 . 1 111 111 ALA HB1 H 1 1.029 0.009 . 1 . . . . . 114 A MB . 27830 1
847 . 1 . 1 111 111 ALA HB2 H 1 1.029 0.009 . 1 . . . . . 114 A MB . 27830 1
848 . 1 . 1 111 111 ALA HB3 H 1 1.029 0.009 . 1 . . . . . 114 A MB . 27830 1
849 . 1 . 1 111 111 ALA C C 13 174.291 0.000 . 1 . . . . . 114 A C . 27830 1
850 . 1 . 1 111 111 ALA CA C 13 53.146 0.023 . 1 . . . . . 114 A CA . 27830 1
851 . 1 . 1 111 111 ALA CB C 13 21.787 0.076 . 1 . . . . . 114 A CB . 27830 1
852 . 1 . 1 111 111 ALA N N 15 124.618 0.027 . 1 . . . . . 114 A N . 27830 1
853 . 1 . 1 112 112 GLU H H 1 7.712 0.003 . 1 . . . . . 115 E H . 27830 1
854 . 1 . 1 112 112 GLU HA H 1 4.617 0.003 . 1 . . . . . 115 E HA . 27830 1
855 . 1 . 1 112 112 GLU HB2 H 1 1.952 0.000 . 2 . . . . . 115 E HB2 . 27830 1
856 . 1 . 1 112 112 GLU HB3 H 1 2.406 0.000 . 2 . . . . . 115 E HB3 . 27830 1
857 . 1 . 1 112 112 GLU HG2 H 1 1.912 0.000 . 2 . . . . . 115 E HG2 . 27830 1
858 . 1 . 1 112 112 GLU HG3 H 1 2.086 0.000 . 2 . . . . . 115 E HG3 . 27830 1
859 . 1 . 1 112 112 GLU C C 13 176.281 0.000 . 1 . . . . . 115 E C . 27830 1
860 . 1 . 1 112 112 GLU CA C 13 53.950 0.092 . 1 . . . . . 115 E CA . 27830 1
861 . 1 . 1 112 112 GLU CB C 13 30.340 0.105 . 1 . . . . . 115 E CB . 27830 1
862 . 1 . 1 112 112 GLU CG C 13 34.635 0.011 . 1 . . . . . 115 E CG . 27830 1
863 . 1 . 1 112 112 GLU N N 15 121.656 0.026 . 1 . . . . . 115 E N . 27830 1
864 . 1 . 1 113 113 VAL H H 1 8.615 0.006 . 1 . . . . . 116 V H . 27830 1
865 . 1 . 1 113 113 VAL HA H 1 3.837 0.008 . 1 . . . . . 116 V HA . 27830 1
866 . 1 . 1 113 113 VAL HB H 1 1.896 0.009 . 1 . . . . . 116 V HB . 27830 1
867 . 1 . 1 113 113 VAL HG11 H 1 0.849 0.006 . 2 . . . . . 116 V MG1 . 27830 1
868 . 1 . 1 113 113 VAL HG12 H 1 0.849 0.006 . 2 . . . . . 116 V MG1 . 27830 1
869 . 1 . 1 113 113 VAL HG13 H 1 0.849 0.006 . 2 . . . . . 116 V MG1 . 27830 1
870 . 1 . 1 113 113 VAL HG21 H 1 1.087 0.007 . 2 . . . . . 116 V MG2 . 27830 1
871 . 1 . 1 113 113 VAL HG22 H 1 1.087 0.007 . 2 . . . . . 116 V MG2 . 27830 1
872 . 1 . 1 113 113 VAL HG23 H 1 1.087 0.007 . 2 . . . . . 116 V MG2 . 27830 1
873 . 1 . 1 113 113 VAL C C 13 177.266 0.000 . 1 . . . . . 116 V C . 27830 1
874 . 1 . 1 113 113 VAL CA C 13 65.181 0.099 . 1 . . . . . 116 V CA . 27830 1
875 . 1 . 1 113 113 VAL CB C 13 31.401 0.118 . 1 . . . . . 116 V CB . 27830 1
876 . 1 . 1 113 113 VAL CG1 C 13 22.168 0.119 . 2 . . . . . 116 V CG1 . 27830 1
877 . 1 . 1 113 113 VAL CG2 C 13 21.064 0.113 . 2 . . . . . 116 V CG2 . 27830 1
878 . 1 . 1 113 113 VAL N N 15 123.681 0.039 . 1 . . . . . 116 V N . 27830 1
879 . 1 . 1 114 114 GLY H H 1 9.862 0.009 . 1 . . . . . 117 G H . 27830 1
880 . 1 . 1 114 114 GLY HA2 H 1 4.372 0.010 . 2 . . . . . 117 G HA2 . 27830 1
881 . 1 . 1 114 114 GLY HA3 H 1 3.587 0.018 . 2 . . . . . 117 G HA3 . 27830 1
882 . 1 . 1 114 114 GLY C C 13 172.791 0.000 . 1 . . . . . 117 G C . 27830 1
883 . 1 . 1 114 114 GLY CA C 13 46.236 0.096 . 1 . . . . . 117 G CA . 27830 1
884 . 1 . 1 114 114 GLY N N 15 113.924 0.025 . 1 . . . . . 117 G N . 27830 1
885 . 1 . 1 115 115 SER H H 1 7.663 0.006 . 1 . . . . . 118 S H . 27830 1
886 . 1 . 1 115 115 SER HA H 1 5.105 0.010 . 1 . . . . . 118 S HA . 27830 1
887 . 1 . 1 115 115 SER HB2 H 1 3.789 0.000 . 2 . . . . . 118 S HB2 . 27830 1
888 . 1 . 1 115 115 SER HB3 H 1 4.524 0.000 . 2 . . . . . 118 S HB3 . 27830 1
889 . 1 . 1 115 115 SER C C 13 173.303 0.000 . 1 . . . . . 118 S C . 27830 1
890 . 1 . 1 115 115 SER CA C 13 58.327 0.063 . 1 . . . . . 118 S CA . 27830 1
891 . 1 . 1 115 115 SER CB C 13 64.530 0.151 . 1 . . . . . 118 S CB . 27830 1
892 . 1 . 1 115 115 SER N N 15 117.148 0.051 . 1 . . . . . 118 S N . 27830 1
893 . 1 . 1 116 116 TYR H H 1 9.171 0.012 . 1 . . . . . 119 Y H . 27830 1
894 . 1 . 1 116 116 TYR HA H 1 4.875 0.007 . 1 . . . . . 119 Y HA . 27830 1
895 . 1 . 1 116 116 TYR HB2 H 1 1.283 0.008 . 2 . . . . . 119 Y HB2 . 27830 1
896 . 1 . 1 116 116 TYR HB3 H 1 1.920 0.007 . 2 . . . . . 119 Y HB3 . 27830 1
897 . 1 . 1 116 116 TYR C C 13 174.706 0.000 . 1 . . . . . 119 Y C . 27830 1
898 . 1 . 1 116 116 TYR CA C 13 57.261 0.087 . 1 . . . . . 119 Y CA . 27830 1
899 . 1 . 1 116 116 TYR CB C 13 43.716 0.075 . 1 . . . . . 119 Y CB . 27830 1
900 . 1 . 1 116 116 TYR N N 15 122.365 0.035 . 1 . . . . . 119 Y N . 27830 1
901 . 1 . 1 117 117 CYS H H 1 7.122 0.025 . 1 . . . . . 120 C H . 27830 1
902 . 1 . 1 117 117 CYS HA H 1 4.363 0.000 . 1 . . . . . 120 C HA . 27830 1
903 . 1 . 1 117 117 CYS HB2 H 1 2.073 0.000 . 2 . . . . . 120 C HB2 . 27830 1
904 . 1 . 1 117 117 CYS HB3 H 1 2.642 0.000 . 2 . . . . . 120 C HB3 . 27830 1
905 . 1 . 1 117 117 CYS C C 13 174.200 0.000 . 1 . . . . . 120 C C . 27830 1
906 . 1 . 1 117 117 CYS CA C 13 55.321 0.080 . 1 . . . . . 120 C CA . 27830 1
907 . 1 . 1 117 117 CYS CB C 13 29.240 0.046 . 1 . . . . . 120 C CB . 27830 1
908 . 1 . 1 117 117 CYS N N 15 115.516 0.054 . 1 . . . . . 120 C N . 27830 1
909 . 1 . 1 118 118 PHE H H 1 9.378 0.007 . 1 . . . . . 121 F H . 27830 1
910 . 1 . 1 118 118 PHE HA H 1 5.513 0.004 . 1 . . . . . 121 F HA . 27830 1
911 . 1 . 1 118 118 PHE HB2 H 1 2.493 0.012 . 2 . . . . . 121 F HB2 . 27830 1
912 . 1 . 1 118 118 PHE HB3 H 1 2.734 0.010 . 2 . . . . . 121 F HB3 . 27830 1
913 . 1 . 1 118 118 PHE C C 13 174.740 0.000 . 1 . . . . . 121 F C . 27830 1
914 . 1 . 1 118 118 PHE CA C 13 55.753 0.052 . 1 . . . . . 121 F CA . 27830 1
915 . 1 . 1 118 118 PHE CB C 13 41.035 0.125 . 1 . . . . . 121 F CB . 27830 1
916 . 1 . 1 118 118 PHE N N 15 127.504 0.067 . 1 . . . . . 121 F N . 27830 1
917 . 1 . 1 119 119 GLY H H 1 9.487 0.006 . 1 . . . . . 122 G H . 27830 1
918 . 1 . 1 119 119 GLY HA2 H 1 5.413 0.000 . 2 . . . . . 122 G HA2 . 27830 1
919 . 1 . 1 119 119 GLY HA3 H 1 3.779 0.000 . 2 . . . . . 122 G HA3 . 27830 1
920 . 1 . 1 119 119 GLY C C 13 173.183 0.000 . 1 . . . . . 122 G C . 27830 1
921 . 1 . 1 119 119 GLY CA C 13 45.526 0.068 . 1 . . . . . 122 G CA . 27830 1
922 . 1 . 1 119 119 GLY N N 15 111.096 0.026 . 1 . . . . . 122 G N . 27830 1
923 . 1 . 1 120 120 ILE H H 1 9.859 0.006 . 1 . . . . . 123 I H . 27830 1
924 . 1 . 1 120 120 ILE HA H 1 4.567 0.005 . 1 . . . . . 123 I HA . 27830 1
925 . 1 . 1 120 120 ILE HB H 1 1.819 0.015 . 1 . . . . . 123 I HB . 27830 1
926 . 1 . 1 120 120 ILE HD11 H 1 0.623 0.008 . 1 . . . . . 123 I MD . 27830 1
927 . 1 . 1 120 120 ILE HD12 H 1 0.623 0.008 . 1 . . . . . 123 I MD . 27830 1
928 . 1 . 1 120 120 ILE HD13 H 1 0.623 0.008 . 1 . . . . . 123 I MD . 27830 1
929 . 1 . 1 120 120 ILE C C 13 174.497 0.000 . 1 . . . . . 123 I C . 27830 1
930 . 1 . 1 120 120 ILE CA C 13 60.979 0.074 . 1 . . . . . 123 I CA . 27830 1
931 . 1 . 1 120 120 ILE CB C 13 38.795 0.101 . 1 . . . . . 123 I CB . 27830 1
932 . 1 . 1 120 120 ILE CG1 C 13 28.359 0.120 . 1 . . . . . 123 I CG1 . 27830 1
933 . 1 . 1 120 120 ILE CG2 C 13 17.042 0.172 . 1 . . . . . 123 I CG2 . 27830 1
934 . 1 . 1 120 120 ILE CD1 C 13 14.971 0.095 . 1 . . . . . 123 I CD1 . 27830 1
935 . 1 . 1 120 120 ILE N N 15 128.514 0.040 . 1 . . . . . 123 I N . 27830 1
936 . 1 . 1 121 121 LEU H H 1 9.056 0.007 . 1 . . . . . 124 L H . 27830 1
937 . 1 . 1 121 121 LEU C C 13 177.506 0.000 . 1 . . . . . 124 L C . 27830 1
938 . 1 . 1 121 121 LEU CA C 13 53.773 0.231 . 1 . . . . . 124 L CA . 27830 1
939 . 1 . 1 121 121 LEU N N 15 128.772 0.017 . 1 . . . . . 124 L N . 27830 1
940 . 1 . 1 122 122 LEU H H 1 8.451 0.008 . 1 . . . . . 125 L H . 27830 1
941 . 1 . 1 122 122 LEU HA H 1 4.555 0.005 . 1 . . . . . 125 L HA . 27830 1
942 . 1 . 1 122 122 LEU HB2 H 1 1.575 0.003 . 2 . . . . . 125 L HB2 . 27830 1
943 . 1 . 1 122 122 LEU HB3 H 1 1.882 0.008 . 2 . . . . . 125 L HB3 . 27830 1
944 . 1 . 1 122 122 LEU C C 13 175.501 0.000 . 1 . . . . . 125 L C . 27830 1
945 . 1 . 1 122 122 LEU CA C 13 53.196 0.089 . 1 . . . . . 125 L CA . 27830 1
946 . 1 . 1 122 122 LEU CB C 13 38.793 0.106 . 1 . . . . . 125 L CB . 27830 1
947 . 1 . 1 122 122 LEU N N 15 125.080 0.095 . 1 . . . . . 125 L N . 27830 1
948 . 1 . 1 123 123 GLY H H 1 8.012 0.009 . 1 . . . . . 126 G H . 27830 1
949 . 1 . 1 123 123 GLY HA2 H 1 4.411 0.009 . 2 . . . . . 126 G HA2 . 27830 1
950 . 1 . 1 123 123 GLY HA3 H 1 3.947 0.008 . 2 . . . . . 126 G HA3 . 27830 1
951 . 1 . 1 123 123 GLY C C 13 172.840 0.000 . 1 . . . . . 126 G C . 27830 1
952 . 1 . 1 123 123 GLY CA C 13 45.376 0.071 . 1 . . . . . 126 G CA . 27830 1
953 . 1 . 1 123 123 GLY N N 15 109.765 0.069 . 1 . . . . . 126 G N . 27830 1
954 . 1 . 1 124 124 ASP H H 1 8.240 0.005 . 1 . . . . . 127 D H . 27830 1
955 . 1 . 1 124 124 ASP HA H 1 4.289 0.012 . 1 . . . . . 127 D HA . 27830 1
956 . 1 . 1 124 124 ASP HB2 H 1 2.487 0.007 . 2 . . . . . 127 D HB2 . 27830 1
957 . 1 . 1 124 124 ASP HB3 H 1 2.799 0.011 . 2 . . . . . 127 D HB3 . 27830 1
958 . 1 . 1 124 124 ASP C C 13 175.050 0.000 . 1 . . . . . 127 D C . 27830 1
959 . 1 . 1 124 124 ASP CA C 13 53.631 0.117 . 1 . . . . . 127 D CA . 27830 1
960 . 1 . 1 124 124 ASP CB C 13 40.770 0.093 . 1 . . . . . 127 D CB . 27830 1
961 . 1 . 1 124 124 ASP N N 15 116.548 0.035 . 1 . . . . . 127 D N . 27830 1
962 . 1 . 1 125 125 ARG H H 1 6.722 0.004 . 1 . . . . . 128 R H . 27830 1
963 . 1 . 1 125 125 ARG HA H 1 4.496 0.009 . 1 . . . . . 128 R HA . 27830 1
964 . 1 . 1 125 125 ARG HB2 H 1 1.508 0.014 . 2 . . . . . 128 R HB2 . 27830 1
965 . 1 . 1 125 125 ARG HB3 H 1 1.869 0.010 . 2 . . . . . 128 R HB3 . 27830 1
966 . 1 . 1 125 125 ARG HG2 H 1 1.637 0.021 . 2 . . . . . 128 R HG2 . 27830 1
967 . 1 . 1 125 125 ARG C C 13 173.895 0.000 . 1 . . . . . 128 R C . 27830 1
968 . 1 . 1 125 125 ARG CA C 13 54.948 0.105 . 1 . . . . . 128 R CA . 27830 1
969 . 1 . 1 125 125 ARG CB C 13 33.393 0.083 . 1 . . . . . 128 R CB . 27830 1
970 . 1 . 1 125 125 ARG CG C 13 26.829 0.142 . 1 . . . . . 128 R CG . 27830 1
971 . 1 . 1 125 125 ARG CD C 13 43.500 0.000 . 1 . . . . . 128 R CD . 27830 1
972 . 1 . 1 125 125 ARG N N 15 117.954 0.023 . 1 . . . . . 128 R N . 27830 1
973 . 1 . 1 126 126 LEU H H 1 7.703 0.006 . 1 . . . . . 129 L H . 27830 1
974 . 1 . 1 126 126 LEU HA H 1 4.333 0.003 . 1 . . . . . 129 L HA . 27830 1
975 . 1 . 1 126 126 LEU HB2 H 1 1.595 0.005 . 2 . . . . . 129 L HB2 . 27830 1
976 . 1 . 1 126 126 LEU CA C 13 56.152 0.099 . 1 . . . . . 129 L CA . 27830 1
977 . 1 . 1 126 126 LEU CB C 13 45.432 0.088 . 1 . . . . . 129 L CB . 27830 1
978 . 1 . 1 126 126 LEU N N 15 125.494 0.037 . 1 . . . . . 129 L N . 27830 1
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