Content for NMR-STAR saveframe, "assigned_chem_shift_list"
save_assigned_chem_shift_list
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list
_Assigned_chem_shift_list.Entry_ID 18863
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $methanol_25c
_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 '3D HNCA' 1 $methanol_CN isotropic 18863 1
2 '2D 1H-15N HSQC/HMQC' 1 $methanol_CN isotropic 18863 1
3 '3D HN(CO)CA' 1 $methanol_CN isotropic 18863 1
4 '3D HNCACB' 1 $methanol_CN isotropic 18863 1
5 '3D CBCA(CO)NH' 1 $methanol_CN isotropic 18863 1
6 '3D HNCO' 1 $methanol_CN isotropic 18863 1
12 '2D 1H-13C HSQC/HMQC' 1 $methanol_CN isotropic 18863 1
15 '2D 1H-1H NOESY' 3 $methanol_H isotropic 18863 1
20 '3D 1H-15N NOESY' 2 $methanol_N isotropic 18863 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.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 2 2 PRO C C 13 176.672 0.298 . 1 . . 575 . . -16 PRO C . 18863 1
2 . 1 1 3 3 LEU H H 1 8.276 0.007 . 1 . . 37 . . -15 LEU H . 18863 1
3 . 1 1 3 3 LEU C C 13 177.985 0.298 . 1 . . 576 . . -15 LEU C . 18863 1
4 . 1 1 3 3 LEU CA C 13 56.624 0.073 . 1 . . 235 . . -15 LEU CA . 18863 1
5 . 1 1 3 3 LEU N N 15 121.285 0.025 . 1 . . 38 . . -15 LEU N . 18863 1
6 . 1 1 4 4 GLY H H 1 8.059 0.004 . 1 . . 157 . . -14 GLY H . 18863 1
7 . 1 1 4 4 GLY C C 13 174.678 0.298 . 1 . . 577 . . -14 GLY C . 18863 1
8 . 1 1 4 4 GLY CA C 13 46.200 0.073 . 1 . . 179 . . -14 GLY CA . 18863 1
9 . 1 1 4 4 GLY N N 15 107.315 0.017 . 1 . . 158 . . -14 GLY N . 18863 1
10 . 1 1 5 5 SER H H 1 8.121 0.004 . 1 . . 139 . . -13 SER H . 18863 1
11 . 1 1 5 5 SER CA C 13 58.908 0.073 . 1 . . 180 . . -13 SER CA . 18863 1
12 . 1 1 5 5 SER N N 15 115.312 0.021 . 1 . . 140 . . -13 SER N . 18863 1
13 . 1 1 6 6 PRO C C 13 178.976 0.298 . 1 . . 578 . . -12 PRO C . 18863 1
14 . 1 1 7 7 GLU H H 1 7.932 0.012 . 1 . . 127 . . -11 GLU H . 18863 1
15 . 1 1 7 7 GLU CA C 13 60.787 0.073 . 1 . . 236 . . -11 GLU CA . 18863 1
16 . 1 1 7 7 GLU N N 15 116.928 0.033 . 1 . . 128 . . -11 GLU N . 18863 1
17 . 1 1 8 8 PHE H H 1 7.623 0.011 . 1 . . 95 . . -10 PHE H . 18863 1
18 . 1 1 8 8 PHE C C 13 178.920 0.298 . 1 . . 579 . . -10 PHE C . 18863 1
19 . 1 1 8 8 PHE CA C 13 61.877 0.073 . 1 . . 237 . . -10 PHE CA . 18863 1
20 . 1 1 8 8 PHE N N 15 119.237 0.076 . 1 . . 96 . . -10 PHE N . 18863 1
21 . 1 1 9 9 ALA H H 1 8.020 0.008 . 1 . . 25 . . -9 ALA H . 18863 1
22 . 1 1 9 9 ALA C C 13 180.319 0.298 . 1 . . 582 . . -9 ALA C . 18863 1
23 . 1 1 9 9 ALA CA C 13 56.826 0.073 . 1 . . 238 . . -9 ALA CA . 18863 1
24 . 1 1 9 9 ALA N N 15 122.374 0.045 . 1 . . 26 . . -9 ALA N . 18863 1
25 . 1 1 10 10 ALA H H 1 8.247 0.002 . 1 . . 57 . . -8 ALA H . 18863 1
26 . 1 1 10 10 ALA C C 13 181.157 0.298 . 1 . . 581 . . -8 ALA C . 18863 1
27 . 1 1 10 10 ALA CA C 13 56.944 0.073 . 1 . . 239 . . -8 ALA CA . 18863 1
28 . 1 1 10 10 ALA N N 15 120.510 0.012 . 1 . . 58 . . -8 ALA N . 18863 1
29 . 1 1 11 11 MET H H 1 7.782 0.008 . 1 . . 117 . . -7 MET H . 18863 1
30 . 1 1 11 11 MET C C 13 177.449 0.298 . 1 . . 580 . . -7 MET C . 18863 1
31 . 1 1 11 11 MET CA C 13 60.079 0.073 . 1 . . 240 . . -7 MET CA . 18863 1
32 . 1 1 11 11 MET N N 15 117.782 0.085 . 1 . . 118 . . -7 MET N . 18863 1
33 . 1 1 12 12 ASP H H 1 8.187 0.006 . 1 . . 71 . . -6 ASP H . 18863 1
34 . 1 1 12 12 ASP CA C 13 57.823 0.073 . 1 . . 241 . . -6 ASP CA . 18863 1
35 . 1 1 12 12 ASP N N 15 120.169 0.09 . 1 . . 72 . . -6 ASP N . 18863 1
36 . 1 1 17 17 ASP H H 1 8.054 0.002 . 1 . . 228 . . -1 ASP H . 18863 1
37 . 1 1 17 17 ASP C C 13 179.639 0.298 . 1 . . 583 . . -1 ASP C . 18863 1
38 . 1 1 17 17 ASP CA C 13 63.262 0.073 . 1 . . 230 . . -1 ASP CA . 18863 1
39 . 1 1 17 17 ASP N N 15 120.632 0.033 . 1 . . 229 . . -1 ASP N . 18863 1
40 . 1 1 18 18 ASP H H 1 8.802 0.016 . 1 . . 49 . . 0 ASP H . 18863 1
41 . 1 1 18 18 ASP C C 13 178.853 0.298 . 1 . . 514 . . 0 ASP C . 18863 1
42 . 1 1 18 18 ASP CA C 13 63.418 0.073 . 1 . . 227 . . 0 ASP CA . 18863 1
43 . 1 1 18 18 ASP CB C 13 40.704 0.054 . 1 . . 595 . . 0 ASP CB . 18863 1
44 . 1 1 18 18 ASP N N 15 120.786 0.048 . 1 . . 50 . . 0 ASP N . 18863 1
45 . 1 1 19 19 LYS H H 1 8.402 0.012 . 1 . . 107 . . 1 LYS H . 18863 1
46 . 1 1 19 19 LYS C C 13 178.133 0.298 . 1 . . 517 . . 1 LYS C . 18863 1
47 . 1 1 19 19 LYS CA C 13 65.866 0.073 . 1 . . 226 . . 1 LYS CA . 18863 1
48 . 1 1 19 19 LYS N N 15 117.974 0.114 . 1 . . 108 . . 1 LYS N . 18863 1
49 . 1 1 20 20 ALA H H 1 8.306 0.021 . 1 . . 17 . . 2 ALA H . 18863 1
50 . 1 1 20 20 ALA HA H 1 4.034 0.018 . 1 . . 244 . . 2 ALA HA . 18863 1
51 . 1 1 20 20 ALA HB1 H 1 1.411 0.0 . 1 . . 245 . . 2 ALA HB1 . 18863 1
52 . 1 1 20 20 ALA HB2 H 1 1.411 0.0 . 1 . . 245 . . 2 ALA HB2 . 18863 1
53 . 1 1 20 20 ALA HB3 H 1 1.411 0.0 . 1 . . 245 . . 2 ALA HB3 . 18863 1
54 . 1 1 20 20 ALA C C 13 181.166 0.298 . 1 . . 518 . . 2 ALA C . 18863 1
55 . 1 1 20 20 ALA CA C 13 57.066 0.037 . 1 . . 225 . . 2 ALA CA . 18863 1
56 . 1 1 20 20 ALA CB C 13 19.302 0.054 . 1 . . 246 . . 2 ALA CB . 18863 1
57 . 1 1 20 20 ALA N N 15 122.859 0.049 . 1 . . 18 . . 2 ALA N . 18863 1
58 . 1 1 21 21 LEU H H 1 8.029 0.01 . 1 . . 99 . . 3 LEU H . 18863 1
59 . 1 1 21 21 LEU HA H 1 4.032 0.015 . 1 . . 247 . . 3 LEU HA . 18863 1
60 . 1 1 21 21 LEU HB2 H 1 1.711 0.02 . 1 . . 248 . . 3 LEU HB2 . 18863 1
61 . 1 1 21 21 LEU HB3 H 1 1.693 0.039 . 1 . . 250 . . 3 LEU HB3 . 18863 1
62 . 1 1 21 21 LEU HG H 1 1.739 0.022 . 1 . . 251 . . 3 LEU HG . 18863 1
63 . 1 1 21 21 LEU HD11 H 1 0.876 0.021 . 1 . . 253 . . 3 LEU HD11 . 18863 1
64 . 1 1 21 21 LEU HD12 H 1 0.876 0.021 . 1 . . 253 . . 3 LEU HD12 . 18863 1
65 . 1 1 21 21 LEU HD13 H 1 0.876 0.021 . 1 . . 253 . . 3 LEU HD13 . 18863 1
66 . 1 1 21 21 LEU HD21 H 1 0.821 0.021 . 1 . . 255 . . 3 LEU HD21 . 18863 1
67 . 1 1 21 21 LEU HD22 H 1 0.821 0.021 . 1 . . 255 . . 3 LEU HD22 . 18863 1
68 . 1 1 21 21 LEU HD23 H 1 0.821 0.021 . 1 . . 255 . . 3 LEU HD23 . 18863 1
69 . 1 1 21 21 LEU C C 13 180.035 0.298 . 1 . . 519 . . 3 LEU C . 18863 1
70 . 1 1 21 21 LEU CA C 13 59.761 0.068 . 1 . . 224 . . 3 LEU CA . 18863 1
71 . 1 1 21 21 LEU CB C 13 43.422 0.054 . 1 . . 249 . . 3 LEU CB . 18863 1
72 . 1 1 21 21 LEU CG C 13 28.650 0.041 . 1 . . 252 . . 3 LEU CG . 18863 1
73 . 1 1 21 21 LEU CD1 C 13 25.726 0.041 . 1 . . 254 . . 3 LEU CD1 . 18863 1
74 . 1 1 21 21 LEU CD2 C 13 25.228 0.041 . 1 . . 256 . . 3 LEU CD2 . 18863 1
75 . 1 1 21 21 LEU N N 15 118.765 0.043 . 1 . . 100 . . 3 LEU N . 18863 1
76 . 1 1 22 22 GLU H H 1 8.188 0.007 . 1 . . 87 . . 4 GLU H . 18863 1
77 . 1 1 22 22 GLU HA H 1 3.891 0.024 . 1 . . 468 . . 4 GLU HA . 18863 1
78 . 1 1 22 22 GLU HB2 H 1 2.166 0.021 . 1 . . 466 . . 4 GLU HB2 . 18863 1
79 . 1 1 22 22 GLU HB3 H 1 2.085 0.037 . 1 . . 597 . . 4 GLU HB3 . 18863 1
80 . 1 1 22 22 GLU HG2 H 1 2.195 0.004 . 1 . . 598 . . 4 GLU HG2 . 18863 1
81 . 1 1 22 22 GLU HG3 H 1 2.182 0.016 . 1 . . 599 . . 4 GLU HG3 . 18863 1
82 . 1 1 22 22 GLU C C 13 179.414 0.298 . 1 . . 520 . . 4 GLU C . 18863 1
83 . 1 1 22 22 GLU CA C 13 60.889 0.002 . 1 . . 223 . . 4 GLU CA . 18863 1
84 . 1 1 22 22 GLU CB C 13 29.526 0.054 . 1 . . 467 . . 4 GLU CB . 18863 1
85 . 1 1 22 22 GLU N N 15 119.423 0.11 . 1 . . 88 . . 4 GLU N . 18863 1
86 . 1 1 23 23 ASN H H 1 8.390 0.004 . 1 . . 101 . . 5 ASN H . 18863 1
87 . 1 1 23 23 ASN HA H 1 4.325 0.019 . 1 . . 257 . . 5 ASN HA . 18863 1
88 . 1 1 23 23 ASN HB2 H 1 3.029 0.008 . 1 . . 258 . . 5 ASN HB2 . 18863 1
89 . 1 1 23 23 ASN HB3 H 1 2.590 0.015 . 1 . . 260 . . 5 ASN HB3 . 18863 1
90 . 1 1 23 23 ASN HD21 H 1 7.528 0.006 . 1 . . 151 . . 5 ASN HD21 . 18863 1
91 . 1 1 23 23 ASN HD22 H 1 6.735 0.01 . 1 . . 153 . . 5 ASN HD22 . 18863 1
92 . 1 1 23 23 ASN C C 13 178.905 0.298 . 1 . . 521 . . 5 ASN C . 18863 1
93 . 1 1 23 23 ASN CA C 13 57.785 0.05 . 1 . . 233 . . 5 ASN CA . 18863 1
94 . 1 1 23 23 ASN CB C 13 39.525 0.012 . 1 . . 259 . . 5 ASN CB . 18863 1
95 . 1 1 23 23 ASN N N 15 118.452 0.141 . 1 . . 102 . . 5 ASN N . 18863 1
96 . 1 1 23 23 ASN ND2 N 15 108.404 0.061 . 1 . . 152 . . 5 ASN ND2 . 18863 1
97 . 1 1 24 24 LEU H H 1 7.950 0.006 . 1 . . 43 . . 6 LEU H . 18863 1
98 . 1 1 24 24 LEU HA H 1 4.020 0.016 . 1 . . 584 . . 6 LEU HA . 18863 1
99 . 1 1 24 24 LEU HB2 H 1 1.872 0.021 . 1 . . 601 . . 6 LEU HB2 . 18863 1
100 . 1 1 24 24 LEU HB3 H 1 1.816 0.021 . 1 . . 602 . . 6 LEU HB3 . 18863 1
101 . 1 1 24 24 LEU HG H 1 1.723 0.018 . 1 . . 603 . . 6 LEU HG . 18863 1
102 . 1 1 24 24 LEU HD11 H 1 0.870 0.01 . 1 . . 605 . . 6 LEU HD11 . 18863 1
103 . 1 1 24 24 LEU HD12 H 1 0.870 0.01 . 1 . . 605 . . 6 LEU HD12 . 18863 1
104 . 1 1 24 24 LEU HD13 H 1 0.870 0.01 . 1 . . 605 . . 6 LEU HD13 . 18863 1
105 . 1 1 24 24 LEU HD21 H 1 0.839 0.008 . 1 . . 607 . . 6 LEU HD21 . 18863 1
106 . 1 1 24 24 LEU HD22 H 1 0.839 0.008 . 1 . . 607 . . 6 LEU HD22 . 18863 1
107 . 1 1 24 24 LEU HD23 H 1 0.839 0.008 . 1 . . 607 . . 6 LEU HD23 . 18863 1
108 . 1 1 24 24 LEU C C 13 180.102 0.298 . 1 . . 523 . . 6 LEU C . 18863 1
109 . 1 1 24 24 LEU CA C 13 59.954 0.106 . 1 . . 232 . . 6 LEU CA . 18863 1
110 . 1 1 24 24 LEU CB C 13 43.540 0.085 . 1 . . 600 . . 6 LEU CB . 18863 1
111 . 1 1 24 24 LEU CG C 13 28.642 0.041 . 1 . . 604 . . 6 LEU CG . 18863 1
112 . 1 1 24 24 LEU CD1 C 13 25.335 0.041 . 1 . . 606 . . 6 LEU CD1 . 18863 1
113 . 1 1 24 24 LEU CD2 C 13 25.302 0.041 . 1 . . 608 . . 6 LEU CD2 . 18863 1
114 . 1 1 24 24 LEU N N 15 120.983 0.077 . 1 . . 44 . . 6 LEU N . 18863 1
115 . 1 1 25 25 VAL H H 1 8.144 0.008 . 1 . . 41 . . 7 VAL H . 18863 1
116 . 1 1 25 25 VAL HA H 1 3.607 0.009 . 1 . . 261 . . 7 VAL HA . 18863 1
117 . 1 1 25 25 VAL HB H 1 2.300 0.003 . 1 . . 262 . . 7 VAL HB . 18863 1
118 . 1 1 25 25 VAL HG11 H 1 1.056 0.011 . 1 . . 264 . . 7 VAL HG11 . 18863 1
119 . 1 1 25 25 VAL HG12 H 1 1.056 0.011 . 1 . . 264 . . 7 VAL HG12 . 18863 1
120 . 1 1 25 25 VAL HG13 H 1 1.056 0.011 . 1 . . 264 . . 7 VAL HG13 . 18863 1
121 . 1 1 25 25 VAL HG21 H 1 0.900 0.005 . 1 . . 266 . . 7 VAL HG21 . 18863 1
122 . 1 1 25 25 VAL HG22 H 1 0.900 0.005 . 1 . . 266 . . 7 VAL HG22 . 18863 1
123 . 1 1 25 25 VAL HG23 H 1 0.900 0.005 . 1 . . 266 . . 7 VAL HG23 . 18863 1
124 . 1 1 25 25 VAL CA C 13 68.709 0.009 . 1 . . 231 . . 7 VAL CA . 18863 1
125 . 1 1 25 25 VAL CB C 13 33.377 0.054 . 1 . . 263 . . 7 VAL CB . 18863 1
126 . 1 1 25 25 VAL CG1 C 13 24.319 0.041 . 1 . . 265 . . 7 VAL CG1 . 18863 1
127 . 1 1 25 25 VAL CG2 C 13 22.614 0.041 . 1 . . 267 . . 7 VAL CG2 . 18863 1
128 . 1 1 25 25 VAL N N 15 120.915 0.12 . 1 . . 42 . . 7 VAL N . 18863 1
129 . 1 1 26 26 VAL C C 13 179.182 0.298 . 1 . . 522 . . 8 VAL C . 18863 1
130 . 1 1 27 27 LEU H H 1 8.317 0.019 . 1 . . 45 . . 9 LEU H . 18863 1
131 . 1 1 27 27 LEU HA H 1 4.016 0.018 . 1 . . 585 . . 9 LEU HA . 18863 1
132 . 1 1 27 27 LEU HB2 H 1 1.787 0.021 . 1 . . 609 . . 9 LEU HB2 . 18863 1
133 . 1 1 27 27 LEU HB3 H 1 1.622 0.012 . 1 . . 611 . . 9 LEU HB3 . 18863 1
134 . 1 1 27 27 LEU HG H 1 1.617 0.021 . 1 . . 618 . . 9 LEU HG . 18863 1
135 . 1 1 27 27 LEU HD11 H 1 0.862 0.021 . 1 . . 614 . . 9 LEU HD11 . 18863 1
136 . 1 1 27 27 LEU HD12 H 1 0.862 0.021 . 1 . . 614 . . 9 LEU HD12 . 18863 1
137 . 1 1 27 27 LEU HD13 H 1 0.862 0.021 . 1 . . 614 . . 9 LEU HD13 . 18863 1
138 . 1 1 27 27 LEU HD21 H 1 0.808 0.021 . 1 . . 616 . . 9 LEU HD21 . 18863 1
139 . 1 1 27 27 LEU HD22 H 1 0.808 0.021 . 1 . . 616 . . 9 LEU HD22 . 18863 1
140 . 1 1 27 27 LEU HD23 H 1 0.808 0.021 . 1 . . 616 . . 9 LEU HD23 . 18863 1
141 . 1 1 27 27 LEU C C 13 181.007 0.298 . 1 . . 524 . . 9 LEU C . 18863 1
142 . 1 1 27 27 LEU CA C 13 59.809 0.073 . 1 . . 205 . . 9 LEU CA . 18863 1
143 . 1 1 27 27 LEU CB C 13 43.430 0.009 . 1 . . 610 . . 9 LEU CB . 18863 1
144 . 1 1 27 27 LEU CG C 13 28.853 0.041 . 1 . . 613 . . 9 LEU CG . 18863 1
145 . 1 1 27 27 LEU CD1 C 13 25.318 0.041 . 1 . . 615 . . 9 LEU CD1 . 18863 1
146 . 1 1 27 27 LEU CD2 C 13 25.305 0.041 . 1 . . 617 . . 9 LEU CD2 . 18863 1
147 . 1 1 27 27 LEU N N 15 120.973 0.036 . 1 . . 46 . . 9 LEU N . 18863 1
148 . 1 1 28 28 ASN H H 1 8.527 0.025 . 1 . . 61 . . 10 ASN H . 18863 1
149 . 1 1 28 28 ASN HA H 1 4.401 0.004 . 1 . . 268 . . 10 ASN HA . 18863 1
150 . 1 1 28 28 ASN HB2 H 1 2.900 0.001 . 1 . . 270 . . 10 ASN HB2 . 18863 1
151 . 1 1 28 28 ASN HB3 H 1 2.624 0.021 . 1 . . 619 . . 10 ASN HB3 . 18863 1
152 . 1 1 28 28 ASN HD21 H 1 7.524 0.021 . 1 . . 147 . . 10 ASN HD21 . 18863 1
153 . 1 1 28 28 ASN HD22 H 1 6.742 0.021 . 1 . . 149 . . 10 ASN HD22 . 18863 1
154 . 1 1 28 28 ASN C C 13 178.841 0.298 . 1 . . 525 . . 10 ASN C . 18863 1
155 . 1 1 28 28 ASN CA C 13 58.505 0.06 . 1 . . 204 . . 10 ASN CA . 18863 1
156 . 1 1 28 28 ASN CB C 13 40.370 0.067 . 1 . . 271 . . 10 ASN CB . 18863 1
157 . 1 1 28 28 ASN N N 15 120.287 0.15 . 1 . . 62 . . 10 ASN N . 18863 1
158 . 1 1 28 28 ASN ND2 N 15 108.891 0.002 . 1 . . 148 . . 10 ASN ND2 . 18863 1
159 . 1 1 29 29 ALA H H 1 8.517 0.031 . 1 . . 11 . . 11 ALA H . 18863 1
160 . 1 1 29 29 ALA HA H 1 3.983 0.016 . 1 . . 272 . . 11 ALA HA . 18863 1
161 . 1 1 29 29 ALA HB1 H 1 1.397 0.021 . 1 . . 274 . . 11 ALA HB1 . 18863 1
162 . 1 1 29 29 ALA HB2 H 1 1.397 0.021 . 1 . . 274 . . 11 ALA HB2 . 18863 1
163 . 1 1 29 29 ALA HB3 H 1 1.397 0.021 . 1 . . 274 . . 11 ALA HB3 . 18863 1
164 . 1 1 29 29 ALA C C 13 181.060 0.298 . 1 . . 526 . . 11 ALA C . 18863 1
165 . 1 1 29 29 ALA CA C 13 57.268 0.069 . 1 . . 203 . . 11 ALA CA . 18863 1
166 . 1 1 29 29 ALA CB C 13 19.354 0.054 . 1 . . 275 . . 11 ALA CB . 18863 1
167 . 1 1 29 29 ALA N N 15 123.441 0.144 . 1 . . 12 . . 11 ALA N . 18863 1
168 . 1 1 30 30 ALA H H 1 8.569 0.014 . 1 . . 47 . . 12 ALA H . 18863 1
169 . 1 1 30 30 ALA HA H 1 4.016 0.022 . 1 . . 289 . . 12 ALA HA . 18863 1
170 . 1 1 30 30 ALA HB1 H 1 1.476 0.018 . 1 . . 380 . . 12 ALA HB1 . 18863 1
171 . 1 1 30 30 ALA HB2 H 1 1.476 0.018 . 1 . . 380 . . 12 ALA HB2 . 18863 1
172 . 1 1 30 30 ALA HB3 H 1 1.476 0.018 . 1 . . 380 . . 12 ALA HB3 . 18863 1
173 . 1 1 30 30 ALA C C 13 181.423 0.298 . 1 . . 527 . . 12 ALA C . 18863 1
174 . 1 1 30 30 ALA CA C 13 56.875 0.091 . 1 . . 202 . . 12 ALA CA . 18863 1
175 . 1 1 30 30 ALA CB C 13 19.302 0.054 . 1 . . 381 . . 12 ALA CB . 18863 1
176 . 1 1 30 30 ALA N N 15 120.909 0.158 . 1 . . 48 . . 12 ALA N . 18863 1
177 . 1 1 31 31 SER H H 1 8.178 0.02 . 1 . . 137 . . 13 SER H . 18863 1
178 . 1 1 31 31 SER HA H 1 4.151 0.005 . 1 . . 276 . . 13 SER HA . 18863 1
179 . 1 1 31 31 SER HB2 H 1 4.011 0.035 . 1 . . 278 . . 13 SER HB2 . 18863 1
180 . 1 1 31 31 SER HB3 H 1 4.083 0.003 . 1 . . 280 . . 13 SER HB3 . 18863 1
181 . 1 1 31 31 SER C C 13 177.982 0.298 . 1 . . 528 . . 13 SER C . 18863 1
182 . 1 1 31 31 SER CA C 13 63.765 0.055 . 1 . . 201 . . 13 SER CA . 18863 1
183 . 1 1 31 31 SER CB C 13 64.733 0.01 . 1 . . 279 . . 13 SER CB . 18863 1
184 . 1 1 31 31 SER N N 15 115.954 0.027 . 1 . . 138 . . 13 SER N . 18863 1
185 . 1 1 32 32 VAL H H 1 8.134 0.011 . 1 . . 15 . . 14 VAL H . 18863 1
186 . 1 1 32 32 VAL HA H 1 3.627 0.023 . 1 . . 283 . . 14 VAL HA . 18863 1
187 . 1 1 32 32 VAL HB H 1 2.135 0.005 . 1 . . 281 . . 14 VAL HB . 18863 1
188 . 1 1 32 32 VAL HG11 H 1 1.036 0.007 . 1 . . 382 . . 14 VAL HG11 . 18863 1
189 . 1 1 32 32 VAL HG12 H 1 1.036 0.007 . 1 . . 382 . . 14 VAL HG12 . 18863 1
190 . 1 1 32 32 VAL HG13 H 1 1.036 0.007 . 1 . . 382 . . 14 VAL HG13 . 18863 1
191 . 1 1 32 32 VAL HG21 H 1 0.883 0.003 . 1 . . 384 . . 14 VAL HG21 . 18863 1
192 . 1 1 32 32 VAL HG22 H 1 0.883 0.003 . 1 . . 384 . . 14 VAL HG22 . 18863 1
193 . 1 1 32 32 VAL HG23 H 1 0.883 0.003 . 1 . . 384 . . 14 VAL HG23 . 18863 1
194 . 1 1 32 32 VAL C C 13 179.493 0.298 . 1 . . 529 . . 14 VAL C . 18863 1
195 . 1 1 32 32 VAL CA C 13 68.318 0.073 . 1 . . 284 . . 14 VAL CA . 18863 1
196 . 1 1 32 32 VAL CB C 13 33.665 0.028 . 1 . . 282 . . 14 VAL CB . 18863 1
197 . 1 1 32 32 VAL CG1 C 13 24.305 0.041 . 1 . . 383 . . 14 VAL CG1 . 18863 1
198 . 1 1 32 32 VAL CG2 C 13 22.725 0.041 . 1 . . 385 . . 14 VAL CG2 . 18863 1
199 . 1 1 32 32 VAL N N 15 123.007 0.108 . 1 . . 16 . . 14 VAL N . 18863 1
200 . 1 1 33 33 ALA H H 1 8.302 0.008 . 1 . . 9 . . 15 ALA H . 18863 1
201 . 1 1 33 33 ALA HA H 1 4.059 0.059 . 1 . . 285 . . 15 ALA HA . 18863 1
202 . 1 1 33 33 ALA HB1 H 1 1.475 0.014 . 1 . . 386 . . 15 ALA HB1 . 18863 1
203 . 1 1 33 33 ALA HB2 H 1 1.475 0.014 . 1 . . 386 . . 15 ALA HB2 . 18863 1
204 . 1 1 33 33 ALA HB3 H 1 1.475 0.014 . 1 . . 386 . . 15 ALA HB3 . 18863 1
205 . 1 1 33 33 ALA C C 13 182.100 0.298 . 1 . . 530 . . 15 ALA C . 18863 1
206 . 1 1 33 33 ALA CA C 13 57.170 0.065 . 1 . . 195 . . 15 ALA CA . 18863 1
207 . 1 1 33 33 ALA CB C 13 19.488 0.054 . 1 . . 387 . . 15 ALA CB . 18863 1
208 . 1 1 33 33 ALA N N 15 123.545 0.182 . 1 . . 10 . . 15 ALA N . 18863 1
209 . 1 1 34 34 GLY H H 1 8.616 0.02 . 1 . . 155 . . 16 GLY H . 18863 1
210 . 1 1 34 34 GLY HA2 H 1 3.834 0.017 . 1 . . 298 . . 16 GLY HA2 . 18863 1
211 . 1 1 34 34 GLY HA3 H 1 3.829 0.025 . 1 . . 485 . . 16 GLY HA3 . 18863 1
212 . 1 1 34 34 GLY C C 13 176.822 0.298 . 1 . . 531 . . 16 GLY C . 18863 1
213 . 1 1 34 34 GLY CA C 13 48.448 0.006 . 1 . . 299 . . 16 GLY CA . 18863 1
214 . 1 1 34 34 GLY N N 15 107.470 0.064 . 1 . . 156 . . 16 GLY N . 18863 1
215 . 1 1 35 35 ALA H H 1 8.328 0.012 . 1 . . 5 . . 17 ALA H . 18863 1
216 . 1 1 35 35 ALA HA H 1 4.083 0.015 . 1 . . 292 . . 17 ALA HA . 18863 1
217 . 1 1 35 35 ALA HB1 H 1 1.493 0.004 . 1 . . 389 . . 17 ALA HB1 . 18863 1
218 . 1 1 35 35 ALA HB2 H 1 1.493 0.004 . 1 . . 389 . . 17 ALA HB2 . 18863 1
219 . 1 1 35 35 ALA HB3 H 1 1.493 0.004 . 1 . . 389 . . 17 ALA HB3 . 18863 1
220 . 1 1 35 35 ALA C C 13 180.963 0.298 . 1 . . 532 . . 17 ALA C . 18863 1
221 . 1 1 35 35 ALA CA C 13 56.982 0.07 . 1 . . 176 . . 17 ALA CA . 18863 1
222 . 1 1 35 35 ALA CB C 13 19.276 0.054 . 1 . . 390 . . 17 ALA CB . 18863 1
223 . 1 1 35 35 ALA N N 15 124.955 0.076 . 1 . . 6 . . 17 ALA N . 18863 1
224 . 1 1 36 36 HIS H H 1 8.402 0.02 . 1 . . 133 . . 18 HIS H . 18863 1
225 . 1 1 36 36 HIS HA H 1 4.273 0.028 . 1 . . 296 . . 18 HIS HA . 18863 1
226 . 1 1 36 36 HIS HB2 H 1 3.371 0.021 . 1 . . 294 . . 18 HIS HB2 . 18863 1
227 . 1 1 36 36 HIS HB3 H 1 3.363 0.021 . 1 . . 620 . . 18 HIS HB3 . 18863 1
228 . 1 1 36 36 HIS HD2 H 1 7.351 0.021 . 1 . . 477 . . 18 HIS HD2 . 18863 1
229 . 1 1 36 36 HIS HE1 H 1 8.599 0.021 . 1 . . 479 . . 18 HIS HE1 . 18863 1
230 . 1 1 36 36 HIS C C 13 178.820 0.298 . 1 . . 533 . . 18 HIS C . 18863 1
231 . 1 1 36 36 HIS CA C 13 60.670 0.048 . 1 . . 177 . . 18 HIS CA . 18863 1
232 . 1 1 36 36 HIS CB C 13 29.626 0.001 . 1 . . 295 . . 18 HIS CB . 18863 1
233 . 1 1 36 36 HIS CD2 C 13 121.202 0.041 . 1 . . 478 . . 18 HIS CD2 . 18863 1
234 . 1 1 36 36 HIS CE1 C 13 138.016 0.041 . 1 . . 480 . . 18 HIS CE1 . 18863 1
235 . 1 1 36 36 HIS N N 15 116.071 0.083 . 1 . . 134 . . 18 HIS N . 18863 1
236 . 1 1 37 37 GLY H H 1 8.577 0.03 . 1 . . 145 . . 19 GLY H . 18863 1
237 . 1 1 37 37 GLY HA2 H 1 3.820 0.025 . 1 . . 290 . . 19 GLY HA2 . 18863 1
238 . 1 1 37 37 GLY HA3 H 1 3.941 0.016 . 1 . . 391 . . 19 GLY HA3 . 18863 1
239 . 1 1 37 37 GLY C C 13 176.607 0.298 . 1 . . 534 . . 19 GLY C . 18863 1
240 . 1 1 37 37 GLY CA C 13 48.808 0.073 . 1 . . 178 . . 19 GLY CA . 18863 1
241 . 1 1 37 37 GLY N N 15 110.287 0.197 . 1 . . 146 . . 19 GLY N . 18863 1
242 . 1 1 38 38 ILE H H 1 8.229 0.013 . 1 . . 13 . . 20 ILE H . 18863 1
243 . 1 1 38 38 ILE HA H 1 3.823 0.017 . 1 . . 302 . . 20 ILE HA . 18863 1
244 . 1 1 38 38 ILE HB H 1 1.951 0.021 . 1 . . 300 . . 20 ILE HB . 18863 1
245 . 1 1 38 38 ILE HG12 H 1 1.739 0.001 . 1 . . 392 . . 20 ILE HG12 . 18863 1
246 . 1 1 38 38 ILE HG13 H 1 1.134 0.009 . 1 . . 394 . . 20 ILE HG13 . 18863 1
247 . 1 1 38 38 ILE HG21 H 1 0.920 0.021 . 1 . . 398 . . 20 ILE HG21 . 18863 1
248 . 1 1 38 38 ILE HG22 H 1 0.920 0.021 . 1 . . 398 . . 20 ILE HG22 . 18863 1
249 . 1 1 38 38 ILE HG23 H 1 0.920 0.021 . 1 . . 398 . . 20 ILE HG23 . 18863 1
250 . 1 1 38 38 ILE HD11 H 1 0.800 0.021 . 1 . . 396 . . 20 ILE HD11 . 18863 1
251 . 1 1 38 38 ILE HD12 H 1 0.800 0.021 . 1 . . 396 . . 20 ILE HD12 . 18863 1
252 . 1 1 38 38 ILE HD13 H 1 0.800 0.021 . 1 . . 396 . . 20 ILE HD13 . 18863 1
253 . 1 1 38 38 ILE C C 13 179.097 0.298 . 1 . . 535 . . 20 ILE C . 18863 1
254 . 1 1 38 38 ILE CA C 13 66.544 0.032 . 1 . . 184 . . 20 ILE CA . 18863 1
255 . 1 1 38 38 ILE CB C 13 39.472 0.054 . 1 . . 301 . . 20 ILE CB . 18863 1
256 . 1 1 38 38 ILE CG1 C 13 30.905 0.058 . 1 . . 393 . . 20 ILE CG1 . 18863 1
257 . 1 1 38 38 ILE CG2 C 13 18.627 0.041 . 1 . . 399 . . 20 ILE CG2 . 18863 1
258 . 1 1 38 38 ILE CD1 C 13 14.173 0.041 . 1 . . 397 . . 20 ILE CD1 . 18863 1
259 . 1 1 38 38 ILE N N 15 123.027 0.079 . 1 . . 14 . . 20 ILE N . 18863 1
260 . 1 1 39 39 LEU H H 1 8.081 0.017 . 1 . . 51 . . 21 LEU H . 18863 1
261 . 1 1 39 39 LEU HA H 1 4.090 0.016 . 1 . . 304 . . 21 LEU HA . 18863 1
262 . 1 1 39 39 LEU HB2 H 1 1.773 0.021 . 1 . . 306 . . 21 LEU HB2 . 18863 1
263 . 1 1 39 39 LEU HB3 H 1 1.708 0.021 . 1 . . 400 . . 21 LEU HB3 . 18863 1
264 . 1 1 39 39 LEU HG H 1 1.747 0.021 . 1 . . 401 . . 21 LEU HG . 18863 1
265 . 1 1 39 39 LEU HD11 H 1 0.877 0.021 . 1 . . 403 . . 21 LEU HD11 . 18863 1
266 . 1 1 39 39 LEU HD12 H 1 0.877 0.021 . 1 . . 403 . . 21 LEU HD12 . 18863 1
267 . 1 1 39 39 LEU HD13 H 1 0.877 0.021 . 1 . . 403 . . 21 LEU HD13 . 18863 1
268 . 1 1 39 39 LEU HD21 H 1 0.829 0.021 . 1 . . 405 . . 21 LEU HD21 . 18863 1
269 . 1 1 39 39 LEU HD22 H 1 0.829 0.021 . 1 . . 405 . . 21 LEU HD22 . 18863 1
270 . 1 1 39 39 LEU HD23 H 1 0.829 0.021 . 1 . . 405 . . 21 LEU HD23 . 18863 1
271 . 1 1 39 39 LEU C C 13 180.014 0.298 . 1 . . 536 . . 21 LEU C . 18863 1
272 . 1 1 39 39 LEU CA C 13 59.903 0.073 . 1 . . 185 . . 21 LEU CA . 18863 1
273 . 1 1 39 39 LEU CB C 13 43.340 0.023 . 1 . . 307 . . 21 LEU CB . 18863 1
274 . 1 1 39 39 LEU CG C 13 28.687 0.041 . 1 . . 402 . . 21 LEU CG . 18863 1
275 . 1 1 39 39 LEU CD1 C 13 25.496 0.041 . 1 . . 404 . . 21 LEU CD1 . 18863 1
276 . 1 1 39 39 LEU CD2 C 13 25.496 0.041 . 1 . . 406 . . 21 LEU CD2 . 18863 1
277 . 1 1 39 39 LEU N N 15 120.579 0.062 . 1 . . 52 . . 21 LEU N . 18863 1
278 . 1 1 40 40 SER H H 1 8.157 0.012 . 1 . . 141 . . 22 SER H . 18863 1
279 . 1 1 40 40 SER HA H 1 3.798 0.024 . 1 . . 311 . . 22 SER HA . 18863 1
280 . 1 1 40 40 SER HB2 H 1 3.818 0.013 . 1 . . 308 . . 22 SER HB2 . 18863 1
281 . 1 1 40 40 SER HB3 H 1 3.973 0.002 . 1 . . 407 . . 22 SER HB3 . 18863 1
282 . 1 1 40 40 SER CA C 13 64.547 0.074 . 1 . . 186 . . 22 SER CA . 18863 1
283 . 1 1 40 40 SER CB C 13 65.031 0.061 . 1 . . 310 . . 22 SER CB . 18863 1
284 . 1 1 40 40 SER N N 15 114.721 0.201 . 1 . . 142 . . 22 SER N . 18863 1
285 . 1 1 41 41 PHE H H 1 8.098 0.002 . 1 . . 193 . . 23 PHE H . 18863 1
286 . 1 1 41 41 PHE HA H 1 4.239 0.029 . 1 . . 621 . . 23 PHE HA . 18863 1
287 . 1 1 41 41 PHE HB2 H 1 3.265 0.021 . 1 . . 622 . . 23 PHE HB2 . 18863 1
288 . 1 1 41 41 PHE HB3 H 1 3.225 0.021 . 1 . . 624 . . 23 PHE HB3 . 18863 1
289 . 1 1 41 41 PHE HD1 H 1 7.120 0.003 . 3 . . 625 . . 23 PHE HD1 . 18863 1
290 . 1 1 41 41 PHE HD2 H 1 7.120 0.003 . 3 . . 625 . . 23 PHE HD2 . 18863 1
291 . 1 1 41 41 PHE HE1 H 1 7.062 0.021 . 3 . . 627 . . 23 PHE HE1 . 18863 1
292 . 1 1 41 41 PHE HE2 H 1 7.062 0.021 . 3 . . 627 . . 23 PHE HE2 . 18863 1
293 . 1 1 41 41 PHE C C 13 178.437 0.298 . 1 . . 537 . . 23 PHE C . 18863 1
294 . 1 1 41 41 PHE CA C 13 63.668 0.034 . 1 . . 188 . . 23 PHE CA . 18863 1
295 . 1 1 41 41 PHE CB C 13 40.569 0.018 . 1 . . 623 . . 23 PHE CB . 18863 1
296 . 1 1 41 41 PHE CD1 C 13 132.008 0.041 . 3 . . 626 . . 23 PHE CD1 . 18863 1
297 . 1 1 41 41 PHE CD2 C 13 132.008 0.041 . 3 . . 626 . . 23 PHE CD2 . 18863 1
298 . 1 1 41 41 PHE CE1 C 13 133.122 0.041 . 3 . . 628 . . 23 PHE CE1 . 18863 1
299 . 1 1 41 41 PHE CE2 C 13 133.122 0.041 . 3 . . 628 . . 23 PHE CE2 . 18863 1
300 . 1 1 41 41 PHE N N 15 122.433 0.008 . 1 . . 594 . . 23 PHE N . 18863 1
301 . 1 1 42 42 LEU H H 1 8.335 0.013 . 1 . . 59 . . 24 LEU H . 18863 1
302 . 1 1 42 42 LEU HA H 1 4.033 0.023 . 1 . . 629 . . 24 LEU HA . 18863 1
303 . 1 1 42 42 LEU HB2 H 1 1.814 0.021 . 1 . . 313 . . 24 LEU HB2 . 18863 1
304 . 1 1 42 42 LEU HG H 1 1.631 0.021 . 1 . . 754 . . 24 LEU HG . 18863 1
305 . 1 1 42 42 LEU HD11 H 1 1.041 0.021 . 1 . . 753 . . 24 LEU HD11 . 18863 1
306 . 1 1 42 42 LEU HD12 H 1 1.041 0.021 . 1 . . 753 . . 24 LEU HD12 . 18863 1
307 . 1 1 42 42 LEU HD13 H 1 1.041 0.021 . 1 . . 753 . . 24 LEU HD13 . 18863 1
308 . 1 1 42 42 LEU HD21 H 1 0.851 0.021 . 1 . . 750 . . 24 LEU HD21 . 18863 1
309 . 1 1 42 42 LEU HD22 H 1 0.851 0.021 . 1 . . 750 . . 24 LEU HD22 . 18863 1
310 . 1 1 42 42 LEU HD23 H 1 0.851 0.021 . 1 . . 750 . . 24 LEU HD23 . 18863 1
311 . 1 1 42 42 LEU C C 13 178.743 0.298 . 1 . . 538 . . 24 LEU C . 18863 1
312 . 1 1 42 42 LEU CA C 13 60.100 0.022 . 1 . . 218 . . 24 LEU CA . 18863 1
313 . 1 1 42 42 LEU CB C 13 43.800 0.054 . 1 . . 314 . . 24 LEU CB . 18863 1
314 . 1 1 42 42 LEU N N 15 120.378 0.144 . 1 . . 60 . . 24 LEU N . 18863 1
315 . 1 1 43 43 VAL H H 1 8.288 0.007 . 1 . . 63 . . 25 VAL H . 18863 1
316 . 1 1 43 43 VAL HA H 1 4.276 0.012 . 1 . . 315 . . 25 VAL HA . 18863 1
317 . 1 1 43 43 VAL HB H 1 1.931 0.018 . 1 . . 317 . . 25 VAL HB . 18863 1
318 . 1 1 43 43 VAL C C 13 179.484 0.298 . 1 . . 539 . . 25 VAL C . 18863 1
319 . 1 1 43 43 VAL CA C 13 62.625 0.053 . 1 . . 217 . . 25 VAL CA . 18863 1
320 . 1 1 43 43 VAL CB C 13 33.693 0.054 . 1 . . 318 . . 25 VAL CB . 18863 1
321 . 1 1 43 43 VAL N N 15 120.412 0.133 . 1 . . 64 . . 25 VAL N . 18863 1
322 . 1 1 44 44 PHE H H 1 8.147 0.014 . 1 . . 39 . . 26 PHE H . 18863 1
323 . 1 1 44 44 PHE HA H 1 3.960 0.013 . 1 . . 323 . . 26 PHE HA . 18863 1
324 . 1 1 44 44 PHE HB2 H 1 3.041 0.004 . 1 . . 742 . . 26 PHE HB2 . 18863 1
325 . 1 1 44 44 PHE HB3 H 1 3.034 0.003 . 1 . . 743 . . 26 PHE HB3 . 18863 1
326 . 1 1 44 44 PHE C C 13 179.663 0.298 . 1 . . 540 . . 26 PHE C . 18863 1
327 . 1 1 44 44 PHE CA C 13 61.112 0.019 . 1 . . 216 . . 26 PHE CA . 18863 1
328 . 1 1 44 44 PHE CB C 13 39.396 0.019 . 1 . . 322 . . 26 PHE CB . 18863 1
329 . 1 1 44 44 PHE N N 15 121.041 0.111 . 1 . . 40 . . 26 PHE N . 18863 1
330 . 1 1 45 45 PHE H H 1 8.480 0.021 . 1 . . 85 . . 27 PHE H . 18863 1
331 . 1 1 45 45 PHE HA H 1 4.383 0.014 . 1 . . 493 . . 27 PHE HA . 18863 1
332 . 1 1 45 45 PHE HB2 H 1 3.073 0.011 . 1 . . 744 . . 27 PHE HB2 . 18863 1
333 . 1 1 45 45 PHE HB3 H 1 2.757 0.014 . 1 . . 745 . . 27 PHE HB3 . 18863 1
334 . 1 1 45 45 PHE HD1 H 1 7.114 0.007 . 3 . . 755 . . 27 PHE HD1 . 18863 1
335 . 1 1 45 45 PHE HD2 H 1 7.114 0.007 . 3 . . 755 . . 27 PHE HD2 . 18863 1
336 . 1 1 45 45 PHE HE1 H 1 7.023 0.004 . 3 . . 756 . . 27 PHE HE1 . 18863 1
337 . 1 1 45 45 PHE HE2 H 1 7.023 0.004 . 3 . . 756 . . 27 PHE HE2 . 18863 1
338 . 1 1 45 45 PHE C C 13 178.653 0.298 . 1 . . 541 . . 27 PHE C . 18863 1
339 . 1 1 45 45 PHE CA C 13 57.781 0.056 . 1 . . 215 . . 27 PHE CA . 18863 1
340 . 1 1 45 45 PHE CB C 13 38.700 0.006 . 1 . . 494 . . 27 PHE CB . 18863 1
341 . 1 1 45 45 PHE CD1 C 13 133.141 0.041 . 3 . . 757 . . 27 PHE CD1 . 18863 1
342 . 1 1 45 45 PHE CD2 C 13 133.141 0.041 . 3 . . 757 . . 27 PHE CD2 . 18863 1
343 . 1 1 45 45 PHE CE1 C 13 133.020 0.041 . 3 . . 758 . . 27 PHE CE1 . 18863 1
344 . 1 1 45 45 PHE CE2 C 13 133.020 0.041 . 3 . . 758 . . 27 PHE CE2 . 18863 1
345 . 1 1 45 45 PHE N N 15 119.462 0.219 . 1 . . 86 . . 27 PHE N . 18863 1
346 . 1 1 46 46 CYS H H 1 8.167 0.007 . 1 . . 31 . . 28 CYS H . 18863 1
347 . 1 1 46 46 CYS HA H 1 3.987 0.002 . 1 . . 507 . . 28 CYS HA . 18863 1
348 . 1 1 46 46 CYS HB2 H 1 2.646 0.021 . 1 . . 509 . . 28 CYS HB2 . 18863 1
349 . 1 1 46 46 CYS HB3 H 1 2.524 0.021 . 1 . . 511 . . 28 CYS HB3 . 18863 1
350 . 1 1 46 46 CYS C C 13 179.199 0.298 . 1 . . 542 . . 28 CYS C . 18863 1
351 . 1 1 46 46 CYS CA C 13 60.497 0.073 . 1 . . 214 . . 28 CYS CA . 18863 1
352 . 1 1 46 46 CYS CB C 13 33.924 0.02 . 1 . . 510 . . 28 CYS CB . 18863 1
353 . 1 1 46 46 CYS N N 15 121.547 0.041 . 1 . . 32 . . 28 CYS N . 18863 1
354 . 1 1 47 47 ALA H H 1 8.103 0.008 . 1 . . 23 . . 29 ALA H . 18863 1
355 . 1 1 47 47 ALA HA H 1 4.030 0.0 . 1 . . 408 . . 29 ALA HA . 18863 1
356 . 1 1 47 47 ALA HB1 H 1 1.475 0.021 . 1 . . 409 . . 29 ALA HB1 . 18863 1
357 . 1 1 47 47 ALA HB2 H 1 1.475 0.021 . 1 . . 409 . . 29 ALA HB2 . 18863 1
358 . 1 1 47 47 ALA HB3 H 1 1.475 0.021 . 1 . . 409 . . 29 ALA HB3 . 18863 1
359 . 1 1 47 47 ALA C C 13 180.011 0.298 . 1 . . 543 . . 29 ALA C . 18863 1
360 . 1 1 47 47 ALA CA C 13 56.956 0.022 . 1 . . 219 . . 29 ALA CA . 18863 1
361 . 1 1 47 47 ALA CB C 13 19.367 0.054 . 1 . . 410 . . 29 ALA CB . 18863 1
362 . 1 1 47 47 ALA N N 15 122.597 0.105 . 1 . . 24 . . 29 ALA N . 18863 1
363 . 1 1 48 48 ALA H H 1 7.969 0.014 . 1 . . 91 . . 30 ALA H . 18863 1
364 . 1 1 48 48 ALA HA H 1 3.931 0.018 . 1 . . 411 . . 30 ALA HA . 18863 1
365 . 1 1 48 48 ALA HB1 H 1 1.414 0.017 . 1 . . 412 . . 30 ALA HB1 . 18863 1
366 . 1 1 48 48 ALA HB2 H 1 1.414 0.017 . 1 . . 412 . . 30 ALA HB2 . 18863 1
367 . 1 1 48 48 ALA HB3 H 1 1.414 0.017 . 1 . . 412 . . 30 ALA HB3 . 18863 1
368 . 1 1 48 48 ALA C C 13 180.835 0.298 . 1 . . 544 . . 30 ALA C . 18863 1
369 . 1 1 48 48 ALA CA C 13 56.960 0.049 . 1 . . 220 . . 30 ALA CA . 18863 1
370 . 1 1 48 48 ALA CB C 13 19.132 0.054 . 1 . . 413 . . 30 ALA CB . 18863 1
371 . 1 1 48 48 ALA N N 15 119.533 0.035 . 1 . . 92 . . 30 ALA N . 18863 1
372 . 1 1 49 49 TRP H H 1 8.084 0.003 . 1 . . 81 . . 31 TRP H . 18863 1
373 . 1 1 49 49 TRP HA H 1 3.965 0.008 . 1 . . 324 . . 31 TRP HA . 18863 1
374 . 1 1 49 49 TRP HB2 H 1 3.171 0.003 . 1 . . 414 . . 31 TRP HB2 . 18863 1
375 . 1 1 49 49 TRP HB3 H 1 2.869 0.011 . 1 . . 416 . . 31 TRP HB3 . 18863 1
376 . 1 1 49 49 TRP HD1 H 1 6.618 0.014 . 1 . . 481 . . 31 TRP HD1 . 18863 1
377 . 1 1 49 49 TRP HE1 H 1 9.764 0.011 . 1 . . 3 . . 31 TRP HE1 . 18863 1
378 . 1 1 49 49 TRP HE3 H 1 7.311 0.008 . 1 . . 474 . . 31 TRP HE3 . 18863 1
379 . 1 1 49 49 TRP HZ2 H 1 7.194 0.013 . 1 . . 732 . . 31 TRP HZ2 . 18863 1
380 . 1 1 49 49 TRP HZ3 H 1 6.872 0.016 . 1 . . 738 . . 31 TRP HZ3 . 18863 1
381 . 1 1 49 49 TRP HH2 H 1 6.957 0.008 . 1 . . 736 . . 31 TRP HH2 . 18863 1
382 . 1 1 49 49 TRP C C 13 179.573 0.298 . 1 . . 545 . . 31 TRP C . 18863 1
383 . 1 1 49 49 TRP CA C 13 62.501 0.073 . 1 . . 325 . . 31 TRP CA . 18863 1
384 . 1 1 49 49 TRP CB C 13 30.593 0.039 . 1 . . 415 . . 31 TRP CB . 18863 1
385 . 1 1 49 49 TRP CD1 C 13 127.444 0.041 . 1 . . 482 . . 31 TRP CD1 . 18863 1
386 . 1 1 49 49 TRP CZ2 C 13 115.189 0.041 . 1 . . 733 . . 31 TRP CZ2 . 18863 1
387 . 1 1 49 49 TRP CZ3 C 13 122.606 0.041 . 1 . . 739 . . 31 TRP CZ3 . 18863 1
388 . 1 1 49 49 TRP CH2 C 13 125.249 0.021 . 1 . . 737 . . 31 TRP CH2 . 18863 1
389 . 1 1 49 49 TRP N N 15 119.633 0.135 . 1 . . 82 . . 31 TRP N . 18863 1
390 . 1 1 49 49 TRP NE1 N 15 128.381 0.089 . 1 . . 4 . . 31 TRP NE1 . 18863 1
391 . 1 1 50 50 TYR H H 1 8.212 0.01 . 1 . . 55 . . 32 TYR H . 18863 1
392 . 1 1 50 50 TYR HA H 1 3.956 0.001 . 1 . . 326 . . 32 TYR HA . 18863 1
393 . 1 1 50 50 TYR HB2 H 1 3.107 0.004 . 1 . . 419 . . 32 TYR HB2 . 18863 1
394 . 1 1 50 50 TYR HB3 H 1 3.079 0.021 . 1 . . 632 . . 32 TYR HB3 . 18863 1
395 . 1 1 50 50 TYR HD1 H 1 6.930 0.013 . 3 . . 633 . . 32 TYR HD1 . 18863 1
396 . 1 1 50 50 TYR HD2 H 1 6.930 0.013 . 3 . . 633 . . 32 TYR HD2 . 18863 1
397 . 1 1 50 50 TYR HE1 H 1 6.578 0.01 . 3 . . 635 . . 32 TYR HE1 . 18863 1
398 . 1 1 50 50 TYR HE2 H 1 6.578 0.01 . 3 . . 635 . . 32 TYR HE2 . 18863 1
399 . 1 1 50 50 TYR C C 13 179.396 0.298 . 1 . . 546 . . 32 TYR C . 18863 1
400 . 1 1 50 50 TYR CA C 13 63.419 0.073 . 1 . . 327 . . 32 TYR CA . 18863 1
401 . 1 1 50 50 TYR CB C 13 39.865 0.02 . 1 . . 418 . . 32 TYR CB . 18863 1
402 . 1 1 50 50 TYR CD1 C 13 134.007 0.041 . 3 . . 634 . . 32 TYR CD1 . 18863 1
403 . 1 1 50 50 TYR CD2 C 13 134.007 0.041 . 3 . . 634 . . 32 TYR CD2 . 18863 1
404 . 1 1 50 50 TYR CE1 C 13 118.914 0.041 . 3 . . 636 . . 32 TYR CE1 . 18863 1
405 . 1 1 50 50 TYR CE2 C 13 118.914 0.041 . 3 . . 636 . . 32 TYR CE2 . 18863 1
406 . 1 1 50 50 TYR N N 15 120.576 0.083 . 1 . . 56 . . 32 TYR N . 18863 1
407 . 1 1 51 51 ILE H H 1 8.234 0.006 . 1 . . 83 . . 33 ILE H . 18863 1
408 . 1 1 51 51 ILE HA H 1 3.464 0.029 . 1 . . 328 . . 33 ILE HA . 18863 1
409 . 1 1 51 51 ILE HB H 1 1.863 0.021 . 1 . . 726 . . 33 ILE HB . 18863 1
410 . 1 1 51 51 ILE HG21 H 1 0.809 0.021 . 1 . . 728 . . 33 ILE HG21 . 18863 1
411 . 1 1 51 51 ILE HG22 H 1 0.809 0.021 . 1 . . 728 . . 33 ILE HG22 . 18863 1
412 . 1 1 51 51 ILE HG23 H 1 0.809 0.021 . 1 . . 728 . . 33 ILE HG23 . 18863 1
413 . 1 1 51 51 ILE C C 13 179.052 0.298 . 1 . . 547 . . 33 ILE C . 18863 1
414 . 1 1 51 51 ILE CA C 13 66.667 0.073 . 1 . . 329 . . 33 ILE CA . 18863 1
415 . 1 1 51 51 ILE CB C 13 39.489 0.054 . 1 . . 727 . . 33 ILE CB . 18863 1
416 . 1 1 51 51 ILE CG2 C 13 18.737 0.041 . 1 . . 729 . . 33 ILE CG2 . 18863 1
417 . 1 1 51 51 ILE N N 15 119.761 0.167 . 1 . . 84 . . 33 ILE N . 18863 1
418 . 1 1 52 52 LYS H H 1 8.076 0.004 . 1 . . 89 . . 34 LYS H . 18863 1
419 . 1 1 52 52 LYS HA H 1 3.952 0.005 . 1 . . 330 . . 34 LYS HA . 18863 1
420 . 1 1 52 52 LYS C C 13 179.727 0.298 . 1 . . 548 . . 34 LYS C . 18863 1
421 . 1 1 52 52 LYS CA C 13 61.093 0.073 . 1 . . 331 . . 34 LYS CA . 18863 1
422 . 1 1 52 52 LYS N N 15 119.460 0.027 . 1 . . 90 . . 34 LYS N . 18863 1
423 . 1 1 53 53 GLY H H 1 8.008 0.009 . 1 . . 182 . . 35 GLY H . 18863 1
424 . 1 1 53 53 GLY HA2 H 1 3.493 0.022 . 1 . . 422 . . 35 GLY HA2 . 18863 1
425 . 1 1 53 53 GLY HA3 H 1 3.651 0.021 . 1 . . 424 . . 35 GLY HA3 . 18863 1
426 . 1 1 53 53 GLY C C 13 175.912 0.298 . 1 . . 549 . . 35 GLY C . 18863 1
427 . 1 1 53 53 GLY CA C 13 47.951 0.035 . 1 . . 183 . . 35 GLY CA . 18863 1
428 . 1 1 53 53 GLY N N 15 106.103 0.043 . 1 . . 162 . . 35 GLY N . 18863 1
429 . 1 1 54 54 ARG H H 1 7.504 0.019 . 1 . . 105 . . 36 ARG H . 18863 1
430 . 1 1 54 54 ARG HA H 1 4.025 0.015 . 1 . . 332 . . 36 ARG HA . 18863 1
431 . 1 1 54 54 ARG HB2 H 1 1.732 0.021 . 1 . . 637 . . 36 ARG HB2 . 18863 1
432 . 1 1 54 54 ARG HB3 H 1 1.679 0.012 . 1 . . 499 . . 36 ARG HB3 . 18863 1
433 . 1 1 54 54 ARG HG2 H 1 1.554 0.002 . 1 . . 638 . . 36 ARG HG2 . 18863 1
434 . 1 1 54 54 ARG HG3 H 1 1.441 0.013 . 1 . . 640 . . 36 ARG HG3 . 18863 1
435 . 1 1 54 54 ARG HD2 H 1 2.911 0.021 . 1 . . 641 . . 36 ARG HD2 . 18863 1
436 . 1 1 54 54 ARG HD3 H 1 2.868 0.011 . 1 . . 643 . . 36 ARG HD3 . 18863 1
437 . 1 1 54 54 ARG C C 13 178.381 0.298 . 1 . . 550 . . 36 ARG C . 18863 1
438 . 1 1 54 54 ARG CA C 13 58.528 0.03 . 1 . . 181 . . 36 ARG CA . 18863 1
439 . 1 1 54 54 ARG CB C 13 30.870 0.04 . 1 . . 498 . . 36 ARG CB . 18863 1
440 . 1 1 54 54 ARG CG C 13 26.700 0.015 . 1 . . 639 . . 36 ARG CG . 18863 1
441 . 1 1 54 54 ARG CD C 13 43.580 0.018 . 1 . . 642 . . 36 ARG CD . 18863 1
442 . 1 1 54 54 ARG N N 15 118.264 0.042 . 1 . . 106 . . 36 ARG N . 18863 1
443 . 1 1 55 55 LEU H H 1 7.596 0.012 . 1 . . 111 . . 37 LEU H . 18863 1
444 . 1 1 55 55 LEU HA H 1 4.256 0.014 . 1 . . 334 . . 37 LEU HA . 18863 1
445 . 1 1 55 55 LEU HB2 H 1 1.541 0.021 . 1 . . 644 . . 37 LEU HB2 . 18863 1
446 . 1 1 55 55 LEU HB3 H 1 1.519 0.021 . 1 . . 646 . . 37 LEU HB3 . 18863 1
447 . 1 1 55 55 LEU HG H 1 1.826 0.021 . 1 . . 647 . . 37 LEU HG . 18863 1
448 . 1 1 55 55 LEU HD11 H 1 0.857 0.021 . 1 . . 649 . . 37 LEU HD11 . 18863 1
449 . 1 1 55 55 LEU HD12 H 1 0.857 0.021 . 1 . . 649 . . 37 LEU HD12 . 18863 1
450 . 1 1 55 55 LEU HD13 H 1 0.857 0.021 . 1 . . 649 . . 37 LEU HD13 . 18863 1
451 . 1 1 55 55 LEU HD21 H 1 0.799 0.024 . 1 . . 651 . . 37 LEU HD21 . 18863 1
452 . 1 1 55 55 LEU HD22 H 1 0.799 0.024 . 1 . . 651 . . 37 LEU HD22 . 18863 1
453 . 1 1 55 55 LEU HD23 H 1 0.799 0.024 . 1 . . 651 . . 37 LEU HD23 . 18863 1
454 . 1 1 55 55 LEU C C 13 178.286 0.298 . 1 . . 551 . . 37 LEU C . 18863 1
455 . 1 1 55 55 LEU CA C 13 56.716 0.073 . 1 . . 335 . . 37 LEU CA . 18863 1
456 . 1 1 55 55 LEU CB C 13 44.204 0.009 . 1 . . 645 . . 37 LEU CB . 18863 1
457 . 1 1 55 55 LEU CG C 13 28.449 0.041 . 1 . . 648 . . 37 LEU CG . 18863 1
458 . 1 1 55 55 LEU CD1 C 13 26.477 0.041 . 1 . . 650 . . 37 LEU CD1 . 18863 1
459 . 1 1 55 55 LEU CD2 C 13 26.441 0.041 . 1 . . 652 . . 37 LEU CD2 . 18863 1
460 . 1 1 55 55 LEU N N 15 118.030 0.093 . 1 . . 112 . . 37 LEU N . 18863 1
461 . 1 1 56 56 ALA H H 1 7.828 0.011 . 1 . . 27 . . 38 ALA H . 18863 1
462 . 1 1 56 56 ALA HA H 1 4.416 0.029 . 1 . . 336 . . 38 ALA HA . 18863 1
463 . 1 1 56 56 ALA HB1 H 1 1.336 0.021 . 1 . . 338 . . 38 ALA HB1 . 18863 1
464 . 1 1 56 56 ALA HB2 H 1 1.336 0.021 . 1 . . 338 . . 38 ALA HB2 . 18863 1
465 . 1 1 56 56 ALA HB3 H 1 1.336 0.021 . 1 . . 338 . . 38 ALA HB3 . 18863 1
466 . 1 1 56 56 ALA CA C 13 54.440 0.073 . 1 . . 337 . . 38 ALA CA . 18863 1
467 . 1 1 56 56 ALA CB C 13 18.832 0.054 . 1 . . 339 . . 38 ALA CB . 18863 1
468 . 1 1 56 56 ALA N N 15 122.471 0.137 . 1 . . 28 . . 38 ALA N . 18863 1
469 . 1 1 57 57 PRO HA H 1 4.291 0.002 . 1 . . 653 . . 39 PRO HA . 18863 1
470 . 1 1 57 57 PRO HB2 H 1 1.833 0.021 . 1 . . 655 . . 39 PRO HB2 . 18863 1
471 . 1 1 57 57 PRO HB3 H 1 1.808 0.021 . 1 . . 657 . . 39 PRO HB3 . 18863 1
472 . 1 1 57 57 PRO HG2 H 1 1.949 0.021 . 1 . . 658 . . 39 PRO HG2 . 18863 1
473 . 1 1 57 57 PRO HG3 H 1 1.928 0.021 . 1 . . 660 . . 39 PRO HG3 . 18863 1
474 . 1 1 57 57 PRO HD2 H 1 3.539 0.021 . 1 . . 661 . . 39 PRO HD2 . 18863 1
475 . 1 1 57 57 PRO HD3 H 1 3.527 0.021 . 1 . . 663 . . 39 PRO HD3 . 18863 1
476 . 1 1 57 57 PRO C C 13 179.489 0.298 . 1 . . 552 . . 39 PRO C . 18863 1
477 . 1 1 57 57 PRO CA C 13 66.899 0.073 . 1 . . 654 . . 39 PRO CA . 18863 1
478 . 1 1 57 57 PRO CB C 13 32.855 0.054 . 1 . . 656 . . 39 PRO CB . 18863 1
479 . 1 1 57 57 PRO CG C 13 29.397 0.018 . 1 . . 659 . . 39 PRO CG . 18863 1
480 . 1 1 57 57 PRO CD C 13 51.636 0.018 . 1 . . 662 . . 39 PRO CD . 18863 1
481 . 1 1 58 58 GLY H H 1 8.226 0.007 . 1 . . 163 . . 40 GLY H . 18863 1
482 . 1 1 58 58 GLY HA2 H 1 3.817 0.012 . 1 . . 340 . . 40 GLY HA2 . 18863 1
483 . 1 1 58 58 GLY HA3 H 1 3.799 0.025 . 1 . . 430 . . 40 GLY HA3 . 18863 1
484 . 1 1 58 58 GLY C C 13 176.415 0.298 . 1 . . 553 . . 40 GLY C . 18863 1
485 . 1 1 58 58 GLY CA C 13 48.118 0.002 . 1 . . 341 . . 40 GLY CA . 18863 1
486 . 1 1 58 58 GLY N N 15 105.749 0.342 . 1 . . 164 . . 40 GLY N . 18863 1
487 . 1 1 59 59 ALA H H 1 7.946 0.013 . 1 . . 7 . . 41 ALA H . 18863 1
488 . 1 1 59 59 ALA HA H 1 4.012 0.006 . 1 . . 342 . . 41 ALA HA . 18863 1
489 . 1 1 59 59 ALA HB1 H 1 1.384 0.029 . 1 . . 344 . . 41 ALA HB1 . 18863 1
490 . 1 1 59 59 ALA HB2 H 1 1.384 0.029 . 1 . . 344 . . 41 ALA HB2 . 18863 1
491 . 1 1 59 59 ALA HB3 H 1 1.384 0.029 . 1 . . 344 . . 41 ALA HB3 . 18863 1
492 . 1 1 59 59 ALA C C 13 180.038 0.298 . 1 . . 554 . . 41 ALA C . 18863 1
493 . 1 1 59 59 ALA CA C 13 55.532 0.073 . 1 . . 343 . . 41 ALA CA . 18863 1
494 . 1 1 59 59 ALA CB C 13 19.857 0.054 . 1 . . 345 . . 41 ALA CB . 18863 1
495 . 1 1 59 59 ALA N N 15 123.814 0.111 . 1 . . 8 . . 41 ALA N . 18863 1
496 . 1 1 60 60 ALA H H 1 8.049 0.028 . 1 . . 65 . . 42 ALA H . 18863 1
497 . 1 1 60 60 ALA HA H 1 4.082 0.001 . 1 . . 346 . . 42 ALA HA . 18863 1
498 . 1 1 60 60 ALA HB1 H 1 1.370 0.021 . 1 . . 431 . . 42 ALA HB1 . 18863 1
499 . 1 1 60 60 ALA HB2 H 1 1.370 0.021 . 1 . . 431 . . 42 ALA HB2 . 18863 1
500 . 1 1 60 60 ALA HB3 H 1 1.370 0.021 . 1 . . 431 . . 42 ALA HB3 . 18863 1
501 . 1 1 60 60 ALA C C 13 180.178 0.298 . 1 . . 555 . . 42 ALA C . 18863 1
502 . 1 1 60 60 ALA CA C 13 56.082 0.073 . 1 . . 347 . . 42 ALA CA . 18863 1
503 . 1 1 60 60 ALA CB C 13 19.895 0.054 . 1 . . 432 . . 42 ALA CB . 18863 1
504 . 1 1 60 60 ALA N N 15 120.273 0.025 . 1 . . 66 . . 42 ALA N . 18863 1
505 . 1 1 61 61 TYR H H 1 7.885 0.015 . 1 . . 119 . . 43 TYR H . 18863 1
506 . 1 1 61 61 TYR HA H 1 4.279 0.012 . 1 . . 348 . . 43 TYR HA . 18863 1
507 . 1 1 61 61 TYR HB2 H 1 3.037 0.001 . 1 . . 664 . . 43 TYR HB2 . 18863 1
508 . 1 1 61 61 TYR HB3 H 1 2.991 0.01 . 1 . . 433 . . 43 TYR HB3 . 18863 1
509 . 1 1 61 61 TYR HD1 H 1 6.958 0.014 . 3 . . 665 . . 43 TYR HD1 . 18863 1
510 . 1 1 61 61 TYR HD2 H 1 6.958 0.014 . 3 . . 665 . . 43 TYR HD2 . 18863 1
511 . 1 1 61 61 TYR HE1 H 1 6.572 0.006 . 3 . . 667 . . 43 TYR HE1 . 18863 1
512 . 1 1 61 61 TYR HE2 H 1 6.572 0.006 . 3 . . 667 . . 43 TYR HE2 . 18863 1
513 . 1 1 61 61 TYR C C 13 178.829 0.298 . 1 . . 556 . . 43 TYR C . 18863 1
514 . 1 1 61 61 TYR CA C 13 62.285 0.073 . 1 . . 349 . . 43 TYR CA . 18863 1
515 . 1 1 61 61 TYR CB C 13 39.858 0.012 . 1 . . 434 . . 43 TYR CB . 18863 1
516 . 1 1 61 61 TYR CD1 C 13 133.968 0.041 . 3 . . 666 . . 43 TYR CD1 . 18863 1
517 . 1 1 61 61 TYR CD2 C 13 133.968 0.041 . 3 . . 666 . . 43 TYR CD2 . 18863 1
518 . 1 1 61 61 TYR CE1 C 13 118.912 0.041 . 3 . . 668 . . 43 TYR CE1 . 18863 1
519 . 1 1 61 61 TYR CE2 C 13 118.912 0.041 . 3 . . 668 . . 43 TYR CE2 . 18863 1
520 . 1 1 61 61 TYR N N 15 117.392 0.203 . 1 . . 120 . . 43 TYR N . 18863 1
521 . 1 1 62 62 ALA H H 1 7.853 0.01 . 1 . . 33 . . 44 ALA H . 18863 1
522 . 1 1 62 62 ALA HA H 1 3.980 0.02 . 1 . . 350 . . 44 ALA HA . 18863 1
523 . 1 1 62 62 ALA HB1 H 1 1.269 0.014 . 1 . . 435 . . 44 ALA HB1 . 18863 1
524 . 1 1 62 62 ALA HB2 H 1 1.269 0.014 . 1 . . 435 . . 44 ALA HB2 . 18863 1
525 . 1 1 62 62 ALA HB3 H 1 1.269 0.014 . 1 . . 435 . . 44 ALA HB3 . 18863 1
526 . 1 1 62 62 ALA C C 13 179.646 0.298 . 1 . . 557 . . 44 ALA C . 18863 1
527 . 1 1 62 62 ALA CA C 13 56.209 0.073 . 1 . . 351 . . 44 ALA CA . 18863 1
528 . 1 1 62 62 ALA CB C 13 19.663 0.054 . 1 . . 436 . . 44 ALA CB . 18863 1
529 . 1 1 62 62 ALA N N 15 121.586 0.043 . 1 . . 34 . . 44 ALA N . 18863 1
530 . 1 1 63 63 PHE H H 1 7.883 0.003 . 1 . . 131 . . 45 PHE H . 18863 1
531 . 1 1 63 63 PHE HA H 1 4.247 0.041 . 1 . . 352 . . 45 PHE HA . 18863 1
532 . 1 1 63 63 PHE HB2 H 1 2.829 0.008 . 1 . . 437 . . 45 PHE HB2 . 18863 1
533 . 1 1 63 63 PHE HB3 H 1 2.823 0.002 . 1 . . 669 . . 45 PHE HB3 . 18863 1
534 . 1 1 63 63 PHE HD1 H 1 6.807 0.01 . 3 . . 670 . . 45 PHE HD1 . 18863 1
535 . 1 1 63 63 PHE HD2 H 1 6.807 0.01 . 3 . . 670 . . 45 PHE HD2 . 18863 1
536 . 1 1 63 63 PHE HE1 H 1 6.967 0.01 . 3 . . 672 . . 45 PHE HE1 . 18863 1
537 . 1 1 63 63 PHE HE2 H 1 6.967 0.01 . 3 . . 672 . . 45 PHE HE2 . 18863 1
538 . 1 1 63 63 PHE HZ H 1 6.905 0.013 . 1 . . 674 . . 45 PHE HZ . 18863 1
539 . 1 1 63 63 PHE C C 13 177.655 0.298 . 1 . . 558 . . 45 PHE C . 18863 1
540 . 1 1 63 63 PHE CA C 13 61.784 0.073 . 1 . . 353 . . 45 PHE CA . 18863 1
541 . 1 1 63 63 PHE CB C 13 41.003 0.008 . 1 . . 438 . . 45 PHE CB . 18863 1
542 . 1 1 63 63 PHE CD1 C 13 132.977 0.041 . 3 . . 671 . . 45 PHE CD1 . 18863 1
543 . 1 1 63 63 PHE CD2 C 13 132.977 0.041 . 3 . . 671 . . 45 PHE CD2 . 18863 1
544 . 1 1 63 63 PHE CE1 C 13 131.976 0.041 . 3 . . 673 . . 45 PHE CE1 . 18863 1
545 . 1 1 63 63 PHE CE2 C 13 131.976 0.041 . 3 . . 673 . . 45 PHE CE2 . 18863 1
546 . 1 1 63 63 PHE CZ C 13 134.004 0.041 . 1 . . 675 . . 45 PHE CZ . 18863 1
547 . 1 1 63 63 PHE N N 15 116.633 0.065 . 1 . . 132 . . 45 PHE N . 18863 1
548 . 1 1 64 64 TYR H H 1 7.992 0.023 . 1 . . 129 . . 46 TYR H . 18863 1
549 . 1 1 64 64 TYR HA H 1 4.332 0.011 . 1 . . 354 . . 46 TYR HA . 18863 1
550 . 1 1 64 64 TYR HB2 H 1 2.935 0.013 . 1 . . 676 . . 46 TYR HB2 . 18863 1
551 . 1 1 64 64 TYR HB3 H 1 2.896 0.021 . 1 . . 677 . . 46 TYR HB3 . 18863 1
552 . 1 1 64 64 TYR HD1 H 1 7.082 0.013 . 3 . . 678 . . 46 TYR HD1 . 18863 1
553 . 1 1 64 64 TYR HD2 H 1 7.082 0.013 . 3 . . 678 . . 46 TYR HD2 . 18863 1
554 . 1 1 64 64 TYR HE1 H 1 6.626 0.011 . 3 . . 680 . . 46 TYR HE1 . 18863 1
555 . 1 1 64 64 TYR HE2 H 1 6.626 0.011 . 3 . . 680 . . 46 TYR HE2 . 18863 1
556 . 1 1 64 64 TYR C C 13 177.901 0.298 . 1 . . 559 . . 46 TYR C . 18863 1
557 . 1 1 64 64 TYR CA C 13 61.385 0.073 . 1 . . 355 . . 46 TYR CA . 18863 1
558 . 1 1 64 64 TYR CB C 13 40.193 0.054 . 1 . . 440 . . 46 TYR CB . 18863 1
559 . 1 1 64 64 TYR CD1 C 13 134.264 0.041 . 3 . . 679 . . 46 TYR CD1 . 18863 1
560 . 1 1 64 64 TYR CD2 C 13 134.264 0.041 . 3 . . 679 . . 46 TYR CD2 . 18863 1
561 . 1 1 64 64 TYR CE1 C 13 119.025 0.041 . 3 . . 681 . . 46 TYR CE1 . 18863 1
562 . 1 1 64 64 TYR CE2 C 13 119.025 0.041 . 3 . . 681 . . 46 TYR CE2 . 18863 1
563 . 1 1 64 64 TYR N N 15 116.786 0.129 . 1 . . 130 . . 46 TYR N . 18863 1
564 . 1 1 65 65 GLY H H 1 7.937 0.018 . 1 . . 159 . . 47 GLY H . 18863 1
565 . 1 1 65 65 GLY HA2 H 1 3.814 0.037 . 1 . . 441 . . 47 GLY HA2 . 18863 1
566 . 1 1 65 65 GLY HA3 H 1 3.684 0.029 . 1 . . 356 . . 47 GLY HA3 . 18863 1
567 . 1 1 65 65 GLY C C 13 175.412 0.298 . 1 . . 563 . . 47 GLY C . 18863 1
568 . 1 1 65 65 GLY CA C 13 47.376 0.029 . 1 . . 172 . . 47 GLY CA . 18863 1
569 . 1 1 65 65 GLY N N 15 106.599 0.108 . 1 . . 160 . . 47 GLY N . 18863 1
570 . 1 1 66 66 VAL H H 1 7.706 0.03 . 1 . . 121 . . 48 VAL H . 18863 1
571 . 1 1 66 66 VAL HA H 1 4.049 0.029 . 1 . . 360 . . 48 VAL HA . 18863 1
572 . 1 1 66 66 VAL HB H 1 2.074 0.012 . 1 . . 358 . . 48 VAL HB . 18863 1
573 . 1 1 66 66 VAL HG11 H 1 0.848 0.016 . 1 . . 682 . . 48 VAL HG11 . 18863 1
574 . 1 1 66 66 VAL HG12 H 1 0.848 0.016 . 1 . . 682 . . 48 VAL HG12 . 18863 1
575 . 1 1 66 66 VAL HG13 H 1 0.848 0.016 . 1 . . 682 . . 48 VAL HG13 . 18863 1
576 . 1 1 66 66 VAL HG21 H 1 0.837 0.027 . 1 . . 684 . . 48 VAL HG21 . 18863 1
577 . 1 1 66 66 VAL HG22 H 1 0.837 0.027 . 1 . . 684 . . 48 VAL HG22 . 18863 1
578 . 1 1 66 66 VAL HG23 H 1 0.837 0.027 . 1 . . 684 . . 48 VAL HG23 . 18863 1
579 . 1 1 66 66 VAL C C 13 177.991 0.298 . 1 . . 560 . . 48 VAL C . 18863 1
580 . 1 1 66 66 VAL CA C 13 64.969 0.073 . 1 . . 361 . . 48 VAL CA . 18863 1
581 . 1 1 66 66 VAL CB C 13 34.092 0.054 . 1 . . 359 . . 48 VAL CB . 18863 1
582 . 1 1 66 66 VAL CG1 C 13 22.346 0.041 . 1 . . 683 . . 48 VAL CG1 . 18863 1
583 . 1 1 66 66 VAL CG2 C 13 22.321 0.041 . 1 . . 685 . . 48 VAL CG2 . 18863 1
584 . 1 1 66 66 VAL N N 15 117.221 0.107 . 1 . . 122 . . 48 VAL N . 18863 1
585 . 1 1 67 67 TRP H H 1 8.019 0.024 . 1 . . 19 . . 49 TRP H . 18863 1
586 . 1 1 67 67 TRP HA H 1 4.511 0.021 . 1 . . 362 . . 49 TRP HA . 18863 1
587 . 1 1 67 67 TRP HB2 H 1 3.217 0.007 . 1 . . 364 . . 49 TRP HB2 . 18863 1
588 . 1 1 67 67 TRP HB3 H 1 3.213 0.003 . 1 . . 686 . . 49 TRP HB3 . 18863 1
589 . 1 1 67 67 TRP HD1 H 1 7.058 0.017 . 1 . . 483 . . 49 TRP HD1 . 18863 1
590 . 1 1 67 67 TRP HE1 H 1 10.143 0.002 . 1 . . 1 . . 49 TRP HE1 . 18863 1
591 . 1 1 67 67 TRP HE3 H 1 7.358 0.006 . 1 . . 470 . . 49 TRP HE3 . 18863 1
592 . 1 1 67 67 TRP HZ2 H 1 7.215 0.011 . 1 . . 730 . . 49 TRP HZ2 . 18863 1
593 . 1 1 67 67 TRP HZ3 H 1 6.841 0.01 . 1 . . 740 . . 49 TRP HZ3 . 18863 1
594 . 1 1 67 67 TRP HH2 H 1 6.968 0.013 . 1 . . 734 . . 49 TRP HH2 . 18863 1
595 . 1 1 67 67 TRP CA C 13 62.867 0.073 . 1 . . 363 . . 49 TRP CA . 18863 1
596 . 1 1 67 67 TRP CB C 13 29.058 0.02 . 1 . . 365 . . 49 TRP CB . 18863 1
597 . 1 1 67 67 TRP CD1 C 13 127.438 0.041 . 1 . . 484 . . 49 TRP CD1 . 18863 1
598 . 1 1 67 67 TRP CZ2 C 13 115.236 0.041 . 1 . . 731 . . 49 TRP CZ2 . 18863 1
599 . 1 1 67 67 TRP CZ3 C 13 122.671 0.041 . 1 . . 741 . . 49 TRP CZ3 . 18863 1
600 . 1 1 67 67 TRP CH2 C 13 125.301 0.021 . 1 . . 735 . . 49 TRP CH2 . 18863 1
601 . 1 1 67 67 TRP N N 15 122.735 0.064 . 1 . . 20 . . 49 TRP N . 18863 1
602 . 1 1 67 67 TRP NE1 N 15 128.744 0.094 . 1 . . 2 . . 49 TRP NE1 . 18863 1
603 . 1 1 68 68 PRO HA H 1 3.990 0.029 . 1 . . 687 . . 50 PRO HA . 18863 1
604 . 1 1 68 68 PRO HB2 H 1 1.647 0.021 . 1 . . 689 . . 50 PRO HB2 . 18863 1
605 . 1 1 68 68 PRO HB3 H 1 1.629 0.021 . 1 . . 691 . . 50 PRO HB3 . 18863 1
606 . 1 1 68 68 PRO C C 13 179.415 0.298 . 1 . . 561 . . 50 PRO C . 18863 1
607 . 1 1 68 68 PRO CA C 13 67.827 0.073 . 1 . . 688 . . 50 PRO CA . 18863 1
608 . 1 1 68 68 PRO CB C 13 32.712 0.005 . 1 . . 690 . . 50 PRO CB . 18863 1
609 . 1 1 69 69 LEU H H 1 7.064 0.006 . 1 . . 135 . . 51 LEU H . 18863 1
610 . 1 1 69 69 LEU HA H 1 4.006 0.034 . 1 . . 366 . . 51 LEU HA . 18863 1
611 . 1 1 69 69 LEU HB2 H 1 1.685 0.021 . 1 . . 692 . . 51 LEU HB2 . 18863 1
612 . 1 1 69 69 LEU HB3 H 1 1.661 0.021 . 1 . . 694 . . 51 LEU HB3 . 18863 1
613 . 1 1 69 69 LEU HG H 1 1.642 0.021 . 1 . . 695 . . 51 LEU HG . 18863 1
614 . 1 1 69 69 LEU HD11 H 1 0.848 0.021 . 1 . . 697 . . 51 LEU HD11 . 18863 1
615 . 1 1 69 69 LEU HD12 H 1 0.848 0.021 . 1 . . 697 . . 51 LEU HD12 . 18863 1
616 . 1 1 69 69 LEU HD13 H 1 0.848 0.021 . 1 . . 697 . . 51 LEU HD13 . 18863 1
617 . 1 1 69 69 LEU HD21 H 1 0.809 0.021 . 1 . . 699 . . 51 LEU HD21 . 18863 1
618 . 1 1 69 69 LEU HD22 H 1 0.809 0.021 . 1 . . 699 . . 51 LEU HD22 . 18863 1
619 . 1 1 69 69 LEU HD23 H 1 0.809 0.021 . 1 . . 699 . . 51 LEU HD23 . 18863 1
620 . 1 1 69 69 LEU C C 13 179.671 0.298 . 1 . . 562 . . 51 LEU C . 18863 1
621 . 1 1 69 69 LEU CA C 13 59.172 0.073 . 1 . . 367 . . 51 LEU CA . 18863 1
622 . 1 1 69 69 LEU CB C 13 43.245 0.006 . 1 . . 693 . . 51 LEU CB . 18863 1
623 . 1 1 69 69 LEU CG C 13 28.640 0.041 . 1 . . 696 . . 51 LEU CG . 18863 1
624 . 1 1 69 69 LEU CD1 C 13 25.734 0.041 . 1 . . 698 . . 51 LEU CD1 . 18863 1
625 . 1 1 69 69 LEU CD2 C 13 25.685 0.041 . 1 . . 700 . . 51 LEU CD2 . 18863 1
626 . 1 1 69 69 LEU N N 15 116.129 0.08 . 1 . . 136 . . 51 LEU N . 18863 1
627 . 1 1 70 70 LEU H H 1 7.831 0.013 . 1 . . 79 . . 52 LEU H . 18863 1
628 . 1 1 70 70 LEU HA H 1 3.906 0.0 . 1 . . 370 . . 52 LEU HA . 18863 1
629 . 1 1 70 70 LEU HB2 H 1 1.590 0.021 . 1 . . 701 . . 52 LEU HB2 . 18863 1
630 . 1 1 70 70 LEU HB3 H 1 1.538 0.016 . 1 . . 702 . . 52 LEU HB3 . 18863 1
631 . 1 1 70 70 LEU CA C 13 59.689 0.073 . 1 . . 371 . . 52 LEU CA . 18863 1
632 . 1 1 70 70 LEU CB C 13 43.126 0.049 . 1 . . 592 . . 52 LEU CB . 18863 1
633 . 1 1 70 70 LEU N N 15 119.629 0.147 . 1 . . 80 . . 52 LEU N . 18863 1
634 . 1 1 71 71 LEU H H 1 7.828 0.009 . 1 . . 109 . . 53 LEU H . 18863 1
635 . 1 1 71 71 LEU HA H 1 4.015 0.029 . 1 . . 703 . . 53 LEU HA . 18863 1
636 . 1 1 71 71 LEU HB2 H 1 1.801 0.021 . 1 . . 704 . . 53 LEU HB2 . 18863 1
637 . 1 1 71 71 LEU HB3 H 1 1.652 0.021 . 1 . . 705 . . 53 LEU HB3 . 18863 1
638 . 1 1 71 71 LEU HG H 1 1.492 0.021 . 1 . . 749 . . 53 LEU HG . 18863 1
639 . 1 1 71 71 LEU CA C 13 59.491 0.013 . 1 . . 589 . . 53 LEU CA . 18863 1
640 . 1 1 71 71 LEU CB C 13 43.147 0.115 . 1 . . 591 . . 53 LEU CB . 18863 1
641 . 1 1 71 71 LEU N N 15 117.945 0.134 . 1 . . 110 . . 53 LEU N . 18863 1
642 . 1 1 72 72 LEU H H 1 7.513 0.001 . 1 . . 93 . . 54 LEU H . 18863 1
643 . 1 1 72 72 LEU HA H 1 3.961 0.003 . 1 . . 706 . . 54 LEU HA . 18863 1
644 . 1 1 72 72 LEU HB2 H 1 1.711 0.021 . 1 . . 707 . . 54 LEU HB2 . 18863 1
645 . 1 1 72 72 LEU HB3 H 1 1.677 0.021 . 1 . . 708 . . 54 LEU HB3 . 18863 1
646 . 1 1 72 72 LEU CA C 13 59.528 0.043 . 1 . . 588 . . 54 LEU CA . 18863 1
647 . 1 1 72 72 LEU CB C 13 43.432 0.066 . 1 . . 590 . . 54 LEU CB . 18863 1
648 . 1 1 72 72 LEU N N 15 119.409 0.009 . 1 . . 94 . . 54 LEU N . 18863 1
649 . 1 1 73 73 LEU H H 1 7.822 0.002 . 1 . . 103 . . 55 LEU H . 18863 1
650 . 1 1 73 73 LEU HA H 1 4.000 0.029 . 1 . . 709 . . 55 LEU HA . 18863 1
651 . 1 1 73 73 LEU HB2 H 1 1.857 0.021 . 1 . . 710 . . 55 LEU HB2 . 18863 1
652 . 1 1 73 73 LEU HB3 H 1 1.841 0.021 . 1 . . 711 . . 55 LEU HB3 . 18863 1
653 . 1 1 73 73 LEU C C 13 180.043 0.298 . 1 . . 564 . . 55 LEU C . 18863 1
654 . 1 1 73 73 LEU CA C 13 59.214 0.125 . 1 . . 586 . . 55 LEU CA . 18863 1
655 . 1 1 73 73 LEU CB C 13 43.476 0.024 . 1 . . 587 . . 55 LEU CB . 18863 1
656 . 1 1 73 73 LEU N N 15 118.344 0.058 . 1 . . 104 . . 55 LEU N . 18863 1
657 . 1 1 74 74 LEU H H 1 7.748 0.012 . 1 . . 125 . . 56 LEU H . 18863 1
658 . 1 1 74 74 LEU HA H 1 4.064 0.029 . 1 . . 712 . . 56 LEU HA . 18863 1
659 . 1 1 74 74 LEU HB2 H 1 1.831 0.021 . 1 . . 713 . . 56 LEU HB2 . 18863 1
660 . 1 1 74 74 LEU HB3 H 1 1.442 0.021 . 1 . . 714 . . 56 LEU HB3 . 18863 1
661 . 1 1 74 74 LEU HG H 1 1.815 0.021 . 1 . . 715 . . 56 LEU HG . 18863 1
662 . 1 1 74 74 LEU HD11 H 1 0.803 0.021 . 1 . . 717 . . 56 LEU HD11 . 18863 1
663 . 1 1 74 74 LEU HD12 H 1 0.803 0.021 . 1 . . 717 . . 56 LEU HD12 . 18863 1
664 . 1 1 74 74 LEU HD13 H 1 0.803 0.021 . 1 . . 717 . . 56 LEU HD13 . 18863 1
665 . 1 1 74 74 LEU HD21 H 1 0.785 0.021 . 1 . . 719 . . 56 LEU HD21 . 18863 1
666 . 1 1 74 74 LEU HD22 H 1 0.785 0.021 . 1 . . 719 . . 56 LEU HD22 . 18863 1
667 . 1 1 74 74 LEU HD23 H 1 0.785 0.021 . 1 . . 719 . . 56 LEU HD23 . 18863 1
668 . 1 1 74 74 LEU C C 13 178.754 0.298 . 1 . . 565 . . 56 LEU C . 18863 1
669 . 1 1 74 74 LEU CA C 13 58.039 0.073 . 1 . . 234 . . 56 LEU CA . 18863 1
670 . 1 1 74 74 LEU CB C 13 43.754 0.018 . 1 . . 593 . . 56 LEU CB . 18863 1
671 . 1 1 74 74 LEU CG C 13 28.406 0.041 . 1 . . 716 . . 56 LEU CG . 18863 1
672 . 1 1 74 74 LEU CD1 C 13 26.531 0.041 . 1 . . 718 . . 56 LEU CD1 . 18863 1
673 . 1 1 74 74 LEU CD2 C 13 24.212 0.041 . 1 . . 720 . . 56 LEU CD2 . 18863 1
674 . 1 1 74 74 LEU N N 15 117.210 0.096 . 1 . . 126 . . 56 LEU N . 18863 1
675 . 1 1 75 75 ALA H H 1 7.630 0.012 . 1 . . 77 . . 57 ALA H . 18863 1
676 . 1 1 75 75 ALA HA H 1 4.197 0.013 . 1 . . 374 . . 57 ALA HA . 18863 1
677 . 1 1 75 75 ALA HB1 H 1 1.388 0.021 . 1 . . 376 . . 57 ALA HB1 . 18863 1
678 . 1 1 75 75 ALA HB2 H 1 1.388 0.021 . 1 . . 376 . . 57 ALA HB2 . 18863 1
679 . 1 1 75 75 ALA HB3 H 1 1.388 0.021 . 1 . . 376 . . 57 ALA HB3 . 18863 1
680 . 1 1 75 75 ALA C C 13 178.868 0.298 . 1 . . 566 . . 57 ALA C . 18863 1
681 . 1 1 75 75 ALA CA C 13 54.353 0.032 . 1 . . 221 . . 57 ALA CA . 18863 1
682 . 1 1 75 75 ALA CB C 13 20.595 0.054 . 1 . . 377 . . 57 ALA CB . 18863 1
683 . 1 1 75 75 ALA N N 15 119.870 0.088 . 1 . . 78 . . 57 ALA N . 18863 1
684 . 1 1 76 76 LEU H H 1 7.637 0.005 . 1 . . 97 . . 58 LEU H . 18863 1
685 . 1 1 76 76 LEU HB2 H 1 1.753 0.006 . 1 . . 746 . . 58 LEU HB2 . 18863 1
686 . 1 1 76 76 LEU HB3 H 1 1.461 0.021 . 1 . . 748 . . 58 LEU HB3 . 18863 1
687 . 1 1 76 76 LEU CA C 13 57.295 0.073 . 1 . . 222 . . 58 LEU CA . 18863 1
688 . 1 1 76 76 LEU CB C 13 43.286 0.019 . 1 . . 747 . . 58 LEU CB . 18863 1
689 . 1 1 76 76 LEU N N 15 119.139 0.105 . 1 . . 98 . . 58 LEU N . 18863 1
690 . 1 1 78 78 PRO HA H 1 4.269 0.019 . 1 . . 751 . . 60 PRO HA . 18863 1
691 . 1 1 78 78 PRO C C 13 179.039 0.298 . 1 . . 567 . . 60 PRO C . 18863 1
692 . 1 1 78 78 PRO CA C 13 66.774 0.073 . 1 . . 752 . . 60 PRO CA . 18863 1
693 . 1 1 79 79 ARG H H 1 7.704 0.019 . 1 . . 115 . . 61 ARG H . 18863 1
694 . 1 1 79 79 ARG HA H 1 4.063 0.045 . 1 . . 501 . . 61 ARG HA . 18863 1
695 . 1 1 79 79 ARG HB2 H 1 2.033 0.021 . 1 . . 503 . . 61 ARG HB2 . 18863 1
696 . 1 1 79 79 ARG HB3 H 1 1.933 0.021 . 1 . . 505 . . 61 ARG HB3 . 18863 1
697 . 1 1 79 79 ARG C C 13 178.213 0.298 . 1 . . 568 . . 61 ARG C . 18863 1
698 . 1 1 79 79 ARG CA C 13 59.324 0.066 . 1 . . 213 . . 61 ARG CA . 18863 1
699 . 1 1 79 79 ARG CB C 13 31.063 0.03 . 1 . . 504 . . 61 ARG CB . 18863 1
700 . 1 1 79 79 ARG N N 15 117.896 0.088 . 1 . . 116 . . 61 ARG N . 18863 1
701 . 1 1 80 80 ALA H H 1 8.161 0.007 . 1 . . 21 . . 62 ALA H . 18863 1
702 . 1 1 80 80 ALA HA H 1 4.074 0.03 . 1 . . 460 . . 62 ALA HA . 18863 1
703 . 1 1 80 80 ALA HB1 H 1 1.280 0.015 . 1 . . 462 . . 62 ALA HB1 . 18863 1
704 . 1 1 80 80 ALA HB2 H 1 1.280 0.015 . 1 . . 462 . . 62 ALA HB2 . 18863 1
705 . 1 1 80 80 ALA HB3 H 1 1.280 0.015 . 1 . . 462 . . 62 ALA HB3 . 18863 1
706 . 1 1 80 80 ALA C C 13 179.703 0.298 . 1 . . 569 . . 62 ALA C . 18863 1
707 . 1 1 80 80 ALA CA C 13 55.571 0.073 . 1 . . 461 . . 62 ALA CA . 18863 1
708 . 1 1 80 80 ALA CB C 13 20.255 0.054 . 1 . . 463 . . 62 ALA CB . 18863 1
709 . 1 1 80 80 ALA N N 15 122.652 0.02 . 1 . . 22 . . 62 ALA N . 18863 1
710 . 1 1 81 81 TYR H H 1 7.958 0.019 . 1 . . 113 . . 63 TYR H . 18863 1
711 . 1 1 81 81 TYR HA H 1 4.144 0.029 . 1 . . 378 . . 63 TYR HA . 18863 1
712 . 1 1 81 81 TYR HB2 H 1 2.982 0.021 . 1 . . 721 . . 63 TYR HB2 . 18863 1
713 . 1 1 81 81 TYR HB3 H 1 2.882 0.021 . 1 . . 464 . . 63 TYR HB3 . 18863 1
714 . 1 1 81 81 TYR HD1 H 1 6.897 0.001 . 3 . . 722 . . 63 TYR HD1 . 18863 1
715 . 1 1 81 81 TYR HD2 H 1 6.897 0.001 . 3 . . 722 . . 63 TYR HD2 . 18863 1
716 . 1 1 81 81 TYR HE1 H 1 6.569 0.004 . 3 . . 724 . . 63 TYR HE1 . 18863 1
717 . 1 1 81 81 TYR HE2 H 1 6.569 0.004 . 3 . . 724 . . 63 TYR HE2 . 18863 1
718 . 1 1 81 81 TYR C C 13 177.824 0.298 . 1 . . 570 . . 63 TYR C . 18863 1
719 . 1 1 81 81 TYR CA C 13 61.526 0.04 . 1 . . 211 . . 63 TYR CA . 18863 1
720 . 1 1 81 81 TYR CB C 13 39.898 0.005 . 1 . . 465 . . 63 TYR CB . 18863 1
721 . 1 1 81 81 TYR CD1 C 13 133.998 0.041 . 3 . . 723 . . 63 TYR CD1 . 18863 1
722 . 1 1 81 81 TYR CD2 C 13 133.998 0.041 . 3 . . 723 . . 63 TYR CD2 . 18863 1
723 . 1 1 81 81 TYR CE1 C 13 118.841 0.041 . 3 . . 725 . . 63 TYR CE1 . 18863 1
724 . 1 1 81 81 TYR CE2 C 13 118.841 0.041 . 3 . . 725 . . 63 TYR CE2 . 18863 1
725 . 1 1 81 81 TYR N N 15 117.821 0.08 . 1 . . 114 . . 63 TYR N . 18863 1
726 . 1 1 82 82 ALA H H 1 7.914 0.01 . 1 . . 29 . . 64 ALA H . 18863 1
727 . 1 1 82 82 ALA HA H 1 4.035 0.039 . 1 . . 442 . . 64 ALA HA . 18863 1
728 . 1 1 82 82 ALA HB1 H 1 1.323 0.009 . 1 . . 443 . . 64 ALA HB1 . 18863 1
729 . 1 1 82 82 ALA HB2 H 1 1.323 0.009 . 1 . . 443 . . 64 ALA HB2 . 18863 1
730 . 1 1 82 82 ALA HB3 H 1 1.323 0.009 . 1 . . 443 . . 64 ALA HB3 . 18863 1
731 . 1 1 82 82 ALA C C 13 179.637 0.298 . 1 . . 571 . . 64 ALA C . 18863 1
732 . 1 1 82 82 ALA CA C 13 55.437 0.049 . 1 . . 210 . . 64 ALA CA . 18863 1
733 . 1 1 82 82 ALA CB C 13 19.979 0.054 . 1 . . 444 . . 64 ALA CB . 18863 1
734 . 1 1 82 82 ALA N N 15 121.804 0.163 . 1 . . 30 . . 64 ALA N . 18863 1
735 . 1 1 83 83 ALA H H 1 7.877 0.015 . 1 . . 69 . . 65 ALA H . 18863 1
736 . 1 1 83 83 ALA HA H 1 4.074 0.024 . 1 . . 447 . . 65 ALA HA . 18863 1
737 . 1 1 83 83 ALA HB1 H 1 1.328 0.021 . 1 . . 445 . . 65 ALA HB1 . 18863 1
738 . 1 1 83 83 ALA HB2 H 1 1.328 0.021 . 1 . . 445 . . 65 ALA HB2 . 18863 1
739 . 1 1 83 83 ALA HB3 H 1 1.328 0.021 . 1 . . 445 . . 65 ALA HB3 . 18863 1
740 . 1 1 83 83 ALA C C 13 179.256 0.298 . 1 . . 572 . . 65 ALA C . 18863 1
741 . 1 1 83 83 ALA CA C 13 55.167 0.008 . 1 . . 209 . . 65 ALA CA . 18863 1
742 . 1 1 83 83 ALA CB C 13 20.147 0.054 . 1 . . 446 . . 65 ALA CB . 18863 1
743 . 1 1 83 83 ALA N N 15 120.321 0.152 . 1 . . 70 . . 65 ALA N . 18863 1
744 . 1 1 84 84 ALA H H 1 7.782 0.002 . 1 . . 67 . . 66 ALA H . 18863 1
745 . 1 1 84 84 ALA HA H 1 4.127 0.029 . 1 . . 449 . . 66 ALA HA . 18863 1
746 . 1 1 84 84 ALA HB1 H 1 1.315 0.021 . 1 . . 451 . . 66 ALA HB1 . 18863 1
747 . 1 1 84 84 ALA HB2 H 1 1.315 0.021 . 1 . . 451 . . 66 ALA HB2 . 18863 1
748 . 1 1 84 84 ALA HB3 H 1 1.315 0.021 . 1 . . 451 . . 66 ALA HB3 . 18863 1
749 . 1 1 84 84 ALA C C 13 178.081 0.298 . 1 . . 573 . . 66 ALA C . 18863 1
750 . 1 1 84 84 ALA CA C 13 54.534 0.01 . 1 . . 208 . . 66 ALA CA . 18863 1
751 . 1 1 84 84 ALA CB C 13 20.295 0.054 . 1 . . 452 . . 66 ALA CB . 18863 1
752 . 1 1 84 84 ALA N N 15 120.300 0.016 . 1 . . 68 . . 66 ALA N . 18863 1
753 . 1 1 85 85 ALA H H 1 7.708 0.004 . 1 . . 75 . . 67 ALA H . 18863 1
754 . 1 1 85 85 ALA HA H 1 4.270 0.029 . 1 . . 455 . . 67 ALA HA . 18863 1
755 . 1 1 85 85 ALA HB1 H 1 1.231 0.021 . 1 . . 453 . . 67 ALA HB1 . 18863 1
756 . 1 1 85 85 ALA HB2 H 1 1.231 0.021 . 1 . . 453 . . 67 ALA HB2 . 18863 1
757 . 1 1 85 85 ALA HB3 H 1 1.231 0.021 . 1 . . 453 . . 67 ALA HB3 . 18863 1
758 . 1 1 85 85 ALA C C 13 177.735 0.298 . 1 . . 574 . . 67 ALA C . 18863 1
759 . 1 1 85 85 ALA CA C 13 53.291 0.033 . 1 . . 207 . . 67 ALA CA . 18863 1
760 . 1 1 85 85 ALA CB C 13 20.425 0.054 . 1 . . 454 . . 67 ALA CB . 18863 1
761 . 1 1 85 85 ALA N N 15 119.792 0.028 . 1 . . 76 . . 67 ALA N . 18863 1
762 . 1 1 86 86 SER H H 1 7.577 0.006 . 1 . . 143 . . 68 SER H . 18863 1
763 . 1 1 86 86 SER HA H 1 3.811 0.029 . 1 . . 456 . . 68 SER HA . 18863 1
764 . 1 1 86 86 SER HB2 H 1 4.119 0.021 . 1 . . 486 . . 68 SER HB2 . 18863 1
765 . 1 1 86 86 SER HB3 H 1 4.076 0.021 . 1 . . 489 . . 68 SER HB3 . 18863 1
766 . 1 1 86 86 SER CA C 13 59.619 0.073 . 1 . . 457 . . 68 SER CA . 18863 1
767 . 1 1 86 86 SER CB C 13 65.802 0.054 . 1 . . 459 . . 68 SER CB . 18863 1
768 . 1 1 86 86 SER N N 15 114.021 0.026 . 1 . . 144 . . 68 SER N . 18863 1
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