Content for NMR-STAR saveframe, "0_m_urea_shifts"
save_0_m_urea_shifts
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode 0_m_urea_shifts
_Assigned_chem_shift_list.Entry_ID 17513
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $Normal
_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 CBCA(CO)NH' 1 $0.5mM isotropic 17513 1
2 '2D 1H-15N HSQC/HMQC' 1 $0.5mM isotropic 17513 1
3 '3D HNCA' 1 $0.5mM isotropic 17513 1
4 'HNCACO (H[N[ca[CO]]])' 1 $0.5mM isotropic 17513 1
5 '3D HNCO' 1 $0.5mM isotropic 17513 1
6 '3D HNCACB' 1 $0.5mM isotropic 17513 1
7 'Expt_10 (h[N]_H[N].NOESY)' 1 $0.5mM isotropic 17513 1
8 'Expt_12 (H{[N]+[HA]})' 1 $0.5mM isotropic 17513 1
9 'Expt_13 (h[N]_H.NOESY)' 1 $0.5mM isotropic 17513 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.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 9 9 GLU H H 1 8.600 0.006 . 1 . 386 . . 9 GLU H . 17513 1
2 . 1 1 9 9 GLU HA H 1 4.236 . . 1 . 431 . . 9 GLU HA . 17513 1
3 . 1 1 9 9 GLU C C 13 176.314 0.01 . 1 . 383 . . 9 GLU C . 17513 1
4 . 1 1 9 9 GLU CA C 13 56.396 0.006 . 1 . 384 . . 9 GLU CA . 17513 1
5 . 1 1 9 9 GLU CB C 13 30.117 . . 1 . 385 . . 9 GLU CB . 17513 1
6 . 1 1 9 9 GLU N N 15 122.405 0.058 . 1 . 387 . . 9 GLU N . 17513 1
7 . 1 1 10 10 LEU H H 1 8.442 0.009 . 1 . 381 . . 10 LEU H . 17513 1
8 . 1 1 10 10 LEU HA H 1 4.317 . . 1 . 419 . . 10 LEU HA . 17513 1
9 . 1 1 10 10 LEU C C 13 177.416 0.03 . 1 . 380 . . 10 LEU C . 17513 1
10 . 1 1 10 10 LEU CA C 13 55.123 0.017 . 1 . 377 . . 10 LEU CA . 17513 1
11 . 1 1 10 10 LEU CB C 13 42.006 . . 1 . 379 . . 10 LEU CB . 17513 1
12 . 1 1 10 10 LEU N N 15 123.833 0.063 . 1 . 382 . . 10 LEU N . 17513 1
13 . 1 1 11 11 LYS H H 1 8.436 0.011 . 1 . 374 . . 11 LYS H . 17513 1
14 . 1 1 11 11 LYS C C 13 176.308 0.002 . 1 . 337 . . 11 LYS C . 17513 1
15 . 1 1 11 11 LYS CA C 13 56.409 0.032 . 1 . 335 . . 11 LYS CA . 17513 1
16 . 1 1 11 11 LYS CB C 13 32.832 . . 1 . 336 . . 11 LYS CB . 17513 1
17 . 1 1 11 11 LYS N N 15 122.340 0.041 . 1 . 375 . . 11 LYS N . 17513 1
18 . 1 1 12 12 ASN H H 1 8.536 0.01 . 1 . 152 . . 12 ASN H . 17513 1
19 . 1 1 12 12 ASN HA H 1 4.710 . . 1 . 463 . . 12 ASN HA . 17513 1
20 . 1 1 12 12 ASN C C 13 175.139 0.005 . 1 . 304 . . 12 ASN C . 17513 1
21 . 1 1 12 12 ASN CA C 13 53.232 0.053 . 1 . 184 . . 12 ASN CA . 17513 1
22 . 1 1 12 12 ASN CB C 13 38.820 . . 1 . 185 . . 12 ASN CB . 17513 1
23 . 1 1 12 12 ASN N N 15 119.717 0.101 . 1 . 153 . . 12 ASN N . 17513 1
24 . 1 1 13 13 SER H H 1 8.371 0.012 . 1 . 182 . . 13 SER H . 17513 1
25 . 1 1 13 13 SER HA H 1 4.457 . . 1 . 471 . . 13 SER HA . 17513 1
26 . 1 1 13 13 SER C C 13 174.581 0.001 . 1 . 291 . . 13 SER C . 17513 1
27 . 1 1 13 13 SER CA C 13 58.385 0.039 . 1 . 326 . . 13 SER CA . 17513 1
28 . 1 1 13 13 SER CB C 13 63.684 . . 1 . 221 . . 13 SER CB . 17513 1
29 . 1 1 13 13 SER N N 15 116.289 0.042 . 1 . 183 . . 13 SER N . 17513 1
30 . 1 1 14 14 ILE H H 1 8.290 0.011 . 1 . 214 . . 14 ILE H . 17513 1
31 . 1 1 14 14 ILE HA H 1 4.186 . . 1 . 434 . . 14 ILE HA . 17513 1
32 . 1 1 14 14 ILE C C 13 176.454 0.013 . 1 . 265 . . 14 ILE C . 17513 1
33 . 1 1 14 14 ILE CA C 13 61.415 0.024 . 1 . 163 . . 14 ILE CA . 17513 1
34 . 1 1 14 14 ILE CB C 13 38.506 . . 1 . 164 . . 14 ILE CB . 17513 1
35 . 1 1 14 14 ILE N N 15 122.450 0.025 . 1 . 215 . . 14 ILE N . 17513 1
36 . 1 1 15 15 SER H H 1 8.376 0.013 . 1 . 161 . . 15 SER H . 17513 1
37 . 1 1 15 15 SER HA H 1 4.401 . . 1 . 465 . . 15 SER HA . 17513 1
38 . 1 1 15 15 SER C C 13 174.094 0.007 . 1 . 289 . . 15 SER C . 17513 1
39 . 1 1 15 15 SER CA C 13 58.468 0.04 . 1 . 323 . . 15 SER CA . 17513 1
40 . 1 1 15 15 SER CB C 13 63.834 . . 1 . 86 . . 15 SER CB . 17513 1
41 . 1 1 15 15 SER N N 15 119.277 0.057 . 1 . 162 . . 15 SER N . 17513 1
42 . 1 1 16 16 ASP H H 1 8.305 0.01 . 1 . 84 . . 16 ASP H . 17513 1
43 . 1 1 16 16 ASP HA H 1 4.576 . . 1 . 435 . . 16 ASP HA . 17513 1
44 . 1 1 16 16 ASP C C 13 175.882 0.03 . 1 . 260 . . 16 ASP C . 17513 1
45 . 1 1 16 16 ASP CA C 13 54.351 0.04 . 1 . 319 . . 16 ASP CA . 17513 1
46 . 1 1 16 16 ASP CB C 13 41.165 . . 1 . 217 . . 16 ASP CB . 17513 1
47 . 1 1 16 16 ASP N N 15 122.341 0.062 . 1 . 85 . . 16 ASP N . 17513 1
48 . 1 1 17 17 TYR H H 1 8.139 0.013 . 1 . 283 . . 17 TYR H . 17513 1
49 . 1 1 17 17 TYR HA H 1 4.584 . . 1 . 458 . . 17 TYR HA . 17513 1
50 . 1 1 17 17 TYR C C 13 176.090 0.014 . 1 . 285 . . 17 TYR C . 17513 1
51 . 1 1 17 17 TYR CA C 13 58.014 0.012 . 1 . 176 . . 17 TYR CA . 17513 1
52 . 1 1 17 17 TYR CB C 13 38.599 . . 1 . 180 . . 17 TYR CB . 17513 1
53 . 1 1 17 17 TYR N N 15 120.742 0.075 . 1 . 284 . . 17 TYR N . 17513 1
54 . 1 1 18 18 THR H H 1 8.195 0.013 . 1 . 174 . . 18 THR H . 17513 1
55 . 1 1 18 18 THR C C 13 174.391 0.003 . 1 . 253 . . 18 THR C . 17513 1
56 . 1 1 18 18 THR CA C 13 61.884 0.02 . 1 . 47 . . 18 THR CA . 17513 1
57 . 1 1 18 18 THR CB C 13 70.053 . . 1 . 46 . . 18 THR CB . 17513 1
58 . 1 1 18 18 THR N N 15 116.751 0.015 . 1 . 175 . . 18 THR N . 17513 1
59 . 1 1 19 19 GLU H H 1 8.471 0.011 . 1 . 44 . . 19 GLU H . 17513 1
60 . 1 1 19 19 GLU HA H 1 4.178 . . 1 . 422 . . 19 GLU HA . 17513 1
61 . 1 1 19 19 GLU C C 13 176.650 0.007 . 1 . 247 . . 19 GLU C . 17513 1
62 . 1 1 19 19 GLU CA C 13 57.198 0.044 . 1 . 310 . . 19 GLU CA . 17513 1
63 . 1 1 19 19 GLU CB C 13 29.929 . . 1 . 29 . . 19 GLU CB . 17513 1
64 . 1 1 19 19 GLU N N 15 123.380 0.106 . 1 . 45 . . 19 GLU N . 17513 1
65 . 1 1 20 20 ALA H H 1 8.343 0.012 . 1 . 27 . . 20 ALA H . 17513 1
66 . 1 1 20 20 ALA HA H 1 4.196 . . 1 . 415 . . 20 ALA HA . 17513 1
67 . 1 1 20 20 ALA C C 13 178.366 0.001 . 1 . 246 . . 20 ALA C . 17513 1
68 . 1 1 20 20 ALA CA C 13 53.224 0.04 . 1 . 401 . . 20 ALA CA . 17513 1
69 . 1 1 20 20 ALA CB C 13 19.193 . . 1 . 156 . . 20 ALA CB . 17513 1
70 . 1 1 20 20 ALA N N 15 124.160 0.058 . 1 . 28 . . 20 ALA N . 17513 1
71 . 1 1 21 21 GLU H H 1 8.308 0.011 . 1 . 154 . . 21 GLU H . 17513 1
72 . 1 1 21 21 GLU C C 13 176.804 0.012 . 1 . 277 . . 21 GLU C . 17513 1
73 . 1 1 21 21 GLU CA C 13 57.148 0.03 . 1 . 116 . . 21 GLU CA . 17513 1
74 . 1 1 21 21 GLU CB C 13 30.016 . . 1 . 232 . . 21 GLU CB . 17513 1
75 . 1 1 21 21 GLU N N 15 119.592 0.111 . 1 . 155 . . 21 GLU N . 17513 1
76 . 1 1 22 22 PHE H H 1 8.249 0.013 . 1 . 114 . . 22 PHE H . 17513 1
77 . 1 1 22 22 PHE HA H 1 4.507 . . 1 . 448 . . 22 PHE HA . 17513 1
78 . 1 1 22 22 PHE C C 13 175.992 0.004 . 1 . 276 . . 22 PHE C . 17513 1
79 . 1 1 22 22 PHE CA C 13 58.440 0.01 . 1 . 58 . . 22 PHE CA . 17513 1
80 . 1 1 22 22 PHE CB C 13 39.055 . . 1 . 231 . . 22 PHE CB . 17513 1
81 . 1 1 22 22 PHE N N 15 121.382 0.085 . 1 . 115 . . 22 PHE N . 17513 1
82 . 1 1 23 23 VAL H H 1 8.062 0.011 . 1 . 56 . . 23 VAL H . 17513 1
83 . 1 1 23 23 VAL HA H 1 3.896 . . 1 . 428 . . 23 VAL HA . 17513 1
84 . 1 1 23 23 VAL C C 13 176.200 0.002 . 1 . 255 . . 23 VAL C . 17513 1
85 . 1 1 23 23 VAL CA C 13 62.967 0.015 . 1 . 39 . . 23 VAL CA . 17513 1
86 . 1 1 23 23 VAL CB C 13 32.659 . . 1 . 40 . . 23 VAL CB . 17513 1
87 . 1 1 23 23 VAL N N 15 123.114 0.054 . 1 . 57 . . 23 VAL N . 17513 1
88 . 1 1 24 24 GLN H H 1 8.337 0.015 . 1 . 37 . . 24 GLN H . 17513 1
89 . 1 1 24 24 GLN HA H 1 4.154 . . 1 . 418 . . 24 GLN HA . 17513 1
90 . 1 1 24 24 GLN C C 13 176.068 0.013 . 1 . 235 . . 24 GLN C . 17513 1
91 . 1 1 24 24 GLN CA C 13 56.251 0.014 . 1 . 9 . . 24 GLN CA . 17513 1
92 . 1 1 24 24 GLN N N 15 123.761 0.055 . 1 . 38 . . 24 GLN N . 17513 1
93 . 1 1 25 25 ALA H H 1 8.366 0.013 . 1 . 7 . . 25 ALA H . 17513 1
94 . 1 1 25 25 ALA HA H 1 4.214 . . 1 . 406 . . 25 ALA HA . 17513 1
95 . 1 1 25 25 ALA C C 13 177.950 0.012 . 1 . 234 . . 25 ALA C . 17513 1
96 . 1 1 25 25 ALA CA C 13 52.708 . . 1 . 307 . . 25 ALA CA . 17513 1
97 . 1 1 25 25 ALA N N 15 125.474 0.055 . 1 . 8 . . 25 ALA N . 17513 1
98 . 1 1 26 26 ALA H H 1 8.267 0.013 . 1 . 63 . . 26 ALA H . 17513 1
99 . 1 1 26 26 ALA HA H 1 4.194 . . 1 . 427 . . 26 ALA HA . 17513 1
100 . 1 1 26 26 ALA C C 13 178.229 0.004 . 1 . 257 . . 26 ALA C . 17513 1
101 . 1 1 26 26 ALA CA C 13 52.767 0.006 . 1 . 65 . . 26 ALA CA . 17513 1
102 . 1 1 26 26 ALA CB C 13 18.807 0.047 . 1 . 66 . . 26 ALA CB . 17513 1
103 . 1 1 26 26 ALA N N 15 123.199 0.097 . 1 . 64 . . 26 ALA N . 17513 1
104 . 1 1 27 27 LYS H H 1 8.239 0.014 . 1 . 143 . . 27 LYS H . 17513 1
105 . 1 1 27 27 LYS C C 13 177.036 0.017 . 1 . 287 . . 27 LYS C . 17513 1
106 . 1 1 27 27 LYS CA C 13 56.641 0.04 . 1 . 321 . . 27 LYS CA . 17513 1
107 . 1 1 27 27 LYS CB C 13 32.950 . . 1 . 98 . . 27 LYS CB . 17513 1
108 . 1 1 27 27 LYS N N 15 120.463 0.014 . 1 . 144 . . 27 LYS N . 17513 1
109 . 1 1 28 28 GLU H H 1 8.385 0.012 . 1 . 96 . . 28 GLU H . 17513 1
110 . 1 1 28 28 GLU C C 13 176.770 0.001 . 1 . 268 . . 28 GLU C . 17513 1
111 . 1 1 28 28 GLU CA C 13 56.685 0.047 . 1 . 93 . . 28 GLU CA . 17513 1
112 . 1 1 28 28 GLU CB C 13 29.939 . . 1 . 94 . . 28 GLU CB . 17513 1
113 . 1 1 28 28 GLU N N 15 122.019 0.079 . 1 . 97 . . 28 GLU N . 17513 1
114 . 1 1 29 29 ILE H H 1 8.169 0.015 . 1 . 91 . . 29 ILE H . 17513 1
115 . 1 1 29 29 ILE HA H 1 4.073 . . 1 . 443 . . 29 ILE HA . 17513 1
116 . 1 1 29 29 ILE C C 13 176.519 0.0 . 1 . 267 . . 29 ILE C . 17513 1
117 . 1 1 29 29 ILE CA C 13 61.447 0.035 . 1 . 12 . . 29 ILE CA . 17513 1
118 . 1 1 29 29 ILE CB C 13 38.542 . . 1 . 13 . . 29 ILE CB . 17513 1
119 . 1 1 29 29 ILE N N 15 121.944 0.04 . 1 . 92 . . 29 ILE N . 17513 1
120 . 1 1 30 30 GLU H H 1 8.453 0.014 . 1 . 10 . . 30 GLU H . 17513 1
121 . 1 1 30 30 GLU HA H 1 4.236 . . 1 . 409 . . 30 GLU HA . 17513 1
122 . 1 1 30 30 GLU C C 13 176.606 0.01 . 1 . 239 . . 30 GLU C . 17513 1
123 . 1 1 30 30 GLU CA C 13 56.789 0.005 . 1 . 69 . . 30 GLU CA . 17513 1
124 . 1 1 30 30 GLU CB C 13 29.960 . . 1 . 70 . . 30 GLU CB . 17513 1
125 . 1 1 30 30 GLU N N 15 124.928 0.047 . 1 . 11 . . 30 GLU N . 17513 1
126 . 1 1 31 31 LYS H H 1 8.356 0.012 . 1 . 67 . . 31 LYS H . 17513 1
127 . 1 1 31 31 LYS HA H 1 4.245 . . 1 . 433 . . 31 LYS HA . 17513 1
128 . 1 1 31 31 LYS C C 13 176.682 0.03 . 1 . 258 . . 31 LYS C . 17513 1
129 . 1 1 31 31 LYS N N 15 122.536 0.097 . 1 . 68 . . 31 LYS N . 17513 1
130 . 1 1 32 32 GLU H H 1 8.465 0.014 . 1 . 108 . . 32 GLU H . 17513 1
131 . 1 1 32 32 GLU HA H 1 4.227 . . 1 . 441 . . 32 GLU HA . 17513 1
132 . 1 1 32 32 GLU C C 13 176.274 0.019 . 1 . 273 . . 32 GLU C . 17513 1
133 . 1 1 32 32 GLU CA C 13 56.740 0.062 . 1 . 147 . . 32 GLU CA . 17513 1
134 . 1 1 32 32 GLU CB C 13 30.177 . . 1 . 220 . . 32 GLU CB . 17513 1
135 . 1 1 32 32 GLU N N 15 121.703 0.079 . 1 . 109 . . 32 GLU N . 17513 1
136 . 1 1 33 33 ASN H H 1 8.571 0.014 . 1 . 145 . . 33 ASN H . 17513 1
137 . 1 1 33 33 ASN HA H 1 4.709 . . 1 . 461 . . 33 ASN HA . 17513 1
138 . 1 1 33 33 ASN C C 13 175.114 0.001 . 1 . 305 . . 33 ASN C . 17513 1
139 . 1 1 33 33 ASN CA C 13 53.145 0.048 . 1 . 121 . . 33 ASN CA . 17513 1
140 . 1 1 33 33 ASN CB C 13 38.809 0.079 . 1 . 122 . . 33 ASN CB . 17513 1
141 . 1 1 33 33 ASN N N 15 120.342 0.107 . 1 . 146 . . 33 ASN N . 17513 1
142 . 1 1 34 34 VAL H H 1 8.171 0.016 . 1 . 119 . . 34 VAL H . 17513 1
143 . 1 1 34 34 VAL HA H 1 4.083 . . 1 . 449 . . 34 VAL HA . 17513 1
144 . 1 1 34 34 VAL C C 13 175.814 0.0 . 1 . 278 . . 34 VAL C . 17513 1
145 . 1 1 34 34 VAL CA C 13 62.224 0.013 . 1 . 327 . . 34 VAL CA . 17513 1
146 . 1 1 34 34 VAL CB C 13 32.657 . . 1 . 3 . . 34 VAL CB . 17513 1
147 . 1 1 34 34 VAL N N 15 121.141 0.042 . 1 . 120 . . 34 VAL N . 17513 1
148 . 1 1 35 35 ALA H H 1 8.451 0.013 . 1 . 1 . . 35 ALA H . 17513 1
149 . 1 1 35 35 ALA HA H 1 4.303 . . 1 . 402 . . 35 ALA HA . 17513 1
150 . 1 1 35 35 ALA C C 13 177.449 0.004 . 1 . 233 . . 35 ALA C . 17513 1
151 . 1 1 35 35 ALA CA C 13 52.331 0.064 . 1 . 306 . . 35 ALA CA . 17513 1
152 . 1 1 35 35 ALA N N 15 128.055 0.084 . 1 . 2 . . 35 ALA N . 17513 1
153 . 1 1 36 36 ALA H H 1 8.419 0.014 . 1 . 34 . . 36 ALA H . 17513 1
154 . 1 1 36 36 ALA HA H 1 4.352 . . 1 . 416 . . 36 ALA HA . 17513 1
155 . 1 1 36 36 ALA C C 13 178.028 0.007 . 1 . 294 . . 36 ALA C . 17513 1
156 . 1 1 36 36 ALA CB C 13 19.188 0.021 . 1 . 36 . . 36 ALA CB . 17513 1
157 . 1 1 36 36 ALA N N 15 124.143 0.078 . 1 . 35 . . 36 ALA N . 17513 1
158 . 1 1 37 37 THR H H 1 8.211 0.014 . 1 . 193 . . 37 THR H . 17513 1
159 . 1 1 37 37 THR HA H 1 4.340 . . 1 . 474 . . 37 THR HA . 17513 1
160 . 1 1 37 37 THR C C 13 174.391 0.005 . 1 . 261 . . 37 THR C . 17513 1
161 . 1 1 37 37 THR CA C 13 61.473 0.009 . 1 . 312 . . 37 THR CA . 17513 1
162 . 1 1 37 37 THR CB C 13 69.818 . . 1 . 73 . . 37 THR CB . 17513 1
163 . 1 1 37 37 THR N N 15 113.061 0.039 . 1 . 194 . . 37 THR N . 17513 1
164 . 1 1 38 38 ASP H H 1 8.381 0.016 . 1 . 71 . . 38 ASP H . 17513 1
165 . 1 1 38 38 ASP HA H 1 4.596 . . 1 . 437 . . 38 ASP HA . 17513 1
166 . 1 1 38 38 ASP C C 13 175.884 0.003 . 1 . 259 . . 38 ASP C . 17513 1
167 . 1 1 38 38 ASP CA C 13 54.327 0.09 . 1 . 166 . . 38 ASP CA . 17513 1
168 . 1 1 38 38 ASP CB C 13 41.067 . . 1 . 126 . . 38 ASP CB . 17513 1
169 . 1 1 38 38 ASP N N 15 122.307 0.079 . 1 . 72 . . 38 ASP N . 17513 1
170 . 1 1 39 39 ASP H H 1 8.353 0.015 . 1 . 123 . . 39 ASP H . 17513 1
171 . 1 1 39 39 ASP HA H 1 4.574 . . 1 . 453 . . 39 ASP HA . 17513 1
172 . 1 1 39 39 ASP C C 13 176.185 0.002 . 1 . 299 . . 39 ASP C . 17513 1
173 . 1 1 39 39 ASP CA C 13 54.327 0.04 . 1 . 125 . . 39 ASP CA . 17513 1
174 . 1 1 39 39 ASP CB C 13 41.018 . . 1 . 136 . . 39 ASP CB . 17513 1
175 . 1 1 39 39 ASP N N 15 120.978 0.046 . 1 . 124 . . 39 ASP N . 17513 1
176 . 1 1 40 40 VAL H H 1 8.134 0.016 . 1 . 134 . . 40 VAL H . 17513 1
177 . 1 1 40 40 VAL HA H 1 4.045 . . 1 . 459 . . 40 VAL HA . 17513 1
178 . 1 1 40 40 VAL C C 13 176.235 0.025 . 1 . 237 . . 40 VAL C . 17513 1
179 . 1 1 40 40 VAL CA C 13 62.446 0.01 . 1 . 228 . . 40 VAL CA . 17513 1
180 . 1 1 40 40 VAL N N 15 120.634 0.065 . 1 . 135 . . 40 VAL N . 17513 1
181 . 1 1 41 41 LEU H H 1 8.376 0.013 . 1 . 226 . . 41 LEU H . 17513 1
182 . 1 1 41 41 LEU HA H 1 4.312 . . 1 . 404 . . 41 LEU HA . 17513 1
183 . 1 1 41 41 LEU C C 13 177.008 0.03 . 1 . 236 . . 41 LEU C . 17513 1
184 . 1 1 41 41 LEU CA C 13 55.036 0.007 . 1 . 308 . . 41 LEU CA . 17513 1
185 . 1 1 41 41 LEU CB C 13 42.296 . . 1 . 347 . . 41 LEU CB . 17513 1
186 . 1 1 41 41 LEU N N 15 125.931 0.034 . 1 . 227 . . 41 LEU N . 17513 1
187 . 1 1 42 42 ASP H H 1 8.391 0.0 . 1 . 333 . . 42 ASP H . 17513 1
188 . 1 1 42 42 ASP C C 13 176.393 0.002 . 1 . 352 . . 42 ASP C . 17513 1
189 . 1 1 42 42 ASP CA C 13 54.266 0.015 . 1 . 349 . . 42 ASP CA . 17513 1
190 . 1 1 42 42 ASP CB C 13 40.951 . . 1 . 348 . . 42 ASP CB . 17513 1
191 . 1 1 42 42 ASP N N 15 122.219 0.012 . 1 . 334 . . 42 ASP N . 17513 1
192 . 1 1 43 43 VAL H H 1 8.087 0.012 . 1 . 280 . . 43 VAL H . 17513 1
193 . 1 1 43 43 VAL HA H 1 4.042 . . 1 . 456 . . 43 VAL HA . 17513 1
194 . 1 1 43 43 VAL C C 13 176.069 0.002 . 1 . 353 . . 43 VAL C . 17513 1
195 . 1 1 43 43 VAL CA C 13 62.441 0.004 . 1 . 350 . . 43 VAL CA . 17513 1
196 . 1 1 43 43 VAL CB C 13 32.342 . . 1 . 358 . . 43 VAL CB . 17513 1
197 . 1 1 43 43 VAL N N 15 120.896 0.079 . 1 . 281 . . 43 VAL N . 17513 1
198 . 1 1 44 44 ALA H H 1 8.404 0.013 . 1 . 354 . . 44 ALA H . 17513 1
199 . 1 1 44 44 ALA HA H 1 4.275 . . 1 . 403 . . 44 ALA HA . 17513 1
200 . 1 1 44 44 ALA C C 13 177.980 0.001 . 1 . 356 . . 44 ALA C . 17513 1
201 . 1 1 44 44 ALA CA C 13 52.648 0.007 . 1 . 357 . . 44 ALA CA . 17513 1
202 . 1 1 44 44 ALA CB C 13 18.837 . . 1 . 362 . . 44 ALA CB . 17513 1
203 . 1 1 44 44 ALA N N 15 126.862 0.076 . 1 . 355 . . 44 ALA N . 17513 1
204 . 1 1 45 45 LEU H H 1 8.145 0.01 . 1 . 359 . . 45 LEU H . 17513 1
205 . 1 1 45 45 LEU HA H 1 4.585 . . 1 . 450 . . 45 LEU HA . 17513 1
206 . 1 1 45 45 LEU C C 13 177.601 0.009 . 1 . 363 . . 45 LEU C . 17513 1
207 . 1 1 45 45 LEU CA C 13 55.244 0.059 . 1 . 361 . . 45 LEU CA . 17513 1
208 . 1 1 45 45 LEU CB C 13 42.056 . . 1 . 365 . . 45 LEU CB . 17513 1
209 . 1 1 45 45 LEU N N 15 121.119 0.058 . 1 . 360 . . 45 LEU N . 17513 1
210 . 1 1 46 46 GLU H H 1 8.306 0.017 . 1 . 315 . . 46 GLU H . 17513 1
211 . 1 1 46 46 GLU HA H 1 4.133 . . 1 . 454 . . 46 GLU HA . 17513 1
212 . 1 1 46 46 GLU C C 13 176.191 0.004 . 1 . 364 . . 46 GLU C . 17513 1
213 . 1 1 46 46 GLU CA C 13 56.775 0.004 . 1 . 366 . . 46 GLU CA . 17513 1
214 . 1 1 46 46 GLU CB C 13 30.033 . . 1 . 367 . . 46 GLU CB . 17513 1
215 . 1 1 46 46 GLU N N 15 120.863 0.055 . 1 . 316 . . 46 GLU N . 17513 1
216 . 1 1 47 47 HIS H H 1 8.307 0.013 . 1 . 218 . . 47 HIS H . 17513 1
217 . 1 1 47 47 HIS HA H 1 4.113 . . 1 . 464 . . 47 HIS HA . 17513 1
218 . 1 1 47 47 HIS C C 13 174.491 0.03 . 1 . 368 . . 47 HIS C . 17513 1
219 . 1 1 47 47 HIS N N 15 119.540 0.103 . 1 . 219 . . 47 HIS N . 17513 1
220 . 1 1 48 48 PHE H H 1 8.214 0.009 . 1 . 103 . . 48 PHE H . 17513 1
221 . 1 1 48 48 PHE C C 13 175.343 0.003 . 1 . 270 . . 48 PHE C . 17513 1
222 . 1 1 48 48 PHE CA C 13 57.883 0.018 . 1 . 54 . . 48 PHE CA . 17513 1
223 . 1 1 48 48 PHE CB C 13 39.600 . . 1 . 55 . . 48 PHE CB . 17513 1
224 . 1 1 48 48 PHE N N 15 121.808 0.026 . 1 . 104 . . 48 PHE N . 17513 1
225 . 1 1 49 49 VAL H H 1 8.109 0.011 . 1 . 52 . . 49 VAL H . 17513 1
226 . 1 1 49 49 VAL HA H 1 3.967 . . 1 . 424 . . 49 VAL HA . 17513 1
227 . 1 1 49 49 VAL C C 13 175.297 0.009 . 1 . 238 . . 49 VAL C . 17513 1
228 . 1 1 49 49 VAL CA C 13 62.132 . . 1 . 6 . . 49 VAL CA . 17513 1
229 . 1 1 49 49 VAL CB C 13 32.816 . . 1 . 229 . . 49 VAL CB . 17513 1
230 . 1 1 49 49 VAL N N 15 123.363 0.086 . 1 . 53 . . 49 VAL N . 17513 1
231 . 1 1 50 50 LYS H H 1 8.384 0.017 . 1 . 4 . . 50 LYS H . 17513 1
232 . 1 1 50 50 LYS HA H 1 4.312 . . 1 . 405 . . 50 LYS HA . 17513 1
233 . 1 1 50 50 LYS C C 13 176.389 0.03 . 1 . 332 . . 50 LYS C . 17513 1
234 . 1 1 50 50 LYS CA C 13 56.308 0.04 . 1 . 43 . . 50 LYS CA . 17513 1
235 . 1 1 50 50 LYS CB C 13 33.015 0.028 . 1 . 216 . . 50 LYS CB . 17513 1
236 . 1 1 50 50 LYS N N 15 125.913 0.018 . 1 . 5 . . 50 LYS N . 17513 1
237 . 1 1 51 51 ILE H H 1 8.415 0.013 . 1 . 41 . . 51 ILE H . 17513 1
238 . 1 1 51 51 ILE HA H 1 4.204 . . 1 . 417 . . 51 ILE HA . 17513 1
239 . 1 1 51 51 ILE C C 13 176.387 0.002 . 1 . 249 . . 51 ILE C . 17513 1
240 . 1 1 51 51 ILE CA C 13 61.066 0.008 . 1 . 159 . . 51 ILE CA . 17513 1
241 . 1 1 51 51 ILE CB C 13 38.523 . . 1 . 160 . . 51 ILE CB . 17513 1
242 . 1 1 51 51 ILE N N 15 123.825 0.077 . 1 . 42 . . 51 ILE N . 17513 1
243 . 1 1 52 52 THR H H 1 8.301 0.012 . 1 . 157 . . 52 THR H . 17513 1
244 . 1 1 52 52 THR HA H 1 4.289 . . 1 . 468 . . 52 THR HA . 17513 1
245 . 1 1 52 52 THR C C 13 174.052 0.001 . 1 . 303 . . 52 THR C . 17513 1
246 . 1 1 52 52 THR CA C 13 61.744 0.012 . 1 . 322 . . 52 THR CA . 17513 1
247 . 1 1 52 52 THR CB C 13 69.676 . . 1 . 346 . . 52 THR CB . 17513 1
248 . 1 1 52 52 THR N N 15 119.105 0.056 . 1 . 158 . . 52 THR N . 17513 1
249 . 1 1 53 53 GLU H H 1 8.422 0.011 . 1 . 250 . . 53 GLU H . 17513 1
250 . 1 1 53 53 GLU HA H 1 4.191 . . 1 . 421 . . 53 GLU HA . 17513 1
251 . 1 1 53 53 GLU C C 13 175.675 0.011 . 1 . 252 . . 53 GLU C . 17513 1
252 . 1 1 53 53 GLU CA C 13 56.167 0.04 . 1 . 340 . . 53 GLU CA . 17513 1
253 . 1 1 53 53 GLU CB C 13 30.386 . . 1 . 342 . . 53 GLU CB . 17513 1
254 . 1 1 53 53 GLU N N 15 123.643 0.053 . 1 . 251 . . 53 GLU N . 17513 1
255 . 1 1 54 54 HIS H H 1 8.598 0.033 . 1 . 338 . . 54 HIS H . 17513 1
256 . 1 1 54 54 HIS HA H 1 4.913 . . 1 . 452 . . 54 HIS HA . 17513 1
257 . 1 1 54 54 HIS C C 13 173.977 0.704 . 1 . 343 . . 54 HIS C . 17513 1
258 . 1 1 54 54 HIS CA C 13 53.823 . . 1 . 341 . . 54 HIS CA . 17513 1
259 . 1 1 54 54 HIS N N 15 120.899 0.047 . 1 . 339 . . 54 HIS N . 17513 1
260 . 1 1 55 55 PRO C C 13 176.860 0.03 . 1 . 330 . . 55 PRO C . 17513 1
261 . 1 1 55 55 PRO CA C 13 63.495 0.04 . 1 . 318 . . 55 PRO CA . 17513 1
262 . 1 1 55 55 PRO CB C 13 31.994 . . 1 . 133 . . 55 PRO CB . 17513 1
263 . 1 1 56 56 ASP H H 1 8.806 0.021 . 1 . 131 . . 56 ASP H . 17513 1
264 . 1 1 56 56 ASP HA H 1 4.629 . . 1 . 451 . . 56 ASP HA . 17513 1
265 . 1 1 56 56 ASP C C 13 176.933 0.014 . 1 . 282 . . 56 ASP C . 17513 1
266 . 1 1 56 56 ASP CA C 13 54.352 0.024 . 1 . 201 . . 56 ASP CA . 17513 1
267 . 1 1 56 56 ASP CB C 13 41.108 . . 1 . 202 . . 56 ASP CB . 17513 1
268 . 1 1 56 56 ASP N N 15 120.785 0.047 . 1 . 132 . . 56 ASP N . 17513 1
269 . 1 1 57 57 GLY H H 1 8.457 0.028 . 1 . 199 . . 57 GLY H . 17513 1
270 . 1 1 57 57 GLY HA2 H 1 4.022 . . 1 . 476 . . 57 GLY HA2 . 17513 1
271 . 1 1 57 57 GLY C C 13 174.681 0.009 . 1 . 292 . . 57 GLY C . 17513 1
272 . 1 1 57 57 GLY CA C 13 45.554 0.019 . 1 . 192 . . 57 GLY CA . 17513 1
273 . 1 1 57 57 GLY N N 15 109.506 0.046 . 1 . 200 . . 57 GLY N . 17513 1
274 . 1 1 58 58 THR H H 1 8.167 0.01 . 1 . 190 . . 58 THR H . 17513 1
275 . 1 1 58 58 THR HA H 1 4.312 . . 1 . 473 . . 58 THR HA . 17513 1
276 . 1 1 58 58 THR C C 13 174.320 0.006 . 1 . 293 . . 58 THR C . 17513 1
277 . 1 1 58 58 THR CA C 13 62.138 0.02 . 1 . 77 . . 58 THR CA . 17513 1
278 . 1 1 58 58 THR CB C 13 69.859 . . 1 . 76 . . 58 THR CB . 17513 1
279 . 1 1 58 58 THR N N 15 113.425 0.052 . 1 . 191 . . 58 THR N . 17513 1
280 . 1 1 59 59 ASP H H 1 8.499 0.013 . 1 . 74 . . 59 ASP H . 17513 1
281 . 1 1 59 59 ASP HA H 1 4.596 . . 1 . 432 . . 59 ASP HA . 17513 1
282 . 1 1 59 59 ASP C C 13 175.862 0.003 . 1 . 262 . . 59 ASP C . 17513 1
283 . 1 1 59 59 ASP CA C 13 54.390 0.024 . 1 . 89 . . 59 ASP CA . 17513 1
284 . 1 1 59 59 ASP CB C 13 40.963 . . 1 . 90 . . 59 ASP CB . 17513 1
285 . 1 1 59 59 ASP N N 15 122.467 0.068 . 1 . 75 . . 59 ASP N . 17513 1
286 . 1 1 60 60 LEU H H 1 8.166 0.001 . 1 . 87 . . 60 LEU H . 17513 1
287 . 1 1 60 60 LEU HA H 1 4.258 . . 1 . 438 . . 60 LEU HA . 17513 1
288 . 1 1 60 60 LEU C C 13 176.725 0.0 . 1 . 266 . . 60 LEU C . 17513 1
289 . 1 1 60 60 LEU CA C 13 55.067 0.006 . 1 . 101 . . 60 LEU CA . 17513 1
290 . 1 1 60 60 LEU N N 15 122.216 0.048 . 1 . 88 . . 60 LEU N . 17513 1
291 . 1 1 61 61 ILE H H 1 8.236 0.002 . 1 . 99 . . 61 ILE H . 17513 1
292 . 1 1 61 61 ILE HA H 1 4.009 . . 1 . 439 . . 61 ILE HA . 17513 1
293 . 1 1 61 61 ILE C C 13 175.131 0.0 . 1 . 269 . . 61 ILE C . 17513 1
294 . 1 1 61 61 ILE CA C 13 60.734 0.027 . 1 . 19 . . 61 ILE CA . 17513 1
295 . 1 1 61 61 ILE CB C 13 38.792 . . 1 . 23 . . 61 ILE CB . 17513 1
296 . 1 1 61 61 ILE N N 15 122.002 0.04 . 1 . 100 . . 61 ILE N . 17513 1
297 . 1 1 62 62 TYR H H 1 8.201 0.01 . 1 . 17 . . 62 TYR H . 17513 1
298 . 1 1 62 62 TYR HA H 1 4.513 . . 1 . 411 . . 62 TYR HA . 17513 1
299 . 1 1 62 62 TYR C C 13 174.410 0.001 . 1 . 241 . . 62 TYR C . 17513 1
300 . 1 1 62 62 TYR CA C 13 57.303 0.009 . 1 . 230 . . 62 TYR CA . 17513 1
301 . 1 1 62 62 TYR CB C 13 39.130 . . 1 . 22 . . 62 TYR CB . 17513 1
302 . 1 1 62 62 TYR N N 15 124.775 0.106 . 1 . 18 . . 62 TYR N . 17513 1
303 . 1 1 63 63 TYR H H 1 8.225 0.02 . 1 . 20 . . 63 TYR H . 17513 1
304 . 1 1 63 63 TYR HA H 1 4.711 . . 1 . 412 . . 63 TYR HA . 17513 1
305 . 1 1 63 63 TYR C C 13 173.390 0.03 . 1 . 242 . . 63 TYR C . 17513 1
306 . 1 1 63 63 TYR CA C 13 55.330 0.04 . 1 . 328 . . 63 TYR CA . 17513 1
307 . 1 1 63 63 TYR N N 15 124.689 0.066 . 1 . 21 . . 63 TYR N . 17513 1
308 . 1 1 64 64 PRO C C 13 176.902 0.03 . 1 . 331 . . 64 PRO C . 17513 1
309 . 1 1 64 64 PRO CA C 13 63.033 0.023 . 1 . 188 . . 64 PRO CA . 17513 1
310 . 1 1 64 64 PRO CB C 13 32.016 . . 1 . 189 . . 64 PRO CB . 17513 1
311 . 1 1 65 65 SER H H 1 8.458 0.013 . 1 . 186 . . 65 SER H . 17513 1
312 . 1 1 65 65 SER HA H 1 4.416 . . 1 . 472 . . 65 SER HA . 17513 1
313 . 1 1 65 65 SER C C 13 174.384 0.006 . 1 . 264 . . 65 SER C . 17513 1
314 . 1 1 65 65 SER CA C 13 58.282 0.074 . 1 . 95 . . 65 SER CA . 17513 1
315 . 1 1 65 65 SER CB C 13 63.748 . . 1 . 80 . . 65 SER CB . 17513 1
316 . 1 1 65 65 SER N N 15 115.887 0.042 . 1 . 187 . . 65 SER N . 17513 1
317 . 1 1 66 66 ASP H H 1 8.444 0.013 . 1 . 78 . . 66 ASP H . 17513 1
318 . 1 1 66 66 ASP C C 13 175.857 0.011 . 1 . 263 . . 66 ASP C . 17513 1
319 . 1 1 66 66 ASP CA C 13 54.281 0.034 . 1 . 313 . . 66 ASP CA . 17513 1
320 . 1 1 66 66 ASP CB C 13 41.175 . . 1 . 167 . . 66 ASP CB . 17513 1
321 . 1 1 66 66 ASP N N 15 122.287 0.09 . 1 . 79 . . 66 ASP N . 17513 1
322 . 1 1 67 67 ASN H H 1 8.423 0.012 . 1 . 301 . . 67 ASN H . 17513 1
323 . 1 1 67 67 ASN HA H 1 4.682 . . 1 . 467 . . 67 ASN HA . 17513 1
324 . 1 1 67 67 ASN C C 13 175.285 0.008 . 1 . 302 . . 67 ASN C . 17513 1
325 . 1 1 67 67 ASN CA C 13 53.219 0.047 . 1 . 112 . . 67 ASN CA . 17513 1
326 . 1 1 67 67 ASN CB C 13 38.681 . . 1 . 113 . . 67 ASN CB . 17513 1
327 . 1 1 67 67 ASN N N 15 119.109 0.041 . 1 . 165 . . 67 ASN N . 17513 1
328 . 1 1 68 68 ARG H H 1 8.399 0.013 . 1 . 110 . . 68 ARG H . 17513 1
329 . 1 1 68 68 ARG HA H 1 4.274 . . 1 . 442 . . 68 ARG HA . 17513 1
330 . 1 1 68 68 ARG C C 13 176.195 0.003 . 1 . 275 . . 68 ARG C . 17513 1
331 . 1 1 68 68 ARG CA C 13 56.400 . . 1 . 390 . . 68 ARG CA . 17513 1
332 . 1 1 68 68 ARG N N 15 121.668 0.089 . 1 . 111 . . 68 ARG N . 17513 1
333 . 1 1 69 69 ASP H H 1 8.467 0.013 . 1 . 117 . . 69 ASP H . 17513 1
334 . 1 1 69 69 ASP HA H 1 4.593 . . 1 . 447 . . 69 ASP HA . 17513 1
335 . 1 1 69 69 ASP C C 13 175.826 0.001 . 1 . 274 . . 69 ASP C . 17513 1
336 . 1 1 69 69 ASP CA C 13 54.365 0.012 . 1 . 129 . . 69 ASP CA . 17513 1
337 . 1 1 69 69 ASP CB C 13 40.973 . . 1 . 130 . . 69 ASP CB . 17513 1
338 . 1 1 69 69 ASP N N 15 121.308 0.049 . 1 . 118 . . 69 ASP N . 17513 1
339 . 1 1 70 70 ASP H H 1 8.282 0.012 . 1 . 127 . . 70 ASP H . 17513 1
340 . 1 1 70 70 ASP HA H 1 4.632 . . 1 . 455 . . 70 ASP HA . 17513 1
341 . 1 1 70 70 ASP C C 13 176.045 0.01 . 1 . 279 . . 70 ASP C . 17513 1
342 . 1 1 70 70 ASP CA C 13 53.972 0.045 . 1 . 317 . . 70 ASP CA . 17513 1
343 . 1 1 70 70 ASP CB C 13 41.523 0.659 . 1 . 102 . . 70 ASP CB . 17513 1
344 . 1 1 70 70 ASP N N 15 120.892 0.076 . 1 . 128 . . 70 ASP N . 17513 1
345 . 1 1 71 71 SER H H 1 8.289 0.012 . 1 . 172 . . 71 SER H . 17513 1
346 . 1 1 71 71 SER HA H 1 4.700 . . 1 . 470 . . 71 SER HA . 17513 1
347 . 1 1 71 71 SER C C 13 173.008 0.03 . 1 . 298 . . 71 SER C . 17513 1
348 . 1 1 71 71 SER CA C 13 56.622 0.04 . 1 . 325 . . 71 SER CA . 17513 1
349 . 1 1 71 71 SER N N 15 117.139 0.039 . 1 . 173 . . 71 SER N . 17513 1
350 . 1 1 72 72 PRO CA C 13 63.597 0.069 . 1 . 150 . . 72 PRO CA . 17513 1
351 . 1 1 72 72 PRO CB C 13 31.864 . . 1 . 151 . . 72 PRO CB . 17513 1
352 . 1 1 73 73 GLU H H 1 8.589 0.012 . 1 . 148 . . 73 GLU H . 17513 1
353 . 1 1 73 73 GLU HA H 1 4.200 . . 1 . 462 . . 73 GLU HA . 17513 1
354 . 1 1 73 73 GLU C C 13 177.250 0.005 . 1 . 288 . . 73 GLU C . 17513 1
355 . 1 1 73 73 GLU CA C 13 57.077 0.007 . 1 . 197 . . 73 GLU CA . 17513 1
356 . 1 1 73 73 GLU CB C 13 29.888 . . 1 . 198 . . 73 GLU CB . 17513 1
357 . 1 1 73 73 GLU N N 15 119.919 0.068 . 1 . 149 . . 73 GLU N . 17513 1
358 . 1 1 74 74 GLY H H 1 8.372 0.014 . 1 . 195 . . 74 GLY H . 17513 1
359 . 1 1 74 74 GLY C C 13 174.192 0.003 . 1 . 295 . . 74 GLY C . 17513 1
360 . 1 1 74 74 GLY CA C 13 45.399 0.008 . 1 . 142 . . 74 GLY CA . 17513 1
361 . 1 1 74 74 GLY N N 15 109.922 0.028 . 1 . 196 . . 74 GLY N . 17513 1
362 . 1 1 75 75 ILE H H 1 7.983 0.012 . 1 . 140 . . 75 ILE H . 17513 1
363 . 1 1 75 75 ILE HA H 1 4.126 . . 1 . 457 . . 75 ILE HA . 17513 1
364 . 1 1 75 75 ILE C C 13 176.445 0.014 . 1 . 286 . . 75 ILE C . 17513 1
365 . 1 1 75 75 ILE CA C 13 61.239 0.004 . 1 . 16 . . 75 ILE CA . 17513 1
366 . 1 1 75 75 ILE CB C 13 38.572 . . 1 . 225 . . 75 ILE CB . 17513 1
367 . 1 1 75 75 ILE N N 15 120.692 0.057 . 1 . 141 . . 75 ILE N . 17513 1
368 . 1 1 76 76 VAL H H 1 8.254 0.011 . 1 . 14 . . 76 VAL H . 17513 1
369 . 1 1 76 76 VAL HA H 1 4.000 . . 1 . 410 . . 76 VAL HA . 17513 1
370 . 1 1 76 76 VAL C C 13 176.334 0.021 . 1 . 240 . . 76 VAL C . 17513 1
371 . 1 1 76 76 VAL CA C 13 62.919 0.011 . 1 . 224 . . 76 VAL CA . 17513 1
372 . 1 1 76 76 VAL CB C 13 32.434 . . 1 . 389 . . 76 VAL CB . 17513 1
373 . 1 1 76 76 VAL N N 15 124.961 0.097 . 1 . 15 . . 76 VAL N . 17513 1
374 . 1 1 77 77 LYS H H 1 8.405 0.013 . 1 . 222 . . 77 LYS H . 17513 1
375 . 1 1 77 77 LYS HA H 1 4.252 . . 1 . 407 . . 77 LYS HA . 17513 1
376 . 1 1 77 77 LYS C C 13 176.651 0.03 . 1 . 487 . . 77 LYS C . 17513 1
377 . 1 1 77 77 LYS CA C 13 56.691 0.04 . 1 . 309 . . 77 LYS CA . 17513 1
378 . 1 1 77 77 LYS N N 15 125.555 0.068 . 1 . 223 . . 77 LYS N . 17513 1
379 . 1 1 78 78 GLU H H 1 8.345 0.019 . 1 . 485 . . 78 GLU H . 17513 1
380 . 1 1 78 78 GLU N N 15 123.269 0.028 . 1 . 486 . . 78 GLU N . 17513 1
381 . 1 1 79 79 ILE C C 13 175.998 0.03 . 1 . 399 . . 79 ILE C . 17513 1
382 . 1 1 80 80 LYS H H 1 8.347 0.015 . 1 . 397 . . 80 LYS H . 17513 1
383 . 1 1 80 80 LYS HA H 1 4.054 . . 1 . 425 . . 80 LYS HA . 17513 1
384 . 1 1 80 80 LYS C C 13 176.542 0.03 . 1 . 396 . . 80 LYS C . 17513 1
385 . 1 1 80 80 LYS N N 15 123.263 0.04 . 1 . 398 . . 80 LYS N . 17513 1
386 . 1 1 81 81 GLU H H 1 8.469 0.014 . 1 . 392 . . 81 GLU H . 17513 1
387 . 1 1 81 81 GLU HA H 1 4.208 . . 1 . 408 . . 81 GLU HA . 17513 1
388 . 1 1 81 81 GLU C C 13 176.494 0.03 . 1 . 391 . . 81 GLU C . 17513 1
389 . 1 1 81 81 GLU CA C 13 56.819 0.067 . 1 . 61 . . 81 GLU CA . 17513 1
390 . 1 1 81 81 GLU CB C 13 30.057 . . 1 . 62 . . 81 GLU CB . 17513 1
391 . 1 1 81 81 GLU N N 15 125.327 0.066 . 1 . 393 . . 81 GLU N . 17513 1
392 . 1 1 82 82 TRP H H 1 8.347 0.015 . 1 . 59 . . 82 TRP H . 17513 1
393 . 1 1 82 82 TRP HA H 1 4.512 . . 1 . 426 . . 82 TRP HA . 17513 1
394 . 1 1 82 82 TRP C C 13 176.582 0.019 . 1 . 256 . . 82 TRP C . 17513 1
395 . 1 1 82 82 TRP CA C 13 58.418 0.044 . 1 . 213 . . 82 TRP CA . 17513 1
396 . 1 1 82 82 TRP N N 15 123.256 0.057 . 1 . 60 . . 82 TRP N . 17513 1
397 . 1 1 83 83 ARG H H 1 8.110 0.015 . 1 . 211 . . 83 ARG H . 17513 1
398 . 1 1 83 83 ARG C C 13 175.956 0.03 . 1 . 329 . . 83 ARG C . 17513 1
399 . 1 1 83 83 ARG CA C 13 56.265 0.019 . 1 . 32 . . 83 ARG CA . 17513 1
400 . 1 1 83 83 ARG CB C 13 31.041 . . 1 . 33 . . 83 ARG CB . 17513 1
401 . 1 1 83 83 ARG N N 15 122.885 0.024 . 1 . 212 . . 83 ARG N . 17513 1
402 . 1 1 84 84 ALA H H 1 8.098 0.014 . 1 . 30 . . 84 ALA H . 17513 1
403 . 1 1 84 84 ALA HA H 1 4.053 . . 1 . 414 . . 84 ALA HA . 17513 1
404 . 1 1 84 84 ALA C C 13 178.078 0.0 . 1 . 248 . . 84 ALA C . 17513 1
405 . 1 1 84 84 ALA CA C 13 52.816 0.016 . 1 . 311 . . 84 ALA CA . 17513 1
406 . 1 1 84 84 ALA CB C 13 18.802 . . 1 . 83 . . 84 ALA CB . 17513 1
407 . 1 1 84 84 ALA N N 15 124.197 0.051 . 1 . 31 . . 84 ALA N . 17513 1
408 . 1 1 85 85 ALA H H 1 8.213 0.034 . 1 . 81 . . 85 ALA H . 17513 1
409 . 1 1 85 85 ALA HA H 1 4.196 . . 1 . 436 . . 85 ALA HA . 17513 1
410 . 1 1 85 85 ALA C C 13 177.499 0.258 . 1 . 243 . . 85 ALA C . 17513 1
411 . 1 1 85 85 ALA CA C 13 52.804 0.04 . 1 . 179 . . 85 ALA CA . 17513 1
412 . 1 1 85 85 ALA CB C 13 18.853 . . 1 . 181 . . 85 ALA CB . 17513 1
413 . 1 1 85 85 ALA N N 15 122.626 0.595 . 1 . 82 . . 85 ALA N . 17513 1
414 . 1 1 86 86 ASN H H 1 8.194 0.012 . 1 . 177 . . 86 ASN H . 17513 1
415 . 1 1 86 86 ASN C C 13 175.624 0.03 . 1 . 300 . . 86 ASN C . 17513 1
416 . 1 1 86 86 ASN CA C 13 53.193 0.028 . 1 . 209 . . 86 ASN CA . 17513 1
417 . 1 1 86 86 ASN CB C 13 38.610 . . 1 . 210 . . 86 ASN CB . 17513 1
418 . 1 1 86 86 ASN N N 15 116.739 0.02 . 1 . 178 . . 86 ASN N . 17513 1
419 . 1 1 87 87 GLY H H 1 8.218 0.014 . 1 . 207 . . 87 GLY H . 17513 1
420 . 1 1 87 87 GLY HA2 H 1 3.881 . . 1 . 477 . . 87 GLY HA2 . 17513 1
421 . 1 1 87 87 GLY C C 13 173.674 0.011 . 1 . 272 . . 87 GLY C . 17513 1
422 . 1 1 87 87 GLY CA C 13 45.181 0.027 . 1 . 107 . . 87 GLY CA . 17513 1
423 . 1 1 87 87 GLY N N 15 108.621 0.038 . 1 . 208 . . 87 GLY N . 17513 1
424 . 1 1 88 88 LYS H H 1 8.116 0.013 . 1 . 105 . . 88 LYS H . 17513 1
425 . 1 1 88 88 LYS HA H 1 4.578 . . 1 . 446 . . 88 LYS HA . 17513 1
426 . 1 1 88 88 LYS C C 13 174.459 0.03 . 1 . 271 . . 88 LYS C . 17513 1
427 . 1 1 88 88 LYS CA C 13 54.051 0.04 . 1 . 314 . . 88 LYS CA . 17513 1
428 . 1 1 88 88 LYS N N 15 121.826 0.056 . 1 . 106 . . 88 LYS N . 17513 1
429 . 1 1 89 89 PRO C C 13 177.494 0.03 . 1 . 296 . . 89 PRO C . 17513 1
430 . 1 1 89 89 PRO CA C 13 63.372 0.04 . 1 . 205 . . 89 PRO CA . 17513 1
431 . 1 1 89 89 PRO CB C 13 31.951 . . 1 . 206 . . 89 PRO CB . 17513 1
432 . 1 1 90 90 GLY H H 1 8.570 0.012 . 1 . 203 . . 90 GLY H . 17513 1
433 . 1 1 90 90 GLY HA2 H 1 3.860 . . 1 . 475 . . 90 GLY HA2 . 17513 1
434 . 1 1 90 90 GLY C C 13 173.740 0.003 . 1 . 297 . . 90 GLY C . 17513 1
435 . 1 1 90 90 GLY CA C 13 44.984 0.013 . 1 . 139 . . 90 GLY CA . 17513 1
436 . 1 1 90 90 GLY N N 15 109.640 0.044 . 1 . 204 . . 90 GLY N . 17513 1
437 . 1 1 91 91 PHE H H 1 8.118 0.012 . 1 . 137 . . 91 PHE H . 17513 1
438 . 1 1 91 91 PHE HA H 1 4.561 . . 1 . 460 . . 91 PHE HA . 17513 1
439 . 1 1 91 91 PHE C C 13 175.428 0.001 . 1 . 245 . . 91 PHE C . 17513 1
440 . 1 1 91 91 PHE CA C 13 57.761 0.04 . 1 . 320 . . 91 PHE CA . 17513 1
441 . 1 1 91 91 PHE CB C 13 39.774 . . 1 . 26 . . 91 PHE CB . 17513 1
442 . 1 1 91 91 PHE N N 15 120.318 0.054 . 1 . 138 . . 91 PHE N . 17513 1
443 . 1 1 92 92 LYS H H 1 8.312 0.011 . 1 . 24 . . 92 LYS H . 17513 1
444 . 1 1 92 92 LYS HA H 1 4.211 . . 1 . 413 . . 92 LYS HA . 17513 1
445 . 1 1 92 92 LYS C C 13 175.721 0.009 . 1 . 244 . . 92 LYS C . 17513 1
446 . 1 1 92 92 LYS CA C 13 56.031 0.018 . 1 . 50 . . 92 LYS CA . 17513 1
447 . 1 1 92 92 LYS CB C 13 33.106 . . 1 . 51 . . 92 LYS CB . 17513 1
448 . 1 1 92 92 LYS N N 15 124.373 0.036 . 1 . 25 . . 92 LYS N . 17513 1
449 . 1 1 93 93 GLN H H 1 8.467 0.012 . 1 . 48 . . 93 GLN H . 17513 1
450 . 1 1 93 93 GLN HA H 1 4.255 . . 1 . 429 . . 93 GLN HA . 17513 1
451 . 1 1 93 93 GLN C C 13 175.315 0.004 . 1 . 254 . . 93 GLN C . 17513 1
452 . 1 1 93 93 GLN CA C 13 55.762 0.069 . 1 . 170 . . 93 GLN CA . 17513 1
453 . 1 1 93 93 GLN CB C 13 29.641 . . 1 . 171 . . 93 GLN CB . 17513 1
454 . 1 1 93 93 GLN N N 15 123.044 0.053 . 1 . 49 . . 93 GLN N . 17513 1
455 . 1 1 94 94 GLY H H 1 8.180 0.013 . 1 . 168 . . 94 GLY H . 17513 1
456 . 1 1 94 94 GLY HA2 H 1 3.745 . . 1 . 469 . . 94 GLY HA2 . 17513 1
457 . 1 1 94 94 GLY C C 13 178.974 0.03 . 1 . 290 . . 94 GLY C . 17513 1
458 . 1 1 94 94 GLY CA C 13 46.051 0.04 . 1 . 324 . . 94 GLY CA . 17513 1
459 . 1 1 94 94 GLY N N 15 117.333 0.054 . 1 . 169 . . 94 GLY N . 17513 1
stop_
save_