data_25293
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25293
_Entry.PDB_ID 2MW0
save_
save_delta_chem_shifts
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts
_Entity_delta_chem_shifts.Model_type single
_Entity_delta_chem_shifts.Entry_ID 25293
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 TRP N N 2 124.464 124.464 126.797 -2.333 25293
2 1 1 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.670 -0.649 25293
3 1 1 . 1 1 2 2 TRP CA C 2 59.121 59.121 57.958 1.163 25293
4 1 1 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.893 -0.204 25293
5 1 1 . 1 1 2 2 TRP H H 2 8.268 8.268 7.527 0.741 25293
6 1 1 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.280 0.171 25293
7 1 1 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.306 1.909 25293
8 1 1 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.061 -0.311 25293
9 1 1 . 1 1 4 4 ILE N N 4 126.955 126.955 119.258 7.697 25293
10 1 1 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.740 0.446 25293
11 1 1 . 1 1 4 4 ILE CA C 4 60.005 60.005 61.343 -1.338 25293
12 1 1 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.246 0.163 25293
13 1 1 . 1 1 4 4 ILE H H 4 8.276 8.276 7.409 0.867 25293
14 1 1 . 1 1 5 5 CYS N N 5 124.228 124.228 123.987 0.241 25293
15 1 1 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.599 0.226 25293
16 1 1 . 1 1 5 5 CYS CB C 5 43.781 43.781 29.550 14.231 25293
17 1 1 . 1 1 5 5 CYS H H 5 7.650 7.650 8.102 -0.452 25293
18 1 1 . 1 1 6 6 LYS N N 6 122.395 122.395 122.348 0.047 25293
19 1 1 . 1 1 6 6 LYS HA H 6 4.938 4.938 4.912 0.026 25293
20 1 1 . 1 1 6 6 LYS H H 6 9.212 9.212 8.062 1.150 25293
21 1 1 . 1 1 7 7 ARG N N 7 122.102 122.102 125.686 -3.584 25293
22 1 1 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.224 0.487 25293
23 1 1 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.512 2.209 25293
24 1 1 . 1 1 7 7 ARG H H 7 8.700 8.700 8.743 -0.043 25293
25 1 1 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.741 -0.426 25293
26 1 1 . 1 1 8 8 ASN CA C 8 54.388 54.388 53.032 1.356 25293
27 1 1 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.724 -1.159 25293
28 1 1 . 1 1 8 8 ASN H H 8 7.794 7.794 8.477 -0.683 25293
29 1 1 . 1 1 9 9 GLY N N 9 101.289 101.289 106.157 -4.868 25293
30 1 1 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.182 0.082 25293
31 1 1 . 1 1 9 9 GLY H H 9 8.652 8.652 8.469 0.183 25293
32 1 1 . 1 1 10 10 LEU N N 10 120.783 120.783 118.551 2.232 25293
33 1 1 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.726 0.329 25293
34 1 1 . 1 1 10 10 LEU CA C 10 51.535 51.535 51.060 0.475 25293
35 1 1 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.165 -1.105 25293
36 1 1 . 1 1 10 10 LEU H H 10 7.791 7.791 7.681 0.110 25293
37 1 1 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.443 0.614 25293
38 1 1 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.788 -2.451 25293
39 1 1 . 1 1 12 12 VAL N N 12 115.299 115.299 117.716 -2.417 25293
40 1 1 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.230 0.371 25293
41 1 1 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.561 -1.460 25293
42 1 1 . 1 1 12 12 VAL H H 12 7.971 7.971 8.203 -0.232 25293
43 1 1 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.461 -0.130 25293
44 1 1 . 1 1 13 13 CYS CA C 13 59.105 59.105 59.476 -0.371 25293
45 1 1 . 1 1 13 13 CYS CB C 13 48.573 48.573 27.139 21.434 25293
46 1 1 . 1 1 13 13 CYS H H 13 8.103 8.103 8.012 0.091 25293
47 1 1 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.840 0.629 25293
48 1 1 . 1 1 14 14 GLY H H 14 8.433 8.433 8.578 -0.145 25293
49 1 1 . 1 1 15 15 GLU N N 15 115.613 115.613 117.066 -1.453 25293
50 1 1 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.627 0.040 25293
51 1 1 . 1 1 15 15 GLU CB C 15 32.554 32.554 32.853 -0.299 25293
52 1 1 . 1 1 15 15 GLU H H 15 7.064 7.064 7.961 -0.897 25293
53 1 1 . 1 1 16 16 THR N N 16 115.298 115.298 113.068 2.230 25293
54 1 1 . 1 1 16 16 THR HA H 16 4.525 4.525 4.719 -0.194 25293
55 1 1 . 1 1 16 16 THR CB C 16 70.742 70.742 69.344 1.399 25293
56 1 1 . 1 1 16 16 THR H H 16 8.413 8.413 8.026 0.387 25293
57 1 1 . 1 1 17 17 CYS N N 17 115.927 115.927 124.011 -8.084 25293
58 1 1 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.762 0.299 25293
59 1 1 . 1 1 17 17 CYS CA C 17 62.598 62.598 57.321 5.277 25293
60 1 1 . 1 1 17 17 CYS CB C 17 47.454 47.454 29.221 18.233 25293
61 1 1 . 1 1 17 17 CYS H H 17 8.239 8.239 8.471 -0.232 25293
62 1 1 . 1 1 18 18 THR N N 18 117.192 117.192 116.102 1.090 25293
63 1 1 . 1 1 18 18 THR HA H 18 3.912 3.912 4.789 -0.877 25293
64 1 1 . 1 1 18 18 THR CA C 18 65.404 65.404 62.917 2.487 25293
65 1 1 . 1 1 18 18 THR H H 18 8.277 8.277 8.814 -0.537 25293
66 1 1 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.918 -0.427 25293
67 1 1 . 1 1 19 19 LEU CB C 19 40.963 40.963 42.055 -1.092 25293
68 1 1 . 1 1 19 19 LEU H H 19 8.474 8.474 7.706 0.768 25293
69 1 1 . 1 1 20 20 GLY N N 20 105.833 105.833 107.873 -2.040 25293
70 1 1 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.698 0.261 25293
71 1 1 . 1 1 20 20 GLY H H 20 8.123 8.123 8.405 -0.282 25293
72 1 1 . 1 1 21 21 THR N N 21 111.926 111.926 111.658 0.268 25293
73 1 1 . 1 1 21 21 THR HA H 21 4.653 4.653 4.378 0.275 25293
74 1 1 . 1 1 21 21 THR CB C 21 68.777 68.777 70.321 -1.544 25293
75 1 1 . 1 1 21 21 THR H H 21 7.658 7.658 7.538 0.120 25293
76 1 1 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.531 0.110 25293
77 1 1 . 1 1 22 22 CYS CB C 22 44.757 44.757 27.476 17.281 25293
78 1 1 . 1 1 22 22 CYS H H 22 8.470 8.470 8.851 -0.381 25293
79 1 1 . 1 1 23 23 SER N N 23 122.918 122.918 118.793 4.125 25293
80 1 1 . 1 1 23 23 SER HA H 23 4.423 4.423 4.298 0.125 25293
81 1 1 . 1 1 23 23 SER CA C 23 59.914 59.914 60.221 -0.307 25293
82 1 1 . 1 1 23 23 SER CB C 23 64.597 64.597 63.425 1.172 25293
83 1 1 . 1 1 23 23 SER H H 23 10.973 10.973 8.807 2.166 25293
84 1 1 . 1 1 24 24 THR N N 24 124.108 124.108 115.229 8.879 25293
85 1 1 . 1 1 24 24 THR HA H 24 3.979 3.979 4.416 -0.437 25293
86 1 1 . 1 1 24 24 THR CA C 24 63.960 63.960 61.552 2.408 25293
87 1 1 . 1 1 24 24 THR CB C 24 68.471 68.471 69.777 -1.306 25293
88 1 1 . 1 1 24 24 THR H H 24 9.476 9.476 7.750 1.726 25293
89 1 1 . 1 1 25 25 GLN N N 25 128.543 128.543 121.500 7.043 25293
90 1 1 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.434 -0.509 25293
91 1 1 . 1 1 25 25 GLN CA C 25 57.951 57.951 55.887 2.064 25293
92 1 1 . 1 1 25 25 GLN CB C 25 28.195 28.195 28.626 -0.431 25293
93 1 1 . 1 1 25 25 GLN H H 25 8.714 8.714 8.590 0.124 25293
94 1 1 . 1 1 26 26 GLY CA C 26 45.249 45.249 45.178 0.071 25293
95 1 1 . 1 1 26 26 GLY H H 26 8.810 8.810 8.685 0.125 25293
96 1 1 . 1 1 27 27 CYS N N 27 117.687 117.687 119.834 -2.147 25293
97 1 1 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.606 0.467 25293
98 1 1 . 1 1 27 27 CYS CB C 27 49.941 49.941 28.649 21.292 25293
99 1 1 . 1 1 27 27 CYS H H 27 7.697 7.697 8.011 -0.314 25293
100 1 1 . 1 1 28 28 THR N N 28 115.298 115.298 117.942 -2.644 25293
101 1 1 . 1 1 28 28 THR HA H 28 4.488 4.488 4.641 -0.153 25293
102 1 1 . 1 1 28 28 THR CA C 28 60.019 60.019 61.185 -1.166 25293
103 1 1 . 1 1 28 28 THR CB C 28 71.515 71.515 70.330 1.185 25293
104 1 1 . 1 1 28 28 THR H H 28 9.354 9.354 8.598 0.756 25293
105 1 2 . 1 1 2 2 TRP N N 2 124.464 124.464 126.670 -2.206 25293
106 1 2 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.685 -0.664 25293
107 1 2 . 1 1 2 2 TRP CA C 2 59.121 59.121 58.332 0.789 25293
108 1 2 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.741 -0.052 25293
109 1 2 . 1 1 2 2 TRP H H 2 8.268 8.268 7.532 0.736 25293
110 1 2 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.285 0.166 25293
111 1 2 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.294 1.921 25293
112 1 2 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.108 -0.358 25293
113 1 2 . 1 1 4 4 ILE N N 4 126.955 126.955 119.069 7.886 25293
114 1 2 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.715 0.471 25293
115 1 2 . 1 1 4 4 ILE CA C 4 60.005 60.005 60.889 -0.884 25293
116 1 2 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.544 -0.135 25293
117 1 2 . 1 1 4 4 ILE H H 4 8.276 8.276 7.530 0.746 25293
118 1 2 . 1 1 5 5 CYS N N 5 124.228 124.228 122.858 1.370 25293
119 1 2 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.769 0.056 25293
120 1 2 . 1 1 5 5 CYS CB C 5 43.781 43.781 30.426 13.355 25293
121 1 2 . 1 1 5 5 CYS H H 5 7.650 7.650 8.259 -0.609 25293
122 1 2 . 1 1 6 6 LYS N N 6 122.395 122.395 121.459 0.936 25293
123 1 2 . 1 1 6 6 LYS HA H 6 4.938 4.938 4.955 -0.017 25293
124 1 2 . 1 1 6 6 LYS H H 6 9.212 9.212 8.864 0.348 25293
125 1 2 . 1 1 7 7 ARG N N 7 122.102 122.102 125.821 -3.719 25293
126 1 2 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.320 0.391 25293
127 1 2 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.857 1.864 25293
128 1 2 . 1 1 7 7 ARG H H 7 8.700 8.700 8.573 0.127 25293
129 1 2 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.811 -0.496 25293
130 1 2 . 1 1 8 8 ASN CA C 8 54.388 54.388 53.000 1.388 25293
131 1 2 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.542 -0.977 25293
132 1 2 . 1 1 8 8 ASN H H 8 7.794 7.794 8.460 -0.666 25293
133 1 2 . 1 1 9 9 GLY N N 9 101.289 101.289 106.906 -5.617 25293
134 1 2 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.358 -0.093 25293
135 1 2 . 1 1 9 9 GLY H H 9 8.652 8.652 8.527 0.125 25293
136 1 2 . 1 1 10 10 LEU N N 10 120.783 120.783 118.375 2.408 25293
137 1 2 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.720 0.335 25293
138 1 2 . 1 1 10 10 LEU CA C 10 51.535 51.535 51.121 0.414 25293
139 1 2 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.292 -1.232 25293
140 1 2 . 1 1 10 10 LEU H H 10 7.791 7.791 7.675 0.116 25293
141 1 2 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.455 0.602 25293
142 1 2 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.864 -2.527 25293
143 1 2 . 1 1 12 12 VAL N N 12 115.299 115.299 117.267 -1.968 25293
144 1 2 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.393 0.208 25293
145 1 2 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.529 -1.428 25293
146 1 2 . 1 1 12 12 VAL H H 12 7.971 7.971 7.973 -0.002 25293
147 1 2 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.672 -0.341 25293
148 1 2 . 1 1 13 13 CYS CA C 13 59.105 59.105 58.634 0.471 25293
149 1 2 . 1 1 13 13 CYS CB C 13 48.573 48.573 29.110 19.463 25293
150 1 2 . 1 1 13 13 CYS H H 13 8.103 8.103 8.032 0.071 25293
151 1 2 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.862 0.607 25293
152 1 2 . 1 1 14 14 GLY H H 14 8.433 8.433 8.745 -0.312 25293
153 1 2 . 1 1 15 15 GLU N N 15 115.613 115.613 117.721 -2.108 25293
154 1 2 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.520 0.147 25293
155 1 2 . 1 1 15 15 GLU CB C 15 32.554 32.554 29.607 2.947 25293
156 1 2 . 1 1 15 15 GLU H H 15 7.064 7.064 8.043 -0.979 25293
157 1 2 . 1 1 16 16 THR N N 16 115.298 115.298 113.812 1.486 25293
158 1 2 . 1 1 16 16 THR HA H 16 4.525 4.525 4.214 0.311 25293
159 1 2 . 1 1 16 16 THR CB C 16 70.742 70.742 68.680 2.062 25293
160 1 2 . 1 1 16 16 THR H H 16 8.413 8.413 8.076 0.337 25293
161 1 2 . 1 1 17 17 CYS N N 17 115.927 115.927 123.895 -7.968 25293
162 1 2 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.666 0.395 25293
163 1 2 . 1 1 17 17 CYS CA C 17 62.598 62.598 57.316 5.282 25293
164 1 2 . 1 1 17 17 CYS CB C 17 47.454 47.454 28.951 18.503 25293
165 1 2 . 1 1 17 17 CYS H H 17 8.239 8.239 8.324 -0.085 25293
166 1 2 . 1 1 18 18 THR N N 18 117.192 117.192 115.390 1.802 25293
167 1 2 . 1 1 18 18 THR HA H 18 3.912 3.912 4.772 -0.860 25293
168 1 2 . 1 1 18 18 THR CA C 18 65.404 65.404 62.938 2.466 25293
169 1 2 . 1 1 18 18 THR H H 18 8.277 8.277 8.936 -0.659 25293
170 1 2 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.853 -0.362 25293
171 1 2 . 1 1 19 19 LEU CB C 19 40.963 40.963 42.006 -1.043 25293
172 1 2 . 1 1 19 19 LEU H H 19 8.474 8.474 7.871 0.603 25293
173 1 2 . 1 1 20 20 GLY N N 20 105.833 105.833 107.996 -2.163 25293
174 1 2 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.577 0.383 25293
175 1 2 . 1 1 20 20 GLY H H 20 8.123 8.123 8.388 -0.265 25293
176 1 2 . 1 1 21 21 THR N N 21 111.926 111.926 112.020 -0.094 25293
177 1 2 . 1 1 21 21 THR HA H 21 4.653 4.653 4.363 0.290 25293
178 1 2 . 1 1 21 21 THR CB C 21 68.777 68.777 70.033 -1.256 25293
179 1 2 . 1 1 21 21 THR H H 21 7.658 7.658 7.570 0.088 25293
180 1 2 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.501 0.140 25293
181 1 2 . 1 1 22 22 CYS CB C 22 44.757 44.757 27.813 16.944 25293
182 1 2 . 1 1 22 22 CYS H H 22 8.470 8.470 8.725 -0.255 25293
183 1 2 . 1 1 23 23 SER N N 23 122.918 122.918 117.607 5.311 25293
184 1 2 . 1 1 23 23 SER HA H 23 4.423 4.423 4.475 -0.052 25293
185 1 2 . 1 1 23 23 SER CA C 23 59.914 59.914 60.642 -0.728 25293
186 1 2 . 1 1 23 23 SER CB C 23 64.597 64.597 63.833 0.764 25293
187 1 2 . 1 1 23 23 SER H H 23 10.973 10.973 8.606 2.367 25293
188 1 2 . 1 1 24 24 THR N N 24 124.108 124.108 116.046 8.062 25293
189 1 2 . 1 1 24 24 THR HA H 24 3.979 3.979 4.218 -0.239 25293
190 1 2 . 1 1 24 24 THR CA C 24 63.960 63.960 62.871 1.089 25293
191 1 2 . 1 1 24 24 THR CB C 24 68.471 68.471 69.527 -1.056 25293
192 1 2 . 1 1 24 24 THR H H 24 9.476 9.476 8.284 1.192 25293
193 1 2 . 1 1 25 25 GLN N N 25 128.543 128.543 123.346 5.197 25293
194 1 2 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.331 -0.406 25293
195 1 2 . 1 1 25 25 GLN CA C 25 57.951 57.951 55.624 2.327 25293
196 1 2 . 1 1 25 25 GLN CB C 25 28.195 28.195 27.766 0.429 25293
197 1 2 . 1 1 25 25 GLN H H 25 8.714 8.714 8.619 0.095 25293
198 1 2 . 1 1 26 26 GLY CA C 26 45.249 45.249 45.021 0.228 25293
199 1 2 . 1 1 26 26 GLY H H 26 8.810 8.810 8.020 0.790 25293
200 1 2 . 1 1 27 27 CYS N N 27 117.687 117.687 120.005 -2.318 25293
201 1 2 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.451 0.622 25293
202 1 2 . 1 1 27 27 CYS CB C 27 49.941 49.941 26.943 22.998 25293
203 1 2 . 1 1 27 27 CYS H H 27 7.697 7.697 8.233 -0.536 25293
204 1 2 . 1 1 28 28 THR N N 28 115.298 115.298 117.049 -1.751 25293
205 1 2 . 1 1 28 28 THR HA H 28 4.488 4.488 4.691 -0.203 25293
206 1 2 . 1 1 28 28 THR CA C 28 60.019 60.019 61.144 -1.125 25293
207 1 2 . 1 1 28 28 THR CB C 28 71.515 71.515 70.931 0.584 25293
208 1 2 . 1 1 28 28 THR H H 28 9.354 9.354 8.833 0.521 25293
209 1 3 . 1 1 2 2 TRP N N 2 124.464 124.464 126.832 -2.368 25293
210 1 3 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.672 -0.651 25293
211 1 3 . 1 1 2 2 TRP CA C 2 59.121 59.121 58.245 0.875 25293
212 1 3 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.884 -0.195 25293
213 1 3 . 1 1 2 2 TRP H H 2 8.268 8.268 7.576 0.692 25293
214 1 3 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.279 0.172 25293
215 1 3 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.301 1.914 25293
216 1 3 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.061 -0.311 25293
217 1 3 . 1 1 4 4 ILE N N 4 126.955 126.955 119.233 7.722 25293
218 1 3 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.740 0.446 25293
219 1 3 . 1 1 4 4 ILE CA C 4 60.005 60.005 61.348 -1.343 25293
220 1 3 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.247 0.162 25293
221 1 3 . 1 1 4 4 ILE H H 4 8.276 8.276 7.412 0.864 25293
222 1 3 . 1 1 5 5 CYS N N 5 124.228 124.228 123.629 0.599 25293
223 1 3 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.606 0.219 25293
224 1 3 . 1 1 5 5 CYS CB C 5 43.781 43.781 29.635 14.146 25293
225 1 3 . 1 1 5 5 CYS H H 5 7.650 7.650 8.120 -0.470 25293
226 1 3 . 1 1 6 6 LYS N N 6 122.395 122.395 122.352 0.043 25293
227 1 3 . 1 1 6 6 LYS HA H 6 4.938 4.938 4.934 0.004 25293
228 1 3 . 1 1 6 6 LYS H H 6 9.212 9.212 8.052 1.160 25293
229 1 3 . 1 1 7 7 ARG N N 7 122.102 122.102 125.000 -2.898 25293
230 1 3 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.123 0.588 25293
231 1 3 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.624 2.097 25293
232 1 3 . 1 1 7 7 ARG H H 7 8.700 8.700 8.809 -0.109 25293
233 1 3 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.795 -0.480 25293
234 1 3 . 1 1 8 8 ASN CA C 8 54.388 54.388 53.227 1.161 25293
235 1 3 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.581 -1.016 25293
236 1 3 . 1 1 8 8 ASN H H 8 7.794 7.794 8.571 -0.777 25293
237 1 3 . 1 1 9 9 GLY N N 9 101.289 101.289 106.343 -5.054 25293
238 1 3 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.182 0.082 25293
239 1 3 . 1 1 9 9 GLY H H 9 8.652 8.652 8.489 0.163 25293
240 1 3 . 1 1 10 10 LEU N N 10 120.783 120.783 118.622 2.161 25293
241 1 3 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.722 0.333 25293
242 1 3 . 1 1 10 10 LEU CA C 10 51.535 51.535 51.064 0.471 25293
243 1 3 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.216 -1.156 25293
244 1 3 . 1 1 10 10 LEU H H 10 7.791 7.791 7.713 0.078 25293
245 1 3 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.445 0.612 25293
246 1 3 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.792 -2.455 25293
247 1 3 . 1 1 12 12 VAL N N 12 115.299 115.299 117.716 -2.417 25293
248 1 3 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.230 0.371 25293
249 1 3 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.569 -1.468 25293
250 1 3 . 1 1 12 12 VAL H H 12 7.971 7.971 8.207 -0.236 25293
251 1 3 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.469 -0.138 25293
252 1 3 . 1 1 13 13 CYS CA C 13 59.105 59.105 59.456 -0.351 25293
253 1 3 . 1 1 13 13 CYS CB C 13 48.573 48.573 27.252 21.322 25293
254 1 3 . 1 1 13 13 CYS H H 13 8.103 8.103 8.013 0.090 25293
255 1 3 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.781 0.688 25293
256 1 3 . 1 1 14 14 GLY H H 14 8.433 8.433 8.577 -0.144 25293
257 1 3 . 1 1 15 15 GLU N N 15 115.613 115.613 117.371 -1.758 25293
258 1 3 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.650 0.017 25293
259 1 3 . 1 1 15 15 GLU CB C 15 32.554 32.554 33.050 -0.496 25293
260 1 3 . 1 1 15 15 GLU H H 15 7.064 7.064 7.942 -0.878 25293
261 1 3 . 1 1 16 16 THR N N 16 115.298 115.298 112.425 2.873 25293
262 1 3 . 1 1 16 16 THR HA H 16 4.525 4.525 4.810 -0.285 25293
263 1 3 . 1 1 16 16 THR CB C 16 70.742 70.742 69.628 1.114 25293
264 1 3 . 1 1 16 16 THR H H 16 8.413 8.413 7.965 0.448 25293
265 1 3 . 1 1 17 17 CYS N N 17 115.927 115.927 124.371 -8.444 25293
266 1 3 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.801 0.260 25293
267 1 3 . 1 1 17 17 CYS CA C 17 62.598 62.598 57.131 5.467 25293
268 1 3 . 1 1 17 17 CYS CB C 17 47.454 47.454 28.840 18.614 25293
269 1 3 . 1 1 17 17 CYS H H 17 8.239 8.239 8.474 -0.235 25293
270 1 3 . 1 1 18 18 THR N N 18 117.192 117.192 115.522 1.670 25293
271 1 3 . 1 1 18 18 THR HA H 18 3.912 3.912 4.798 -0.886 25293
272 1 3 . 1 1 18 18 THR CA C 18 65.404 65.404 63.249 2.155 25293
273 1 3 . 1 1 18 18 THR H H 18 8.277 8.277 8.756 -0.479 25293
274 1 3 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.935 -0.444 25293
275 1 3 . 1 1 19 19 LEU CB C 19 40.963 40.963 41.916 -0.953 25293
276 1 3 . 1 1 19 19 LEU H H 19 8.474 8.474 7.799 0.675 25293
277 1 3 . 1 1 20 20 GLY N N 20 105.833 105.833 108.188 -2.355 25293
278 1 3 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.612 0.347 25293
279 1 3 . 1 1 20 20 GLY H H 20 8.123 8.123 8.432 -0.309 25293
280 1 3 . 1 1 21 21 THR N N 21 111.926 111.926 111.443 0.483 25293
281 1 3 . 1 1 21 21 THR HA H 21 4.653 4.653 4.365 0.288 25293
282 1 3 . 1 1 21 21 THR CB C 21 68.777 68.777 70.023 -1.246 25293
283 1 3 . 1 1 21 21 THR H H 21 7.658 7.658 7.593 0.065 25293
284 1 3 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.524 0.117 25293
285 1 3 . 1 1 22 22 CYS CB C 22 44.757 44.757 27.657 17.101 25293
286 1 3 . 1 1 22 22 CYS H H 22 8.470 8.470 8.874 -0.404 25293
287 1 3 . 1 1 23 23 SER N N 23 122.918 122.918 118.533 4.385 25293
288 1 3 . 1 1 23 23 SER HA H 23 4.423 4.423 4.342 0.081 25293
289 1 3 . 1 1 23 23 SER CA C 23 59.914 59.914 60.302 -0.388 25293
290 1 3 . 1 1 23 23 SER CB C 23 64.597 64.597 63.521 1.076 25293
291 1 3 . 1 1 23 23 SER H H 23 10.973 10.973 8.838 2.135 25293
292 1 3 . 1 1 24 24 THR N N 24 124.108 124.108 114.731 9.377 25293
293 1 3 . 1 1 24 24 THR HA H 24 3.979 3.979 4.405 -0.426 25293
294 1 3 . 1 1 24 24 THR CA C 24 63.960 63.960 61.976 1.984 25293
295 1 3 . 1 1 24 24 THR CB C 24 68.471 68.471 69.659 -1.188 25293
296 1 3 . 1 1 24 24 THR H H 24 9.476 9.476 7.668 1.808 25293
297 1 3 . 1 1 25 25 GLN N N 25 128.543 128.543 121.692 6.851 25293
298 1 3 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.613 -0.688 25293
299 1 3 . 1 1 25 25 GLN CA C 25 57.951 57.951 55.811 2.140 25293
300 1 3 . 1 1 25 25 GLN CB C 25 28.195 28.195 28.768 -0.573 25293
301 1 3 . 1 1 25 25 GLN H H 25 8.714 8.714 8.703 0.011 25293
302 1 3 . 1 1 26 26 GLY CA C 26 45.249 45.249 45.159 0.090 25293
303 1 3 . 1 1 26 26 GLY H H 26 8.810 8.810 8.419 0.391 25293
304 1 3 . 1 1 27 27 CYS N N 27 117.687 117.687 117.790 -0.103 25293
305 1 3 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.721 0.352 25293
306 1 3 . 1 1 27 27 CYS CB C 27 49.941 49.941 30.941 19.000 25293
307 1 3 . 1 1 27 27 CYS H H 27 7.697 7.697 7.856 -0.159 25293
308 1 3 . 1 1 28 28 THR N N 28 115.298 115.298 117.754 -2.456 25293
309 1 3 . 1 1 28 28 THR HA H 28 4.488 4.488 4.677 -0.189 25293
310 1 3 . 1 1 28 28 THR CA C 28 60.019 60.019 61.182 -1.163 25293
311 1 3 . 1 1 28 28 THR CB C 28 71.515 71.515 70.424 1.091 25293
312 1 3 . 1 1 28 28 THR H H 28 9.354 9.354 8.626 0.728 25293
313 1 4 . 1 1 2 2 TRP N N 2 124.464 124.464 126.946 -2.482 25293
314 1 4 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.678 -0.657 25293
315 1 4 . 1 1 2 2 TRP CA C 2 59.121 59.121 57.898 1.223 25293
316 1 4 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.873 -0.184 25293
317 1 4 . 1 1 2 2 TRP H H 2 8.268 8.268 7.542 0.726 25293
318 1 4 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.279 0.172 25293
319 1 4 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.310 1.905 25293
320 1 4 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.050 -0.300 25293
321 1 4 . 1 1 4 4 ILE N N 4 126.955 126.955 119.259 7.696 25293
322 1 4 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.744 0.442 25293
323 1 4 . 1 1 4 4 ILE CA C 4 60.005 60.005 61.344 -1.339 25293
324 1 4 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.248 0.161 25293
325 1 4 . 1 1 4 4 ILE H H 4 8.276 8.276 7.415 0.861 25293
326 1 4 . 1 1 5 5 CYS N N 5 124.228 124.228 123.873 0.355 25293
327 1 4 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.551 0.274 25293
328 1 4 . 1 1 5 5 CYS CB C 5 43.781 43.781 29.825 13.956 25293
329 1 4 . 1 1 5 5 CYS H H 5 7.650 7.650 8.308 -0.658 25293
330 1 4 . 1 1 6 6 LYS N N 6 122.395 122.395 122.456 -0.061 25293
331 1 4 . 1 1 6 6 LYS HA H 6 4.938 4.938 4.928 0.010 25293
332 1 4 . 1 1 6 6 LYS H H 6 9.212 9.212 8.183 1.029 25293
333 1 4 . 1 1 7 7 ARG N N 7 122.102 122.102 125.709 -3.607 25293
334 1 4 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.201 0.510 25293
335 1 4 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.628 2.093 25293
336 1 4 . 1 1 7 7 ARG H H 7 8.700 8.700 8.751 -0.051 25293
337 1 4 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.793 -0.478 25293
338 1 4 . 1 1 8 8 ASN CA C 8 54.388 54.388 52.927 1.461 25293
339 1 4 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.636 -1.071 25293
340 1 4 . 1 1 8 8 ASN H H 8 7.794 7.794 8.415 -0.621 25293
341 1 4 . 1 1 9 9 GLY N N 9 101.289 101.289 107.067 -5.778 25293
342 1 4 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.593 -0.329 25293
343 1 4 . 1 1 9 9 GLY H H 9 8.652 8.652 8.550 0.102 25293
344 1 4 . 1 1 10 10 LEU N N 10 120.783 120.783 118.089 2.694 25293
345 1 4 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.695 0.360 25293
346 1 4 . 1 1 10 10 LEU CA C 10 51.535 51.535 51.171 0.364 25293
347 1 4 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.411 -1.351 25293
348 1 4 . 1 1 10 10 LEU H H 10 7.791 7.791 7.664 0.127 25293
349 1 4 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.460 0.597 25293
350 1 4 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.517 -2.180 25293
351 1 4 . 1 1 12 12 VAL N N 12 115.299 115.299 116.125 -0.826 25293
352 1 4 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.221 0.380 25293
353 1 4 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.824 -1.723 25293
354 1 4 . 1 1 12 12 VAL H H 12 7.971 7.971 8.046 -0.075 25293
355 1 4 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.458 -0.127 25293
356 1 4 . 1 1 13 13 CYS CA C 13 59.105 59.105 59.285 -0.180 25293
357 1 4 . 1 1 13 13 CYS CB C 13 48.573 48.573 27.343 21.230 25293
358 1 4 . 1 1 13 13 CYS H H 13 8.103 8.103 8.064 0.039 25293
359 1 4 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.504 0.965 25293
360 1 4 . 1 1 14 14 GLY H H 14 8.433 8.433 8.660 -0.227 25293
361 1 4 . 1 1 15 15 GLU N N 15 115.613 115.613 117.229 -1.616 25293
362 1 4 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.659 0.008 25293
363 1 4 . 1 1 15 15 GLU CB C 15 32.554 32.554 31.892 0.662 25293
364 1 4 . 1 1 15 15 GLU H H 15 7.064 7.064 8.030 -0.966 25293
365 1 4 . 1 1 16 16 THR N N 16 115.298 115.298 111.798 3.500 25293
366 1 4 . 1 1 16 16 THR HA H 16 4.525 4.525 4.868 -0.343 25293
367 1 4 . 1 1 16 16 THR CB C 16 70.742 70.742 69.597 1.145 25293
368 1 4 . 1 1 16 16 THR H H 16 8.413 8.413 8.237 0.176 25293
369 1 4 . 1 1 17 17 CYS N N 17 115.927 115.927 124.386 -8.459 25293
370 1 4 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.794 0.267 25293
371 1 4 . 1 1 17 17 CYS CA C 17 62.598 62.598 57.286 5.312 25293
372 1 4 . 1 1 17 17 CYS CB C 17 47.454 47.454 29.063 18.391 25293
373 1 4 . 1 1 17 17 CYS H H 17 8.239 8.239 8.508 -0.269 25293
374 1 4 . 1 1 18 18 THR N N 18 117.192 117.192 115.392 1.800 25293
375 1 4 . 1 1 18 18 THR HA H 18 3.912 3.912 4.777 -0.865 25293
376 1 4 . 1 1 18 18 THR CA C 18 65.404 65.404 63.525 1.879 25293
377 1 4 . 1 1 18 18 THR H H 18 8.277 8.277 8.844 -0.567 25293
378 1 4 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.907 -0.416 25293
379 1 4 . 1 1 19 19 LEU CB C 19 40.963 40.963 41.834 -0.871 25293
380 1 4 . 1 1 19 19 LEU H H 19 8.474 8.474 7.680 0.794 25293
381 1 4 . 1 1 20 20 GLY N N 20 105.833 105.833 108.366 -2.533 25293
382 1 4 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.779 0.180 25293
383 1 4 . 1 1 20 20 GLY H H 20 8.123 8.123 8.394 -0.271 25293
384 1 4 . 1 1 21 21 THR N N 21 111.926 111.926 112.424 -0.498 25293
385 1 4 . 1 1 21 21 THR HA H 21 4.653 4.653 4.406 0.247 25293
386 1 4 . 1 1 21 21 THR CB C 21 68.777 68.777 69.900 -1.123 25293
387 1 4 . 1 1 21 21 THR H H 21 7.658 7.658 7.601 0.057 25293
388 1 4 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.462 0.179 25293
389 1 4 . 1 1 22 22 CYS CB C 22 44.757 44.757 28.163 16.594 25293
390 1 4 . 1 1 22 22 CYS H H 22 8.470 8.470 8.441 0.029 25293
391 1 4 . 1 1 23 23 SER N N 23 122.918 122.918 114.787 8.131 25293
392 1 4 . 1 1 23 23 SER HA H 23 4.423 4.423 4.705 -0.282 25293
393 1 4 . 1 1 23 23 SER CA C 23 59.914 59.914 58.795 1.119 25293
394 1 4 . 1 1 23 23 SER CB C 23 64.597 64.597 63.400 1.197 25293
395 1 4 . 1 1 23 23 SER H H 23 10.973 10.973 8.768 2.205 25293
396 1 4 . 1 1 24 24 THR N N 24 124.108 124.108 115.753 8.355 25293
397 1 4 . 1 1 24 24 THR HA H 24 3.979 3.979 4.406 -0.427 25293
398 1 4 . 1 1 24 24 THR CA C 24 63.960 63.960 61.727 2.233 25293
399 1 4 . 1 1 24 24 THR CB C 24 68.471 68.471 69.156 -0.685 25293
400 1 4 . 1 1 24 24 THR H H 24 9.476 9.476 7.900 1.576 25293
401 1 4 . 1 1 25 25 GLN N N 25 128.543 128.543 119.744 8.799 25293
402 1 4 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.087 -0.162 25293
403 1 4 . 1 1 25 25 GLN CA C 25 57.951 57.951 56.867 1.084 25293
404 1 4 . 1 1 25 25 GLN CB C 25 28.195 28.195 27.370 0.825 25293
405 1 4 . 1 1 25 25 GLN H H 25 8.714 8.714 8.294 0.420 25293
406 1 4 . 1 1 26 26 GLY CA C 26 45.249 45.249 44.915 0.334 25293
407 1 4 . 1 1 26 26 GLY H H 26 8.810 8.810 8.536 0.274 25293
408 1 4 . 1 1 27 27 CYS N N 27 117.687 117.687 120.355 -2.668 25293
409 1 4 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.536 0.537 25293
410 1 4 . 1 1 27 27 CYS CB C 27 49.941 49.941 28.695 21.247 25293
411 1 4 . 1 1 27 27 CYS H H 27 7.697 7.697 8.218 -0.521 25293
412 1 4 . 1 1 28 28 THR N N 28 115.298 115.298 116.851 -1.553 25293
413 1 4 . 1 1 28 28 THR HA H 28 4.488 4.488 4.577 -0.089 25293
414 1 4 . 1 1 28 28 THR CA C 28 60.019 60.019 61.460 -1.441 25293
415 1 4 . 1 1 28 28 THR CB C 28 71.515 71.515 70.098 1.417 25293
416 1 4 . 1 1 28 28 THR H H 28 9.354 9.354 8.380 0.974 25293
417 1 5 . 1 1 2 2 TRP N N 2 124.464 124.464 126.871 -2.407 25293
418 1 5 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.684 -0.663 25293
419 1 5 . 1 1 2 2 TRP CA C 2 59.121 59.121 57.925 1.196 25293
420 1 5 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.848 -0.159 25293
421 1 5 . 1 1 2 2 TRP H H 2 8.268 8.268 7.519 0.749 25293
422 1 5 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.279 0.172 25293
423 1 5 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.305 1.910 25293
424 1 5 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.056 -0.306 25293
425 1 5 . 1 1 4 4 ILE N N 4 126.955 126.955 119.267 7.688 25293
426 1 5 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.741 0.445 25293
427 1 5 . 1 1 4 4 ILE CA C 4 60.005 60.005 61.307 -1.302 25293
428 1 5 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.238 0.171 25293
429 1 5 . 1 1 4 4 ILE H H 4 8.276 8.276 7.403 0.873 25293
430 1 5 . 1 1 5 5 CYS N N 5 124.228 124.228 124.002 0.226 25293
431 1 5 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.603 0.222 25293
432 1 5 . 1 1 5 5 CYS CB C 5 43.781 43.781 29.454 14.327 25293
433 1 5 . 1 1 5 5 CYS H H 5 7.650 7.650 8.100 -0.450 25293
434 1 5 . 1 1 6 6 LYS N N 6 122.395 122.395 122.474 -0.079 25293
435 1 5 . 1 1 6 6 LYS HA H 6 4.938 4.938 4.926 0.012 25293
436 1 5 . 1 1 6 6 LYS H H 6 9.212 9.212 8.045 1.167 25293
437 1 5 . 1 1 7 7 ARG N N 7 122.102 122.102 124.728 -2.626 25293
438 1 5 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.222 0.489 25293
439 1 5 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.762 1.959 25293
440 1 5 . 1 1 7 7 ARG H H 7 8.700 8.700 8.725 -0.025 25293
441 1 5 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.806 -0.491 25293
442 1 5 . 1 1 8 8 ASN CA C 8 54.388 54.388 52.886 1.502 25293
443 1 5 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.566 -1.001 25293
444 1 5 . 1 1 8 8 ASN H H 8 7.794 7.794 8.405 -0.611 25293
445 1 5 . 1 1 9 9 GLY N N 9 101.289 101.289 105.776 -4.487 25293
446 1 5 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.557 -0.293 25293
447 1 5 . 1 1 9 9 GLY H H 9 8.652 8.652 8.502 0.150 25293
448 1 5 . 1 1 10 10 LEU N N 10 120.783 120.783 118.995 1.788 25293
449 1 5 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.722 0.333 25293
450 1 5 . 1 1 10 10 LEU CA C 10 51.535 51.535 50.755 0.779 25293
451 1 5 . 1 1 10 10 LEU CB C 10 44.060 44.060 44.871 -0.811 25293
452 1 5 . 1 1 10 10 LEU H H 10 7.791 7.791 7.664 0.127 25293
453 1 5 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.466 0.591 25293
454 1 5 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.532 -2.195 25293
455 1 5 . 1 1 12 12 VAL N N 12 115.299 115.299 116.344 -1.045 25293
456 1 5 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.216 0.385 25293
457 1 5 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.815 -1.714 25293
458 1 5 . 1 1 12 12 VAL H H 12 7.971 7.971 8.038 -0.067 25293
459 1 5 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.482 -0.151 25293
460 1 5 . 1 1 13 13 CYS CA C 13 59.105 59.105 59.150 -0.045 25293
461 1 5 . 1 1 13 13 CYS CB C 13 48.573 48.573 26.929 21.644 25293
462 1 5 . 1 1 13 13 CYS H H 13 8.103 8.103 8.058 0.045 25293
463 1 5 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.913 0.556 25293
464 1 5 . 1 1 14 14 GLY H H 14 8.433 8.433 8.645 -0.212 25293
465 1 5 . 1 1 15 15 GLU N N 15 115.613 115.613 116.655 -1.042 25293
466 1 5 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.655 0.012 25293
467 1 5 . 1 1 15 15 GLU CB C 15 32.554 32.554 32.808 -0.254 25293
468 1 5 . 1 1 15 15 GLU H H 15 7.064 7.064 7.891 -0.827 25293
469 1 5 . 1 1 16 16 THR N N 16 115.298 115.298 112.721 2.577 25293
470 1 5 . 1 1 16 16 THR HA H 16 4.525 4.525 4.805 -0.280 25293
471 1 5 . 1 1 16 16 THR CB C 16 70.742 70.742 69.791 0.951 25293
472 1 5 . 1 1 16 16 THR H H 16 8.413 8.413 8.013 0.400 25293
473 1 5 . 1 1 17 17 CYS N N 17 115.927 115.927 124.167 -8.240 25293
474 1 5 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.755 0.306 25293
475 1 5 . 1 1 17 17 CYS CA C 17 62.598 62.598 57.277 5.321 25293
476 1 5 . 1 1 17 17 CYS CB C 17 47.454 47.454 29.190 18.264 25293
477 1 5 . 1 1 17 17 CYS H H 17 8.239 8.239 8.541 -0.302 25293
478 1 5 . 1 1 18 18 THR N N 18 117.192 117.192 116.255 0.937 25293
479 1 5 . 1 1 18 18 THR HA H 18 3.912 3.912 4.793 -0.881 25293
480 1 5 . 1 1 18 18 THR CA C 18 65.404 65.404 63.119 2.285 25293
481 1 5 . 1 1 18 18 THR H H 18 8.277 8.277 8.827 -0.550 25293
482 1 5 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.872 -0.381 25293
483 1 5 . 1 1 19 19 LEU CB C 19 40.963 40.963 42.128 -1.165 25293
484 1 5 . 1 1 19 19 LEU H H 19 8.474 8.474 7.773 0.701 25293
485 1 5 . 1 1 20 20 GLY N N 20 105.833 105.833 107.928 -2.095 25293
486 1 5 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.695 0.264 25293
487 1 5 . 1 1 20 20 GLY H H 20 8.123 8.123 8.406 -0.283 25293
488 1 5 . 1 1 21 21 THR N N 21 111.926 111.926 111.409 0.517 25293
489 1 5 . 1 1 21 21 THR HA H 21 4.653 4.653 4.415 0.237 25293
490 1 5 . 1 1 21 21 THR CB C 21 68.777 68.777 70.274 -1.497 25293
491 1 5 . 1 1 21 21 THR H H 21 7.658 7.658 7.504 0.154 25293
492 1 5 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.579 0.062 25293
493 1 5 . 1 1 22 22 CYS CB C 22 44.757 44.757 27.542 17.215 25293
494 1 5 . 1 1 22 22 CYS H H 22 8.470 8.470 8.889 -0.419 25293
495 1 5 . 1 1 23 23 SER N N 23 122.918 122.918 118.918 4.000 25293
496 1 5 . 1 1 23 23 SER HA H 23 4.423 4.423 4.308 0.115 25293
497 1 5 . 1 1 23 23 SER CA C 23 59.914 59.914 60.489 -0.575 25293
498 1 5 . 1 1 23 23 SER CB C 23 64.597 64.597 63.560 1.037 25293
499 1 5 . 1 1 23 23 SER H H 23 10.973 10.973 8.876 2.097 25293
500 1 5 . 1 1 24 24 THR N N 24 124.108 124.108 116.045 8.063 25293
501 1 5 . 1 1 24 24 THR HA H 24 3.979 3.979 4.413 -0.434 25293
502 1 5 . 1 1 24 24 THR CA C 24 63.960 63.960 61.808 2.152 25293
503 1 5 . 1 1 24 24 THR CB C 24 68.471 68.471 69.858 -1.387 25293
504 1 5 . 1 1 24 24 THR H H 24 9.476 9.476 7.683 1.793 25293
505 1 5 . 1 1 25 25 GLN N N 25 128.543 128.543 121.189 7.354 25293
506 1 5 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.405 -0.480 25293
507 1 5 . 1 1 25 25 GLN CA C 25 57.951 57.951 55.331 2.620 25293
508 1 5 . 1 1 25 25 GLN CB C 25 28.195 28.195 28.788 -0.593 25293
509 1 5 . 1 1 25 25 GLN H H 25 8.714 8.714 8.499 0.215 25293
510 1 5 . 1 1 26 26 GLY CA C 26 45.249 45.249 44.812 0.437 25293
511 1 5 . 1 1 26 26 GLY H H 26 8.810 8.810 8.518 0.292 25293
512 1 5 . 1 1 27 27 CYS N N 27 117.687 117.687 120.943 -3.256 25293
513 1 5 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.461 0.612 25293
514 1 5 . 1 1 27 27 CYS CB C 27 49.941 49.941 27.970 21.971 25293
515 1 5 . 1 1 27 27 CYS H H 27 7.697 7.697 8.163 -0.466 25293
516 1 5 . 1 1 28 28 THR N N 28 115.298 115.298 118.173 -2.875 25293
517 1 5 . 1 1 28 28 THR HA H 28 4.488 4.488 4.615 -0.127 25293
518 1 5 . 1 1 28 28 THR CA C 28 60.019 60.019 61.384 -1.365 25293
519 1 5 . 1 1 28 28 THR CB C 28 71.515 71.515 69.894 1.621 25293
520 1 5 . 1 1 28 28 THR H H 28 9.354 9.354 8.614 0.740 25293
521 1 6 . 1 1 2 2 TRP N N 2 124.464 124.464 126.543 -2.079 25293
522 1 6 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.672 -0.651 25293
523 1 6 . 1 1 2 2 TRP CA C 2 59.121 59.121 58.148 0.973 25293
524 1 6 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.868 -0.179 25293
525 1 6 . 1 1 2 2 TRP H H 2 8.268 8.268 7.550 0.718 25293
526 1 6 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.265 0.186 25293
527 1 6 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.286 1.929 25293
528 1 6 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.029 -0.279 25293
529 1 6 . 1 1 4 4 ILE N N 4 126.955 126.955 119.104 7.851 25293
530 1 6 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.743 0.443 25293
531 1 6 . 1 1 4 4 ILE CA C 4 60.005 60.005 61.458 -1.452 25293
532 1 6 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.245 0.164 25293
533 1 6 . 1 1 4 4 ILE H H 4 8.276 8.276 7.435 0.841 25293
534 1 6 . 1 1 5 5 CYS N N 5 124.228 124.228 122.812 1.416 25293
535 1 6 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.736 0.089 25293
536 1 6 . 1 1 5 5 CYS CB C 5 43.781 43.781 30.505 13.276 25293
537 1 6 . 1 1 5 5 CYS H H 5 7.650 7.650 8.168 -0.518 25293
538 1 6 . 1 1 6 6 LYS N N 6 122.395 122.395 120.908 1.487 25293
539 1 6 . 1 1 6 6 LYS HA H 6 4.938 4.938 4.906 0.032 25293
540 1 6 . 1 1 6 6 LYS H H 6 9.212 9.212 8.791 0.421 25293
541 1 6 . 1 1 7 7 ARG N N 7 122.102 122.102 125.335 -3.233 25293
542 1 6 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.254 0.457 25293
543 1 6 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.513 2.208 25293
544 1 6 . 1 1 7 7 ARG H H 7 8.700 8.700 8.735 -0.035 25293
545 1 6 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.774 -0.459 25293
546 1 6 . 1 1 8 8 ASN CA C 8 54.388 54.388 52.963 1.425 25293
547 1 6 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.555 -0.990 25293
548 1 6 . 1 1 8 8 ASN H H 8 7.794 7.794 8.480 -0.686 25293
549 1 6 . 1 1 9 9 GLY N N 9 101.289 101.289 106.126 -4.837 25293
550 1 6 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.288 -0.024 25293
551 1 6 . 1 1 9 9 GLY H H 9 8.652 8.652 8.476 0.176 25293
552 1 6 . 1 1 10 10 LEU N N 10 120.783 120.783 118.706 2.077 25293
553 1 6 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.738 0.317 25293
554 1 6 . 1 1 10 10 LEU CA C 10 51.535 51.535 51.000 0.535 25293
555 1 6 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.175 -1.115 25293
556 1 6 . 1 1 10 10 LEU H H 10 7.791 7.791 7.682 0.109 25293
557 1 6 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.465 0.593 25293
558 1 6 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.758 -2.421 25293
559 1 6 . 1 1 12 12 VAL N N 12 115.299 115.299 118.087 -2.788 25293
560 1 6 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.235 0.366 25293
561 1 6 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.640 -1.539 25293
562 1 6 . 1 1 12 12 VAL H H 12 7.971 7.971 8.052 -0.081 25293
563 1 6 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.515 -0.184 25293
564 1 6 . 1 1 13 13 CYS CA C 13 59.105 59.105 59.173 -0.068 25293
565 1 6 . 1 1 13 13 CYS CB C 13 48.573 48.573 27.155 21.418 25293
566 1 6 . 1 1 13 13 CYS H H 13 8.103 8.103 7.990 0.113 25293
567 1 6 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.838 0.631 25293
568 1 6 . 1 1 14 14 GLY H H 14 8.433 8.433 8.595 -0.162 25293
569 1 6 . 1 1 15 15 GLU N N 15 115.613 115.613 117.463 -1.850 25293
570 1 6 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.644 0.023 25293
571 1 6 . 1 1 15 15 GLU CB C 15 32.554 32.554 33.051 -0.497 25293
572 1 6 . 1 1 15 15 GLU H H 15 7.064 7.064 7.962 -0.898 25293
573 1 6 . 1 1 16 16 THR N N 16 115.298 115.298 112.378 2.920 25293
574 1 6 . 1 1 16 16 THR HA H 16 4.525 4.525 4.820 -0.295 25293
575 1 6 . 1 1 16 16 THR CB C 16 70.742 70.742 69.638 1.104 25293
576 1 6 . 1 1 16 16 THR H H 16 8.413 8.413 7.986 0.427 25293
577 1 6 . 1 1 17 17 CYS N N 17 115.927 115.927 124.056 -8.129 25293
578 1 6 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.779 0.282 25293
579 1 6 . 1 1 17 17 CYS CA C 17 62.598 62.598 56.988 5.610 25293
580 1 6 . 1 1 17 17 CYS CB C 17 47.454 47.454 29.324 18.130 25293
581 1 6 . 1 1 17 17 CYS H H 17 8.239 8.239 8.504 -0.265 25293
582 1 6 . 1 1 18 18 THR N N 18 117.192 117.192 116.064 1.128 25293
583 1 6 . 1 1 18 18 THR HA H 18 3.912 3.912 4.796 -0.884 25293
584 1 6 . 1 1 18 18 THR CA C 18 65.404 65.404 63.451 1.953 25293
585 1 6 . 1 1 18 18 THR H H 18 8.277 8.277 8.906 -0.629 25293
586 1 6 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.735 -0.244 25293
587 1 6 . 1 1 19 19 LEU CB C 19 40.963 40.963 42.033 -1.070 25293
588 1 6 . 1 1 19 19 LEU H H 19 8.474 8.474 7.681 0.793 25293
589 1 6 . 1 1 20 20 GLY N N 20 105.833 105.833 107.996 -2.163 25293
590 1 6 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.334 0.625 25293
591 1 6 . 1 1 20 20 GLY H H 20 8.123 8.123 8.279 -0.156 25293
592 1 6 . 1 1 21 21 THR N N 21 111.926 111.926 111.934 -0.008 25293
593 1 6 . 1 1 21 21 THR HA H 21 4.653 4.653 4.338 0.315 25293
594 1 6 . 1 1 21 21 THR CB C 21 68.777 68.777 70.004 -1.227 25293
595 1 6 . 1 1 21 21 THR H H 21 7.658 7.658 7.563 0.095 25293
596 1 6 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.614 0.027 25293
597 1 6 . 1 1 22 22 CYS CB C 22 44.757 44.757 27.834 16.923 25293
598 1 6 . 1 1 22 22 CYS H H 22 8.470 8.470 8.457 0.013 25293
599 1 6 . 1 1 23 23 SER N N 23 122.918 122.918 117.058 5.860 25293
600 1 6 . 1 1 23 23 SER HA H 23 4.423 4.423 4.407 0.016 25293
601 1 6 . 1 1 23 23 SER CA C 23 59.914 59.914 60.507 -0.593 25293
602 1 6 . 1 1 23 23 SER CB C 23 64.597 64.597 63.477 1.120 25293
603 1 6 . 1 1 23 23 SER H H 23 10.973 10.973 8.629 2.344 25293
604 1 6 . 1 1 24 24 THR N N 24 124.108 124.108 116.215 7.893 25293
605 1 6 . 1 1 24 24 THR HA H 24 3.979 3.979 4.341 -0.362 25293
606 1 6 . 1 1 24 24 THR CA C 24 63.960 63.960 62.257 1.704 25293
607 1 6 . 1 1 24 24 THR CB C 24 68.471 68.471 69.526 -1.055 25293
608 1 6 . 1 1 24 24 THR H H 24 9.476 9.476 7.653 1.823 25293
609 1 6 . 1 1 25 25 GLN N N 25 128.543 128.543 121.491 7.052 25293
610 1 6 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.432 -0.507 25293
611 1 6 . 1 1 25 25 GLN CA C 25 57.951 57.951 55.724 2.227 25293
612 1 6 . 1 1 25 25 GLN CB C 25 28.195 28.195 28.610 -0.415 25293
613 1 6 . 1 1 25 25 GLN H H 25 8.714 8.714 8.549 0.165 25293
614 1 6 . 1 1 26 26 GLY CA C 26 45.249 45.249 44.716 0.533 25293
615 1 6 . 1 1 26 26 GLY H H 26 8.810 8.810 8.527 0.283 25293
616 1 6 . 1 1 27 27 CYS N N 27 117.687 117.687 119.160 -1.473 25293
617 1 6 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.621 0.452 25293
618 1 6 . 1 1 27 27 CYS CB C 27 49.941 49.941 28.698 21.244 25293
619 1 6 . 1 1 27 27 CYS H H 27 7.697 7.697 8.094 -0.397 25293
620 1 6 . 1 1 28 28 THR N N 28 115.298 115.298 116.607 -1.309 25293
621 1 6 . 1 1 28 28 THR HA H 28 4.488 4.488 4.678 -0.190 25293
622 1 6 . 1 1 28 28 THR CA C 28 60.019 60.019 61.503 -1.484 25293
623 1 6 . 1 1 28 28 THR CB C 28 71.515 71.515 70.879 0.636 25293
624 1 6 . 1 1 28 28 THR H H 28 9.354 9.354 8.840 0.514 25293
625 1 7 . 1 1 2 2 TRP N N 2 124.464 124.464 126.525 -2.061 25293
626 1 7 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.665 -0.644 25293
627 1 7 . 1 1 2 2 TRP CA C 2 59.121 59.121 57.911 1.210 25293
628 1 7 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.841 -0.152 25293
629 1 7 . 1 1 2 2 TRP H H 2 8.268 8.268 7.489 0.779 25293
630 1 7 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.276 0.175 25293
631 1 7 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.303 1.912 25293
632 1 7 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.101 -0.351 25293
633 1 7 . 1 1 4 4 ILE N N 4 126.955 126.955 119.006 7.949 25293
634 1 7 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.717 0.469 25293
635 1 7 . 1 1 4 4 ILE CA C 4 60.005 60.005 60.864 -0.859 25293
636 1 7 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.529 -0.120 25293
637 1 7 . 1 1 4 4 ILE H H 4 8.276 8.276 7.547 0.729 25293
638 1 7 . 1 1 5 5 CYS N N 5 124.228 124.228 122.875 1.353 25293
639 1 7 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.777 0.048 25293
640 1 7 . 1 1 5 5 CYS CB C 5 43.781 43.781 30.517 13.264 25293
641 1 7 . 1 1 5 5 CYS H H 5 7.650 7.650 8.270 -0.620 25293
642 1 7 . 1 1 6 6 LYS N N 6 122.395 122.395 121.235 1.160 25293
643 1 7 . 1 1 6 6 LYS HA H 6 4.938 4.938 5.021 -0.083 25293
644 1 7 . 1 1 6 6 LYS H H 6 9.212 9.212 8.885 0.327 25293
645 1 7 . 1 1 7 7 ARG N N 7 122.102 122.102 125.453 -3.351 25293
646 1 7 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.356 0.355 25293
647 1 7 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.834 1.887 25293
648 1 7 . 1 1 7 7 ARG H H 7 8.700 8.700 8.750 -0.050 25293
649 1 7 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.797 -0.482 25293
650 1 7 . 1 1 8 8 ASN CA C 8 54.388 54.388 53.044 1.344 25293
651 1 7 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.712 -1.147 25293
652 1 7 . 1 1 8 8 ASN H H 8 7.794 7.794 8.488 -0.694 25293
653 1 7 . 1 1 9 9 GLY N N 9 101.289 101.289 106.415 -5.126 25293
654 1 7 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.047 0.216 25293
655 1 7 . 1 1 9 9 GLY H H 9 8.652 8.652 8.476 0.176 25293
656 1 7 . 1 1 10 10 LEU N N 10 120.783 120.783 118.407 2.376 25293
657 1 7 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.700 0.355 25293
658 1 7 . 1 1 10 10 LEU CA C 10 51.535 51.535 51.238 0.297 25293
659 1 7 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.410 -1.350 25293
660 1 7 . 1 1 10 10 LEU H H 10 7.791 7.791 7.707 0.084 25293
661 1 7 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.476 0.581 25293
662 1 7 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.592 -2.255 25293
663 1 7 . 1 1 12 12 VAL N N 12 115.299 115.299 116.251 -0.952 25293
664 1 7 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.228 0.373 25293
665 1 7 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.853 -1.752 25293
666 1 7 . 1 1 12 12 VAL H H 12 7.971 7.971 8.037 -0.065 25293
667 1 7 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.455 -0.124 25293
668 1 7 . 1 1 13 13 CYS CA C 13 59.105 59.105 59.886 -0.781 25293
669 1 7 . 1 1 13 13 CYS CB C 13 48.573 48.573 26.980 21.593 25293
670 1 7 . 1 1 13 13 CYS H H 13 8.103 8.103 8.110 -0.007 25293
671 1 7 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.542 0.927 25293
672 1 7 . 1 1 14 14 GLY H H 14 8.433 8.433 8.815 -0.382 25293
673 1 7 . 1 1 15 15 GLU N N 15 115.613 115.613 117.875 -2.262 25293
674 1 7 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.524 0.143 25293
675 1 7 . 1 1 15 15 GLU CB C 15 32.554 32.554 29.628 2.926 25293
676 1 7 . 1 1 15 15 GLU H H 15 7.064 7.064 8.068 -1.004 25293
677 1 7 . 1 1 16 16 THR N N 16 115.298 115.298 113.918 1.380 25293
678 1 7 . 1 1 16 16 THR HA H 16 4.525 4.525 4.195 0.330 25293
679 1 7 . 1 1 16 16 THR CB C 16 70.742 70.742 68.597 2.145 25293
680 1 7 . 1 1 16 16 THR H H 16 8.413 8.413 8.033 0.380 25293
681 1 7 . 1 1 17 17 CYS N N 17 115.927 115.927 124.952 -9.025 25293
682 1 7 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.626 0.435 25293
683 1 7 . 1 1 17 17 CYS CA C 17 62.598 62.598 57.185 5.413 25293
684 1 7 . 1 1 17 17 CYS CB C 17 47.454 47.454 28.823 18.631 25293
685 1 7 . 1 1 17 17 CYS H H 17 8.239 8.239 8.295 -0.056 25293
686 1 7 . 1 1 18 18 THR N N 18 117.192 117.192 115.085 2.107 25293
687 1 7 . 1 1 18 18 THR HA H 18 3.912 3.912 4.797 -0.885 25293
688 1 7 . 1 1 18 18 THR CA C 18 65.404 65.404 62.917 2.487 25293
689 1 7 . 1 1 18 18 THR H H 18 8.277 8.277 8.903 -0.626 25293
690 1 7 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.913 -0.422 25293
691 1 7 . 1 1 19 19 LEU CB C 19 40.963 40.963 41.948 -0.985 25293
692 1 7 . 1 1 19 19 LEU H H 19 8.474 8.474 7.855 0.619 25293
693 1 7 . 1 1 20 20 GLY N N 20 105.833 105.833 108.097 -2.264 25293
694 1 7 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.646 0.313 25293
695 1 7 . 1 1 20 20 GLY H H 20 8.123 8.123 8.424 -0.301 25293
696 1 7 . 1 1 21 21 THR N N 21 111.926 111.926 111.443 0.483 25293
697 1 7 . 1 1 21 21 THR HA H 21 4.653 4.653 4.362 0.291 25293
698 1 7 . 1 1 21 21 THR CB C 21 68.777 68.777 70.017 -1.240 25293
699 1 7 . 1 1 21 21 THR H H 21 7.658 7.658 7.582 0.076 25293
700 1 7 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.598 0.043 25293
701 1 7 . 1 1 22 22 CYS CB C 22 44.757 44.757 27.843 16.914 25293
702 1 7 . 1 1 22 22 CYS H H 22 8.470 8.470 8.852 -0.382 25293
703 1 7 . 1 1 23 23 SER N N 23 122.918 122.918 117.293 5.625 25293
704 1 7 . 1 1 23 23 SER HA H 23 4.423 4.423 4.433 -0.010 25293
705 1 7 . 1 1 23 23 SER CA C 23 59.914 59.914 60.279 -0.365 25293
706 1 7 . 1 1 23 23 SER CB C 23 64.597 64.597 63.977 0.620 25293
707 1 7 . 1 1 23 23 SER H H 23 10.973 10.973 8.665 2.308 25293
708 1 7 . 1 1 24 24 THR N N 24 124.108 124.108 115.375 8.733 25293
709 1 7 . 1 1 24 24 THR HA H 24 3.979 3.979 4.195 -0.216 25293
710 1 7 . 1 1 24 24 THR CA C 24 63.960 63.960 63.050 0.910 25293
711 1 7 . 1 1 24 24 THR CB C 24 68.471 68.471 69.538 -1.067 25293
712 1 7 . 1 1 24 24 THR H H 24 9.476 9.476 8.367 1.109 25293
713 1 7 . 1 1 25 25 GLN N N 25 128.543 128.543 122.234 6.309 25293
714 1 7 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.339 -0.414 25293
715 1 7 . 1 1 25 25 GLN CA C 25 57.951 57.951 55.871 2.080 25293
716 1 7 . 1 1 25 25 GLN CB C 25 28.195 28.195 28.550 -0.355 25293
717 1 7 . 1 1 25 25 GLN H H 25 8.714 8.714 8.507 0.207 25293
718 1 7 . 1 1 26 26 GLY CA C 26 45.249 45.249 44.745 0.505 25293
719 1 7 . 1 1 26 26 GLY H H 26 8.810 8.810 8.505 0.305 25293
720 1 7 . 1 1 27 27 CYS N N 27 117.687 117.687 119.634 -1.947 25293
721 1 7 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.550 0.523 25293
722 1 7 . 1 1 27 27 CYS CB C 27 49.941 49.941 28.179 21.762 25293
723 1 7 . 1 1 27 27 CYS H H 27 7.697 7.697 8.175 -0.478 25293
724 1 7 . 1 1 28 28 THR N N 28 115.298 115.298 115.931 -0.633 25293
725 1 7 . 1 1 28 28 THR HA H 28 4.488 4.488 4.706 -0.218 25293
726 1 7 . 1 1 28 28 THR CA C 28 60.019 60.019 61.444 -1.425 25293
727 1 7 . 1 1 28 28 THR CB C 28 71.515 71.515 71.162 0.353 25293
728 1 7 . 1 1 28 28 THR H H 28 9.354 9.354 8.781 0.573 25293
729 1 8 . 1 1 2 2 TRP N N 2 124.464 124.464 126.942 -2.478 25293
730 1 8 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.692 -0.671 25293
731 1 8 . 1 1 2 2 TRP CA C 2 59.121 59.121 58.373 0.748 25293
732 1 8 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.776 -0.087 25293
733 1 8 . 1 1 2 2 TRP H H 2 8.268 8.268 7.563 0.705 25293
734 1 8 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.296 0.155 25293
735 1 8 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.307 1.908 25293
736 1 8 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.114 -0.364 25293
737 1 8 . 1 1 4 4 ILE N N 4 126.955 126.955 119.178 7.777 25293
738 1 8 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.716 0.470 25293
739 1 8 . 1 1 4 4 ILE CA C 4 60.005 60.005 60.789 -0.784 25293
740 1 8 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.535 -0.126 25293
741 1 8 . 1 1 4 4 ILE H H 4 8.276 8.276 7.502 0.774 25293
742 1 8 . 1 1 5 5 CYS N N 5 124.228 124.228 123.682 0.546 25293
743 1 8 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.539 0.286 25293
744 1 8 . 1 1 5 5 CYS CB C 5 43.781 43.781 29.674 14.107 25293
745 1 8 . 1 1 5 5 CYS H H 5 7.650 7.650 8.346 -0.696 25293
746 1 8 . 1 1 6 6 LYS N N 6 122.395 122.395 122.420 -0.025 25293
747 1 8 . 1 1 6 6 LYS HA H 6 4.938 4.938 4.817 0.121 25293
748 1 8 . 1 1 6 6 LYS H H 6 9.212 9.212 8.123 1.089 25293
749 1 8 . 1 1 7 7 ARG N N 7 122.102 122.102 124.934 -2.832 25293
750 1 8 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.458 0.253 25293
751 1 8 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.692 2.029 25293
752 1 8 . 1 1 7 7 ARG H H 7 8.700 8.700 8.570 0.130 25293
753 1 8 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.745 -0.430 25293
754 1 8 . 1 1 8 8 ASN CA C 8 54.388 54.388 53.155 1.233 25293
755 1 8 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.696 -1.131 25293
756 1 8 . 1 1 8 8 ASN H H 8 7.794 7.794 8.486 -0.692 25293
757 1 8 . 1 1 9 9 GLY N N 9 101.289 101.289 106.081 -4.792 25293
758 1 8 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.338 -0.074 25293
759 1 8 . 1 1 9 9 GLY H H 9 8.652 8.652 8.465 0.187 25293
760 1 8 . 1 1 10 10 LEU N N 10 120.783 120.783 118.885 1.898 25293
761 1 8 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.752 0.303 25293
762 1 8 . 1 1 10 10 LEU CA C 10 51.535 51.535 50.917 0.618 25293
763 1 8 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.121 -1.061 25293
764 1 8 . 1 1 10 10 LEU H H 10 7.791 7.791 7.677 0.114 25293
765 1 8 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.432 0.625 25293
766 1 8 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.303 -1.966 25293
767 1 8 . 1 1 12 12 VAL N N 12 115.299 115.299 117.003 -1.704 25293
768 1 8 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.464 0.137 25293
769 1 8 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.288 -1.187 25293
770 1 8 . 1 1 12 12 VAL H H 12 7.971 7.971 8.034 -0.063 25293
771 1 8 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.690 -0.359 25293
772 1 8 . 1 1 13 13 CYS CA C 13 59.105 59.105 58.575 0.530 25293
773 1 8 . 1 1 13 13 CYS CB C 13 48.573 48.573 29.262 19.311 25293
774 1 8 . 1 1 13 13 CYS H H 13 8.103 8.103 8.092 0.011 25293
775 1 8 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.920 0.549 25293
776 1 8 . 1 1 14 14 GLY H H 14 8.433 8.433 8.762 -0.329 25293
777 1 8 . 1 1 15 15 GLU N N 15 115.613 115.613 117.970 -2.357 25293
778 1 8 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.529 0.138 25293
779 1 8 . 1 1 15 15 GLU CB C 15 32.554 32.554 29.546 3.008 25293
780 1 8 . 1 1 15 15 GLU H H 15 7.064 7.064 8.007 -0.943 25293
781 1 8 . 1 1 16 16 THR N N 16 115.298 115.298 113.945 1.353 25293
782 1 8 . 1 1 16 16 THR HA H 16 4.525 4.525 4.225 0.300 25293
783 1 8 . 1 1 16 16 THR CB C 16 70.742 70.742 68.691 2.051 25293
784 1 8 . 1 1 16 16 THR H H 16 8.413 8.413 8.129 0.284 25293
785 1 8 . 1 1 17 17 CYS N N 17 115.927 115.927 123.929 -8.002 25293
786 1 8 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.684 0.377 25293
787 1 8 . 1 1 17 17 CYS CA C 17 62.598 62.598 57.659 4.939 25293
788 1 8 . 1 1 17 17 CYS CB C 17 47.454 47.454 28.954 18.500 25293
789 1 8 . 1 1 17 17 CYS H H 17 8.239 8.239 8.314 -0.075 25293
790 1 8 . 1 1 18 18 THR N N 18 117.192 117.192 114.971 2.221 25293
791 1 8 . 1 1 18 18 THR HA H 18 3.912 3.912 4.747 -0.835 25293
792 1 8 . 1 1 18 18 THR CA C 18 65.404 65.404 63.450 1.954 25293
793 1 8 . 1 1 18 18 THR H H 18 8.277 8.277 8.915 -0.638 25293
794 1 8 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.912 -0.421 25293
795 1 8 . 1 1 19 19 LEU CB C 19 40.963 40.963 41.769 -0.806 25293
796 1 8 . 1 1 19 19 LEU H H 19 8.474 8.474 7.726 0.748 25293
797 1 8 . 1 1 20 20 GLY N N 20 105.833 105.833 108.010 -2.177 25293
798 1 8 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.761 0.198 25293
799 1 8 . 1 1 20 20 GLY H H 20 8.123 8.123 8.445 -0.322 25293
800 1 8 . 1 1 21 21 THR N N 21 111.926 111.926 111.793 0.133 25293
801 1 8 . 1 1 21 21 THR HA H 21 4.653 4.653 4.395 0.258 25293
802 1 8 . 1 1 21 21 THR CB C 21 68.777 68.777 70.095 -1.318 25293
803 1 8 . 1 1 21 21 THR H H 21 7.658 7.658 7.539 0.119 25293
804 1 8 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.570 0.071 25293
805 1 8 . 1 1 22 22 CYS CB C 22 44.757 44.757 27.595 17.162 25293
806 1 8 . 1 1 22 22 CYS H H 22 8.470 8.470 8.858 -0.388 25293
807 1 8 . 1 1 23 23 SER N N 23 122.918 122.918 118.954 3.964 25293
808 1 8 . 1 1 23 23 SER HA H 23 4.423 4.423 4.313 0.110 25293
809 1 8 . 1 1 23 23 SER CA C 23 59.914 59.914 60.267 -0.353 25293
810 1 8 . 1 1 23 23 SER CB C 23 64.597 64.597 63.605 0.992 25293
811 1 8 . 1 1 23 23 SER H H 23 10.973 10.973 8.612 2.361 25293
812 1 8 . 1 1 24 24 THR N N 24 124.108 124.108 114.842 9.266 25293
813 1 8 . 1 1 24 24 THR HA H 24 3.979 3.979 4.496 -0.517 25293
814 1 8 . 1 1 24 24 THR CA C 24 63.960 63.960 61.292 2.668 25293
815 1 8 . 1 1 24 24 THR CB C 24 68.471 68.471 69.815 -1.344 25293
816 1 8 . 1 1 24 24 THR H H 24 9.476 9.476 8.057 1.419 25293
817 1 8 . 1 1 25 25 GLN N N 25 128.543 128.543 121.954 6.589 25293
818 1 8 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.551 -0.626 25293
819 1 8 . 1 1 25 25 GLN CA C 25 57.951 57.951 56.680 1.271 25293
820 1 8 . 1 1 25 25 GLN CB C 25 28.195 28.195 28.703 -0.508 25293
821 1 8 . 1 1 25 25 GLN H H 25 8.714 8.714 8.564 0.150 25293
822 1 8 . 1 1 26 26 GLY CA C 26 45.249 45.249 44.937 0.312 25293
823 1 8 . 1 1 26 26 GLY H H 26 8.810 8.810 8.385 0.425 25293
824 1 8 . 1 1 27 27 CYS N N 27 117.687 117.687 118.007 -0.320 25293
825 1 8 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.662 0.411 25293
826 1 8 . 1 1 27 27 CYS CB C 27 49.941 49.941 31.061 18.880 25293
827 1 8 . 1 1 27 27 CYS H H 27 7.697 7.697 7.861 -0.164 25293
828 1 8 . 1 1 28 28 THR N N 28 115.298 115.298 118.379 -3.081 25293
829 1 8 . 1 1 28 28 THR HA H 28 4.488 4.488 4.686 -0.198 25293
830 1 8 . 1 1 28 28 THR CA C 28 60.019 60.019 61.296 -1.277 25293
831 1 8 . 1 1 28 28 THR CB C 28 71.515 71.515 70.006 1.509 25293
832 1 8 . 1 1 28 28 THR H H 28 9.354 9.354 8.728 0.626 25293
833 1 9 . 1 1 2 2 TRP N N 2 124.464 124.464 126.858 -2.394 25293
834 1 9 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.666 -0.645 25293
835 1 9 . 1 1 2 2 TRP CA C 2 59.121 59.121 58.076 1.045 25293
836 1 9 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.891 -0.202 25293
837 1 9 . 1 1 2 2 TRP H H 2 8.268 8.268 7.556 0.712 25293
838 1 9 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.282 0.169 25293
839 1 9 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.308 1.907 25293
840 1 9 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.071 -0.321 25293
841 1 9 . 1 1 4 4 ILE N N 4 126.955 126.955 119.243 7.712 25293
842 1 9 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.720 0.466 25293
843 1 9 . 1 1 4 4 ILE CA C 4 60.005 60.005 60.672 -0.667 25293
844 1 9 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.538 -0.129 25293
845 1 9 . 1 1 4 4 ILE H H 4 8.276 8.276 7.529 0.747 25293
846 1 9 . 1 1 5 5 CYS N N 5 124.228 124.228 123.850 0.378 25293
847 1 9 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.528 0.297 25293
848 1 9 . 1 1 5 5 CYS CB C 5 43.781 43.781 29.768 14.013 25293
849 1 9 . 1 1 5 5 CYS H H 5 7.650 7.650 8.377 -0.727 25293
850 1 9 . 1 1 6 6 LYS N N 6 122.395 122.395 122.523 -0.128 25293
851 1 9 . 1 1 6 6 LYS HA H 6 4.938 4.938 5.034 -0.096 25293
852 1 9 . 1 1 6 6 LYS H H 6 9.212 9.212 8.162 1.050 25293
853 1 9 . 1 1 7 7 ARG N N 7 122.102 122.102 125.390 -3.288 25293
854 1 9 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.285 0.426 25293
855 1 9 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.803 1.918 25293
856 1 9 . 1 1 7 7 ARG H H 7 8.700 8.700 8.576 0.124 25293
857 1 9 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.825 -0.510 25293
858 1 9 . 1 1 8 8 ASN CA C 8 54.388 54.388 52.950 1.438 25293
859 1 9 . 1 1 8 8 ASN CB C 8 37.565 37.565 39.188 -1.623 25293
860 1 9 . 1 1 8 8 ASN H H 8 7.794 7.794 8.373 -0.579 25293
861 1 9 . 1 1 9 9 GLY N N 9 101.289 101.289 106.585 -5.296 25293
862 1 9 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.279 -0.015 25293
863 1 9 . 1 1 9 9 GLY H H 9 8.652 8.652 8.499 0.153 25293
864 1 9 . 1 1 10 10 LEU N N 10 120.783 120.783 118.636 2.147 25293
865 1 9 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.712 0.343 25293
866 1 9 . 1 1 10 10 LEU CA C 10 51.535 51.535 51.022 0.513 25293
867 1 9 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.282 -1.222 25293
868 1 9 . 1 1 10 10 LEU H H 10 7.791 7.791 7.652 0.139 25293
869 1 9 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.458 0.599 25293
870 1 9 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.672 -2.335 25293
871 1 9 . 1 1 12 12 VAL N N 12 115.299 115.299 116.574 -1.275 25293
872 1 9 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.384 0.217 25293
873 1 9 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.501 -1.400 25293
874 1 9 . 1 1 12 12 VAL H H 12 7.971 7.971 8.295 -0.324 25293
875 1 9 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.696 -0.365 25293
876 1 9 . 1 1 13 13 CYS CA C 13 59.105 59.105 58.804 0.301 25293
877 1 9 . 1 1 13 13 CYS CB C 13 48.573 48.573 29.214 19.359 25293
878 1 9 . 1 1 13 13 CYS H H 13 8.103 8.103 8.071 0.032 25293
879 1 9 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.848 0.621 25293
880 1 9 . 1 1 14 14 GLY H H 14 8.433 8.433 8.734 -0.301 25293
881 1 9 . 1 1 15 15 GLU N N 15 115.613 115.613 117.966 -2.353 25293
882 1 9 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.509 0.158 25293
883 1 9 . 1 1 15 15 GLU CB C 15 32.554 32.554 30.180 2.374 25293
884 1 9 . 1 1 15 15 GLU H H 15 7.064 7.064 8.041 -0.977 25293
885 1 9 . 1 1 16 16 THR N N 16 115.298 115.298 114.209 1.089 25293
886 1 9 . 1 1 16 16 THR HA H 16 4.525 4.525 4.195 0.330 25293
887 1 9 . 1 1 16 16 THR CB C 16 70.742 70.742 68.362 2.380 25293
888 1 9 . 1 1 16 16 THR H H 16 8.413 8.413 8.001 0.412 25293
889 1 9 . 1 1 17 17 CYS N N 17 115.927 115.927 124.708 -8.781 25293
890 1 9 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.701 0.360 25293
891 1 9 . 1 1 17 17 CYS CA C 17 62.598 62.598 57.471 5.128 25293
892 1 9 . 1 1 17 17 CYS CB C 17 47.454 47.454 29.010 18.444 25293
893 1 9 . 1 1 17 17 CYS H H 17 8.239 8.239 8.242 -0.003 25293
894 1 9 . 1 1 18 18 THR N N 18 117.192 117.192 115.490 1.702 25293
895 1 9 . 1 1 18 18 THR HA H 18 3.912 3.912 4.773 -0.861 25293
896 1 9 . 1 1 18 18 THR CA C 18 65.404 65.404 63.313 2.091 25293
897 1 9 . 1 1 18 18 THR H H 18 8.277 8.277 8.824 -0.547 25293
898 1 9 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.902 -0.411 25293
899 1 9 . 1 1 19 19 LEU CB C 19 40.963 40.963 41.852 -0.889 25293
900 1 9 . 1 1 19 19 LEU H H 19 8.474 8.474 7.680 0.794 25293
901 1 9 . 1 1 20 20 GLY N N 20 105.833 105.833 108.105 -2.272 25293
902 1 9 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.785 0.174 25293
903 1 9 . 1 1 20 20 GLY H H 20 8.123 8.123 8.464 -0.341 25293
904 1 9 . 1 1 21 21 THR N N 21 111.926 111.926 111.896 0.030 25293
905 1 9 . 1 1 21 21 THR HA H 21 4.653 4.653 4.397 0.256 25293
906 1 9 . 1 1 21 21 THR CB C 21 68.777 68.777 70.103 -1.326 25293
907 1 9 . 1 1 21 21 THR H H 21 7.658 7.658 7.565 0.093 25293
908 1 9 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.524 0.117 25293
909 1 9 . 1 1 22 22 CYS CB C 22 44.757 44.757 27.548 17.209 25293
910 1 9 . 1 1 22 22 CYS H H 22 8.470 8.470 8.891 -0.421 25293
911 1 9 . 1 1 23 23 SER N N 23 122.918 122.918 119.270 3.648 25293
912 1 9 . 1 1 23 23 SER HA H 23 4.423 4.423 4.338 0.085 25293
913 1 9 . 1 1 23 23 SER CA C 23 59.914 59.914 60.284 -0.370 25293
914 1 9 . 1 1 23 23 SER CB C 23 64.597 64.597 63.658 0.939 25293
915 1 9 . 1 1 23 23 SER H H 23 10.973 10.973 8.661 2.312 25293
916 1 9 . 1 1 24 24 THR N N 24 124.108 124.108 115.480 8.628 25293
917 1 9 . 1 1 24 24 THR HA H 24 3.979 3.979 4.351 -0.372 25293
918 1 9 . 1 1 24 24 THR CA C 24 63.960 63.960 61.938 2.022 25293
919 1 9 . 1 1 24 24 THR CB C 24 68.471 68.471 69.689 -1.218 25293
920 1 9 . 1 1 24 24 THR H H 24 9.476 9.476 8.256 1.220 25293
921 1 9 . 1 1 25 25 GLN N N 25 128.543 128.543 122.587 5.956 25293
922 1 9 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.450 -0.525 25293
923 1 9 . 1 1 25 25 GLN CA C 25 57.951 57.951 55.935 2.016 25293
924 1 9 . 1 1 25 25 GLN CB C 25 28.195 28.195 27.743 0.452 25293
925 1 9 . 1 1 25 25 GLN H H 25 8.714 8.714 8.642 0.072 25293
926 1 9 . 1 1 26 26 GLY CA C 26 45.249 45.249 44.995 0.254 25293
927 1 9 . 1 1 26 26 GLY H H 26 8.810 8.810 8.280 0.530 25293
928 1 9 . 1 1 27 27 CYS N N 27 117.687 117.687 121.704 -4.017 25293
929 1 9 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.425 0.648 25293
930 1 9 . 1 1 27 27 CYS CB C 27 49.941 49.941 27.360 22.581 25293
931 1 9 . 1 1 27 27 CYS H H 27 7.697 7.697 8.159 -0.462 25293
932 1 9 . 1 1 28 28 THR N N 28 115.298 115.298 119.369 -4.071 25293
933 1 9 . 1 1 28 28 THR HA H 28 4.488 4.488 4.619 -0.131 25293
934 1 9 . 1 1 28 28 THR CA C 28 60.019 60.019 61.343 -1.324 25293
935 1 9 . 1 1 28 28 THR CB C 28 71.515 71.515 69.871 1.644 25293
936 1 9 . 1 1 28 28 THR H H 28 9.354 9.354 8.602 0.752 25293
937 1 10 . 1 1 2 2 TRP N N 2 124.464 124.464 126.491 -2.027 25293
938 1 10 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.660 -0.639 25293
939 1 10 . 1 1 2 2 TRP CA C 2 59.121 59.121 57.952 1.169 25293
940 1 10 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.884 -0.195 25293
941 1 10 . 1 1 2 2 TRP H H 2 8.268 8.268 7.512 0.756 25293
942 1 10 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.269 0.182 25293
943 1 10 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.286 1.929 25293
944 1 10 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.070 -0.320 25293
945 1 10 . 1 1 4 4 ILE N N 4 126.955 126.955 119.100 7.855 25293
946 1 10 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.718 0.468 25293
947 1 10 . 1 1 4 4 ILE CA C 4 60.005 60.005 60.826 -0.821 25293
948 1 10 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.551 -0.142 25293
949 1 10 . 1 1 4 4 ILE H H 4 8.276 8.276 7.563 0.713 25293
950 1 10 . 1 1 5 5 CYS N N 5 124.228 124.228 122.923 1.305 25293
951 1 10 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.741 0.084 25293
952 1 10 . 1 1 5 5 CYS CB C 5 43.781 43.781 30.407 13.374 25293
953 1 10 . 1 1 5 5 CYS H H 5 7.650 7.650 8.265 -0.615 25293
954 1 10 . 1 1 6 6 LYS N N 6 122.395 122.395 121.194 1.201 25293
955 1 10 . 1 1 6 6 LYS HA H 6 4.938 4.938 4.987 -0.049 25293
956 1 10 . 1 1 6 6 LYS H H 6 9.212 9.212 8.845 0.367 25293
957 1 10 . 1 1 7 7 ARG N N 7 122.102 122.102 126.274 -4.172 25293
958 1 10 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.250 0.461 25293
959 1 10 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.748 1.973 25293
960 1 10 . 1 1 7 7 ARG H H 7 8.700 8.700 8.532 0.168 25293
961 1 10 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.801 -0.486 25293
962 1 10 . 1 1 8 8 ASN CA C 8 54.388 54.388 52.785 1.603 25293
963 1 10 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.563 -0.998 25293
964 1 10 . 1 1 8 8 ASN H H 8 7.794 7.794 8.316 -0.522 25293
965 1 10 . 1 1 9 9 GLY N N 9 101.289 101.289 106.972 -5.683 25293
966 1 10 . 1 1 9 9 GLY CA C 9 45.264 45.264 44.960 0.304 25293
967 1 10 . 1 1 9 9 GLY H H 9 8.652 8.652 8.492 0.160 25293
968 1 10 . 1 1 10 10 LEU N N 10 120.783 120.783 118.104 2.679 25293
969 1 10 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.689 0.366 25293
970 1 10 . 1 1 10 10 LEU CA C 10 51.535 51.535 51.384 0.151 25293
971 1 10 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.452 -1.392 25293
972 1 10 . 1 1 10 10 LEU H H 10 7.791 7.791 7.709 0.082 25293
973 1 10 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.447 0.610 25293
974 1 10 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.545 -2.208 25293
975 1 10 . 1 1 12 12 VAL N N 12 115.299 115.299 116.431 -1.132 25293
976 1 10 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.356 0.245 25293
977 1 10 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.405 -1.304 25293
978 1 10 . 1 1 12 12 VAL H H 12 7.971 7.971 8.332 -0.361 25293
979 1 10 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.691 -0.360 25293
980 1 10 . 1 1 13 13 CYS CA C 13 59.105 59.105 58.691 0.414 25293
981 1 10 . 1 1 13 13 CYS CB C 13 48.573 48.573 29.154 19.419 25293
982 1 10 . 1 1 13 13 CYS H H 13 8.103 8.103 7.914 0.189 25293
983 1 10 . 1 1 14 14 GLY CA C 14 46.469 46.469 46.049 0.420 25293
984 1 10 . 1 1 14 14 GLY H H 14 8.433 8.433 8.737 -0.304 25293
985 1 10 . 1 1 15 15 GLU N N 15 115.613 115.613 117.687 -2.074 25293
986 1 10 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.471 0.196 25293
987 1 10 . 1 1 15 15 GLU CB C 15 32.554 32.554 30.061 2.493 25293
988 1 10 . 1 1 15 15 GLU H H 15 7.064 7.064 8.156 -1.092 25293
989 1 10 . 1 1 16 16 THR N N 16 115.298 115.298 113.893 1.405 25293
990 1 10 . 1 1 16 16 THR HA H 16 4.525 4.525 4.178 0.347 25293
991 1 10 . 1 1 16 16 THR CB C 16 70.742 70.742 68.512 2.230 25293
992 1 10 . 1 1 16 16 THR H H 16 8.413 8.413 7.968 0.445 25293
993 1 10 . 1 1 17 17 CYS N N 17 115.927 115.927 124.999 -9.072 25293
994 1 10 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.681 0.380 25293
995 1 10 . 1 1 17 17 CYS CA C 17 62.598 62.598 57.014 5.584 25293
996 1 10 . 1 1 17 17 CYS CB C 17 47.454 47.454 28.952 18.502 25293
997 1 10 . 1 1 17 17 CYS H H 17 8.239 8.239 8.175 0.064 25293
998 1 10 . 1 1 18 18 THR N N 18 117.192 117.192 115.507 1.685 25293
999 1 10 . 1 1 18 18 THR HA H 18 3.912 3.912 4.808 -0.896 25293
1000 1 10 . 1 1 18 18 THR CA C 18 65.404 65.404 62.648 2.756 25293
1001 1 10 . 1 1 18 18 THR H H 18 8.277 8.277 8.701 -0.424 25293
1002 1 10 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.876 -0.385 25293
1003 1 10 . 1 1 19 19 LEU CB C 19 40.963 40.963 42.000 -1.037 25293
1004 1 10 . 1 1 19 19 LEU H H 19 8.474 8.474 7.877 0.597 25293
1005 1 10 . 1 1 20 20 GLY N N 20 105.833 105.833 108.210 -2.377 25293
1006 1 10 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.690 0.269 25293
1007 1 10 . 1 1 20 20 GLY H H 20 8.123 8.123 8.363 -0.240 25293
1008 1 10 . 1 1 21 21 THR N N 21 111.926 111.926 112.414 -0.488 25293
1009 1 10 . 1 1 21 21 THR HA H 21 4.653 4.653 4.379 0.274 25293
1010 1 10 . 1 1 21 21 THR CB C 21 68.777 68.777 70.093 -1.316 25293
1011 1 10 . 1 1 21 21 THR H H 21 7.658 7.658 7.569 0.089 25293
1012 1 10 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.566 0.075 25293
1013 1 10 . 1 1 22 22 CYS CB C 22 44.757 44.757 27.922 16.835 25293
1014 1 10 . 1 1 22 22 CYS H H 22 8.470 8.470 8.789 -0.319 25293
1015 1 10 . 1 1 23 23 SER N N 23 122.918 122.918 116.614 6.304 25293
1016 1 10 . 1 1 23 23 SER HA H 23 4.423 4.423 4.421 0.002 25293
1017 1 10 . 1 1 23 23 SER CA C 23 59.914 59.914 59.865 0.049 25293
1018 1 10 . 1 1 23 23 SER CB C 23 64.597 64.597 63.607 0.990 25293
1019 1 10 . 1 1 23 23 SER H H 23 10.973 10.973 8.659 2.314 25293
1020 1 10 . 1 1 24 24 THR N N 24 124.108 124.108 116.026 8.082 25293
1021 1 10 . 1 1 24 24 THR HA H 24 3.979 3.979 4.209 -0.230 25293
1022 1 10 . 1 1 24 24 THR CA C 24 63.960 63.960 62.842 1.118 25293
1023 1 10 . 1 1 24 24 THR CB C 24 68.471 68.471 69.788 -1.317 25293
1024 1 10 . 1 1 24 24 THR H H 24 9.476 9.476 8.284 1.192 25293
1025 1 10 . 1 1 25 25 GLN N N 25 128.543 128.543 123.382 5.161 25293
1026 1 10 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.320 -0.395 25293
1027 1 10 . 1 1 25 25 GLN CA C 25 57.951 57.951 55.501 2.450 25293
1028 1 10 . 1 1 25 25 GLN CB C 25 28.195 28.195 27.521 0.674 25293
1029 1 10 . 1 1 25 25 GLN H H 25 8.714 8.714 8.588 0.126 25293
1030 1 10 . 1 1 26 26 GLY CA C 26 45.249 45.249 44.870 0.379 25293
1031 1 10 . 1 1 26 26 GLY H H 26 8.810 8.810 8.253 0.557 25293
1032 1 10 . 1 1 27 27 CYS N N 27 117.687 117.687 120.912 -3.225 25293
1033 1 10 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.401 0.672 25293
1034 1 10 . 1 1 27 27 CYS CB C 27 49.941 49.941 26.894 23.047 25293
1035 1 10 . 1 1 27 27 CYS H H 27 7.697 7.697 8.273 -0.576 25293
1036 1 10 . 1 1 28 28 THR N N 28 115.298 115.298 115.947 -0.649 25293
1037 1 10 . 1 1 28 28 THR HA H 28 4.488 4.488 4.694 -0.206 25293
1038 1 10 . 1 1 28 28 THR CA C 28 60.019 60.019 61.583 -1.564 25293
1039 1 10 . 1 1 28 28 THR CB C 28 71.515 71.515 71.160 0.355 25293
1040 1 10 . 1 1 28 28 THR H H 28 9.354 9.354 8.689 0.665 25293
1041 1 11 . 1 1 2 2 TRP N N 2 124.464 124.464 126.749 -2.285 25293
1042 1 11 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.684 -0.663 25293
1043 1 11 . 1 1 2 2 TRP CA C 2 59.121 59.121 58.387 0.734 25293
1044 1 11 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.770 -0.081 25293
1045 1 11 . 1 1 2 2 TRP H H 2 8.268 8.268 7.571 0.697 25293
1046 1 11 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.273 0.178 25293
1047 1 11 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.297 1.918 25293
1048 1 11 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.052 -0.302 25293
1049 1 11 . 1 1 4 4 ILE N N 4 126.955 126.955 119.164 7.791 25293
1050 1 11 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.734 0.452 25293
1051 1 11 . 1 1 4 4 ILE CA C 4 60.005 60.005 61.391 -1.386 25293
1052 1 11 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.255 0.153 25293
1053 1 11 . 1 1 4 4 ILE H H 4 8.276 8.276 7.422 0.854 25293
1054 1 11 . 1 1 5 5 CYS N N 5 124.228 124.228 123.683 0.545 25293
1055 1 11 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.600 0.225 25293
1056 1 11 . 1 1 5 5 CYS CB C 5 43.781 43.781 29.521 14.260 25293
1057 1 11 . 1 1 5 5 CYS H H 5 7.650 7.650 8.135 -0.485 25293
1058 1 11 . 1 1 6 6 LYS N N 6 122.395 122.395 121.591 0.804 25293
1059 1 11 . 1 1 6 6 LYS HA H 6 4.938 4.938 4.988 -0.050 25293
1060 1 11 . 1 1 6 6 LYS H H 6 9.212 9.212 7.985 1.227 25293
1061 1 11 . 1 1 7 7 ARG N N 7 122.102 122.102 124.208 -2.106 25293
1062 1 11 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.076 0.635 25293
1063 1 11 . 1 1 7 7 ARG CB C 7 32.721 32.721 31.098 1.623 25293
1064 1 11 . 1 1 7 7 ARG H H 7 8.700 8.700 8.057 0.643 25293
1065 1 11 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.740 -0.425 25293
1066 1 11 . 1 1 8 8 ASN CA C 8 54.388 54.388 52.892 1.496 25293
1067 1 11 . 1 1 8 8 ASN CB C 8 37.565 37.565 37.777 -0.212 25293
1068 1 11 . 1 1 8 8 ASN H H 8 7.794 7.794 8.149 -0.355 25293
1069 1 11 . 1 1 9 9 GLY N N 9 101.289 101.289 106.557 -5.268 25293
1070 1 11 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.099 0.165 25293
1071 1 11 . 1 1 9 9 GLY H H 9 8.652 8.652 8.454 0.198 25293
1072 1 11 . 1 1 10 10 LEU N N 10 120.783 120.783 118.475 2.308 25293
1073 1 11 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.695 0.360 25293
1074 1 11 . 1 1 10 10 LEU CA C 10 51.535 51.535 51.276 0.259 25293
1075 1 11 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.498 -1.438 25293
1076 1 11 . 1 1 10 10 LEU H H 10 7.791 7.791 7.700 0.091 25293
1077 1 11 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.488 0.569 25293
1078 1 11 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.714 -2.377 25293
1079 1 11 . 1 1 12 12 VAL N N 12 115.299 115.299 117.830 -2.531 25293
1080 1 11 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.224 0.377 25293
1081 1 11 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.549 -1.448 25293
1082 1 11 . 1 1 12 12 VAL H H 12 7.971 7.971 8.084 -0.113 25293
1083 1 11 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.501 -0.170 25293
1084 1 11 . 1 1 13 13 CYS CA C 13 59.105 59.105 59.227 -0.122 25293
1085 1 11 . 1 1 13 13 CYS CB C 13 48.573 48.573 26.923 21.650 25293
1086 1 11 . 1 1 13 13 CYS H H 13 8.103 8.103 7.979 0.124 25293
1087 1 11 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.967 0.502 25293
1088 1 11 . 1 1 14 14 GLY H H 14 8.433 8.433 8.611 -0.178 25293
1089 1 11 . 1 1 15 15 GLU N N 15 115.613 115.613 116.552 -0.939 25293
1090 1 11 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.628 0.039 25293
1091 1 11 . 1 1 15 15 GLU CB C 15 32.554 32.554 32.912 -0.358 25293
1092 1 11 . 1 1 15 15 GLU H H 15 7.064 7.064 7.862 -0.798 25293
1093 1 11 . 1 1 16 16 THR N N 16 115.298 115.298 112.370 2.928 25293
1094 1 11 . 1 1 16 16 THR HA H 16 4.525 4.525 4.780 -0.255 25293
1095 1 11 . 1 1 16 16 THR CB C 16 70.742 70.742 69.747 0.995 25293
1096 1 11 . 1 1 16 16 THR H H 16 8.413 8.413 8.061 0.352 25293
1097 1 11 . 1 1 17 17 CYS N N 17 115.927 115.927 123.983 -8.056 25293
1098 1 11 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.755 0.306 25293
1099 1 11 . 1 1 17 17 CYS CA C 17 62.598 62.598 57.184 5.414 25293
1100 1 11 . 1 1 17 17 CYS CB C 17 47.454 47.454 29.103 18.351 25293
1101 1 11 . 1 1 17 17 CYS H H 17 8.239 8.239 8.442 -0.203 25293
1102 1 11 . 1 1 18 18 THR N N 18 117.192 117.192 116.066 1.126 25293
1103 1 11 . 1 1 18 18 THR HA H 18 3.912 3.912 4.800 -0.888 25293
1104 1 11 . 1 1 18 18 THR CA C 18 65.404 65.404 63.132 2.272 25293
1105 1 11 . 1 1 18 18 THR H H 18 8.277 8.277 8.779 -0.502 25293
1106 1 11 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.865 -0.374 25293
1107 1 11 . 1 1 19 19 LEU CB C 19 40.963 40.963 42.190 -1.226 25293
1108 1 11 . 1 1 19 19 LEU H H 19 8.474 8.474 7.841 0.633 25293
1109 1 11 . 1 1 20 20 GLY N N 20 105.833 105.833 108.013 -2.180 25293
1110 1 11 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.622 0.337 25293
1111 1 11 . 1 1 20 20 GLY H H 20 8.123 8.123 8.339 -0.216 25293
1112 1 11 . 1 1 21 21 THR N N 21 111.926 111.926 111.630 0.296 25293
1113 1 11 . 1 1 21 21 THR HA H 21 4.653 4.653 4.397 0.256 25293
1114 1 11 . 1 1 21 21 THR CB C 21 68.777 68.777 70.121 -1.344 25293
1115 1 11 . 1 1 21 21 THR H H 21 7.658 7.658 7.609 0.049 25293
1116 1 11 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.642 -0.001 25293
1117 1 11 . 1 1 22 22 CYS CB C 22 44.757 44.757 28.461 16.296 25293
1118 1 11 . 1 1 22 22 CYS H H 22 8.470 8.470 8.700 -0.230 25293
1119 1 11 . 1 1 23 23 SER N N 23 122.918 122.918 118.530 4.388 25293
1120 1 11 . 1 1 23 23 SER HA H 23 4.423 4.423 4.310 0.113 25293
1121 1 11 . 1 1 23 23 SER CA C 23 59.914 59.914 60.108 -0.194 25293
1122 1 11 . 1 1 23 23 SER CB C 23 64.597 64.597 63.410 1.187 25293
1123 1 11 . 1 1 23 23 SER H H 23 10.973 10.973 8.837 2.136 25293
1124 1 11 . 1 1 24 24 THR N N 24 124.108 124.108 115.528 8.580 25293
1125 1 11 . 1 1 24 24 THR HA H 24 3.979 3.979 4.299 -0.320 25293
1126 1 11 . 1 1 24 24 THR CA C 24 63.960 63.960 61.975 1.985 25293
1127 1 11 . 1 1 24 24 THR CB C 24 68.471 68.471 69.846 -1.375 25293
1128 1 11 . 1 1 24 24 THR H H 24 9.476 9.476 7.660 1.816 25293
1129 1 11 . 1 1 25 25 GLN N N 25 128.543 128.543 122.314 6.229 25293
1130 1 11 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.389 -0.464 25293
1131 1 11 . 1 1 25 25 GLN CA C 25 57.951 57.951 56.005 1.946 25293
1132 1 11 . 1 1 25 25 GLN CB C 25 28.195 28.195 28.711 -0.516 25293
1133 1 11 . 1 1 25 25 GLN H H 25 8.714 8.714 8.537 0.177 25293
1134 1 11 . 1 1 26 26 GLY CA C 26 45.249 45.249 44.777 0.472 25293
1135 1 11 . 1 1 26 26 GLY H H 26 8.810 8.810 8.592 0.218 25293
1136 1 11 . 1 1 27 27 CYS N N 27 117.687 117.687 119.534 -1.847 25293
1137 1 11 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.505 0.568 25293
1138 1 11 . 1 1 27 27 CYS CB C 27 49.941 49.941 28.951 20.991 25293
1139 1 11 . 1 1 27 27 CYS H H 27 7.697 7.697 8.026 -0.329 25293
1140 1 11 . 1 1 28 28 THR N N 28 115.298 115.298 116.376 -1.078 25293
1141 1 11 . 1 1 28 28 THR HA H 28 4.488 4.488 4.567 -0.079 25293
1142 1 11 . 1 1 28 28 THR CA C 28 60.019 60.019 61.712 -1.694 25293
1143 1 11 . 1 1 28 28 THR CB C 28 71.515 71.515 69.970 1.545 25293
1144 1 11 . 1 1 28 28 THR H H 28 9.354 9.354 8.458 0.896 25293
1145 1 12 . 1 1 2 2 TRP N N 2 124.464 124.464 125.964 -1.500 25293
1146 1 12 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.640 -0.619 25293
1147 1 12 . 1 1 2 2 TRP CA C 2 59.121 59.121 57.965 1.155 25293
1148 1 12 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.867 -0.178 25293
1149 1 12 . 1 1 2 2 TRP H H 2 8.268 8.268 7.481 0.787 25293
1150 1 12 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.253 0.198 25293
1151 1 12 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.280 1.935 25293
1152 1 12 . 1 1 3 3 PRO CB C 3 31.750 31.750 31.971 -0.221 25293
1153 1 12 . 1 1 4 4 ILE N N 4 126.955 126.955 119.018 7.937 25293
1154 1 12 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.736 0.450 25293
1155 1 12 . 1 1 4 4 ILE CA C 4 60.005 60.005 60.691 -0.686 25293
1156 1 12 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.552 -0.143 25293
1157 1 12 . 1 1 4 4 ILE H H 4 8.276 8.276 7.644 0.632 25293
1158 1 12 . 1 1 5 5 CYS N N 5 124.228 124.228 123.292 0.936 25293
1159 1 12 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.711 0.114 25293
1160 1 12 . 1 1 5 5 CYS CB C 5 43.781 43.781 30.222 13.559 25293
1161 1 12 . 1 1 5 5 CYS H H 5 7.650 7.650 8.276 -0.626 25293
1162 1 12 . 1 1 6 6 LYS N N 6 122.395 122.395 122.154 0.241 25293
1163 1 12 . 1 1 6 6 LYS HA H 6 4.938 4.938 4.983 -0.045 25293
1164 1 12 . 1 1 6 6 LYS H H 6 9.212 9.212 8.847 0.365 25293
1165 1 12 . 1 1 7 7 ARG N N 7 122.102 122.102 125.569 -3.467 25293
1166 1 12 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.293 0.418 25293
1167 1 12 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.806 1.915 25293
1168 1 12 . 1 1 7 7 ARG H H 7 8.700 8.700 8.611 0.089 25293
1169 1 12 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.804 -0.489 25293
1170 1 12 . 1 1 8 8 ASN CA C 8 54.388 54.388 53.011 1.377 25293
1171 1 12 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.605 -1.040 25293
1172 1 12 . 1 1 8 8 ASN H H 8 7.794 7.794 8.453 -0.659 25293
1173 1 12 . 1 1 9 9 GLY N N 9 101.289 101.289 106.527 -5.238 25293
1174 1 12 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.367 -0.103 25293
1175 1 12 . 1 1 9 9 GLY H H 9 8.652 8.652 8.490 0.162 25293
1176 1 12 . 1 1 10 10 LEU N N 10 120.783 120.783 118.549 2.234 25293
1177 1 12 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.731 0.324 25293
1178 1 12 . 1 1 10 10 LEU CA C 10 51.535 51.535 51.012 0.523 25293
1179 1 12 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.296 -1.236 25293
1180 1 12 . 1 1 10 10 LEU H H 10 7.791 7.791 7.673 0.118 25293
1181 1 12 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.458 0.599 25293
1182 1 12 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.858 -2.521 25293
1183 1 12 . 1 1 12 12 VAL N N 12 115.299 115.299 117.528 -2.229 25293
1184 1 12 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.416 0.185 25293
1185 1 12 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.410 -1.309 25293
1186 1 12 . 1 1 12 12 VAL H H 12 7.971 7.971 7.982 -0.011 25293
1187 1 12 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.699 -0.368 25293
1188 1 12 . 1 1 13 13 CYS CA C 13 59.105 59.105 58.525 0.580 25293
1189 1 12 . 1 1 13 13 CYS CB C 13 48.573 48.573 28.943 19.630 25293
1190 1 12 . 1 1 13 13 CYS H H 13 8.103 8.103 8.086 0.017 25293
1191 1 12 . 1 1 14 14 GLY CA C 14 46.469 46.469 46.155 0.314 25293
1192 1 12 . 1 1 14 14 GLY H H 14 8.433 8.433 8.718 -0.285 25293
1193 1 12 . 1 1 15 15 GLU N N 15 115.613 115.613 118.122 -2.509 25293
1194 1 12 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.552 0.115 25293
1195 1 12 . 1 1 15 15 GLU CB C 15 32.554 32.554 29.752 2.802 25293
1196 1 12 . 1 1 15 15 GLU H H 15 7.064 7.064 8.202 -1.138 25293
1197 1 12 . 1 1 16 16 THR N N 16 115.298 115.298 114.015 1.283 25293
1198 1 12 . 1 1 16 16 THR HA H 16 4.525 4.525 4.182 0.343 25293
1199 1 12 . 1 1 16 16 THR CB C 16 70.742 70.742 68.795 1.947 25293
1200 1 12 . 1 1 16 16 THR H H 16 8.413 8.413 7.972 0.441 25293
1201 1 12 . 1 1 17 17 CYS N N 17 115.927 115.927 123.947 -8.020 25293
1202 1 12 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.827 0.234 25293
1203 1 12 . 1 1 17 17 CYS CA C 17 62.598 62.598 56.832 5.766 25293
1204 1 12 . 1 1 17 17 CYS CB C 17 47.454 47.454 30.066 17.388 25293
1205 1 12 . 1 1 17 17 CYS H H 17 8.239 8.239 8.628 -0.389 25293
1206 1 12 . 1 1 18 18 THR N N 18 117.192 117.192 115.184 2.008 25293
1207 1 12 . 1 1 18 18 THR HA H 18 3.912 3.912 4.758 -0.846 25293
1208 1 12 . 1 1 18 18 THR CA C 18 65.404 65.404 64.235 1.169 25293
1209 1 12 . 1 1 18 18 THR H H 18 8.277 8.277 8.914 -0.637 25293
1210 1 12 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.771 -0.280 25293
1211 1 12 . 1 1 19 19 LEU CB C 19 40.963 40.963 42.133 -1.170 25293
1212 1 12 . 1 1 19 19 LEU H H 19 8.474 8.474 7.689 0.785 25293
1213 1 12 . 1 1 20 20 GLY N N 20 105.833 105.833 107.540 -1.707 25293
1214 1 12 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.060 0.899 25293
1215 1 12 . 1 1 20 20 GLY H H 20 8.123 8.123 8.248 -0.125 25293
1216 1 12 . 1 1 21 21 THR N N 21 111.926 111.926 111.651 0.275 25293
1217 1 12 . 1 1 21 21 THR HA H 21 4.653 4.653 4.375 0.278 25293
1218 1 12 . 1 1 21 21 THR CB C 21 68.777 68.777 69.814 -1.037 25293
1219 1 12 . 1 1 21 21 THR H H 21 7.658 7.658 7.564 0.094 25293
1220 1 12 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.417 0.224 25293
1221 1 12 . 1 1 22 22 CYS CB C 22 44.757 44.757 28.171 16.587 25293
1222 1 12 . 1 1 22 22 CYS H H 22 8.470 8.470 8.550 -0.080 25293
1223 1 12 . 1 1 23 23 SER N N 23 122.918 122.918 115.467 7.451 25293
1224 1 12 . 1 1 23 23 SER HA H 23 4.423 4.423 4.702 -0.279 25293
1225 1 12 . 1 1 23 23 SER CA C 23 59.914 59.914 58.494 1.420 25293
1226 1 12 . 1 1 23 23 SER CB C 23 64.597 64.597 63.431 1.166 25293
1227 1 12 . 1 1 23 23 SER H H 23 10.973 10.973 8.892 2.081 25293
1228 1 12 . 1 1 24 24 THR N N 24 124.108 124.108 115.098 9.010 25293
1229 1 12 . 1 1 24 24 THR HA H 24 3.979 3.979 4.394 -0.415 25293
1230 1 12 . 1 1 24 24 THR CA C 24 63.960 63.960 62.067 1.893 25293
1231 1 12 . 1 1 24 24 THR CB C 24 68.471 68.471 69.211 -0.740 25293
1232 1 12 . 1 1 24 24 THR H H 24 9.476 9.476 8.016 1.460 25293
1233 1 12 . 1 1 25 25 GLN N N 25 128.543 128.543 118.964 9.579 25293
1234 1 12 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.063 -0.138 25293
1235 1 12 . 1 1 25 25 GLN CA C 25 57.951 57.951 56.451 1.500 25293
1236 1 12 . 1 1 25 25 GLN CB C 25 28.195 28.195 28.296 -0.101 25293
1237 1 12 . 1 1 25 25 GLN H H 25 8.714 8.714 8.143 0.571 25293
1238 1 12 . 1 1 26 26 GLY CA C 26 45.249 45.249 44.804 0.445 25293
1239 1 12 . 1 1 26 26 GLY H H 26 8.810 8.810 8.398 0.412 25293
1240 1 12 . 1 1 27 27 CYS N N 27 117.687 117.687 120.480 -2.793 25293
1241 1 12 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.493 0.580 25293
1242 1 12 . 1 1 27 27 CYS CB C 27 49.941 49.941 27.691 22.250 25293
1243 1 12 . 1 1 27 27 CYS H H 27 7.697 7.697 8.200 -0.503 25293
1244 1 12 . 1 1 28 28 THR N N 28 115.298 115.298 117.812 -2.514 25293
1245 1 12 . 1 1 28 28 THR HA H 28 4.488 4.488 4.670 -0.182 25293
1246 1 12 . 1 1 28 28 THR CA C 28 60.019 60.019 61.290 -1.271 25293
1247 1 12 . 1 1 28 28 THR CB C 28 71.515 71.515 71.160 0.355 25293
1248 1 12 . 1 1 28 28 THR H H 28 9.354 9.354 8.849 0.505 25293
1249 1 13 . 1 1 2 2 TRP N N 2 124.464 124.464 126.890 -2.426 25293
1250 1 13 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.683 -0.662 25293
1251 1 13 . 1 1 2 2 TRP CA C 2 59.121 59.121 58.316 0.805 25293
1252 1 13 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.827 -0.138 25293
1253 1 13 . 1 1 2 2 TRP H H 2 8.268 8.268 7.584 0.684 25293
1254 1 13 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.274 0.177 25293
1255 1 13 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.304 1.911 25293
1256 1 13 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.057 -0.307 25293
1257 1 13 . 1 1 4 4 ILE N N 4 126.955 126.955 119.179 7.776 25293
1258 1 13 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.736 0.450 25293
1259 1 13 . 1 1 4 4 ILE CA C 4 60.005 60.005 61.372 -1.367 25293
1260 1 13 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.236 0.173 25293
1261 1 13 . 1 1 4 4 ILE H H 4 8.276 8.276 7.419 0.857 25293
1262 1 13 . 1 1 5 5 CYS N N 5 124.228 124.228 123.638 0.590 25293
1263 1 13 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.600 0.225 25293
1264 1 13 . 1 1 5 5 CYS CB C 5 43.781 43.781 29.674 14.107 25293
1265 1 13 . 1 1 5 5 CYS H H 5 7.650 7.650 8.132 -0.482 25293
1266 1 13 . 1 1 6 6 LYS N N 6 122.395 122.395 121.404 0.991 25293
1267 1 13 . 1 1 6 6 LYS HA H 6 4.938 4.938 4.962 -0.024 25293
1268 1 13 . 1 1 6 6 LYS H H 6 9.212 9.212 7.998 1.214 25293
1269 1 13 . 1 1 7 7 ARG N N 7 122.102 122.102 125.311 -3.209 25293
1270 1 13 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.052 0.659 25293
1271 1 13 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.953 1.768 25293
1272 1 13 . 1 1 7 7 ARG H H 7 8.700 8.700 8.273 0.427 25293
1273 1 13 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.757 -0.442 25293
1274 1 13 . 1 1 8 8 ASN CA C 8 54.388 54.388 53.007 1.381 25293
1275 1 13 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.044 -0.478 25293
1276 1 13 . 1 1 8 8 ASN H H 8 7.794 7.794 8.450 -0.656 25293
1277 1 13 . 1 1 9 9 GLY N N 9 101.289 101.289 106.262 -4.973 25293
1278 1 13 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.085 0.179 25293
1279 1 13 . 1 1 9 9 GLY H H 9 8.652 8.652 8.480 0.172 25293
1280 1 13 . 1 1 10 10 LEU N N 10 120.783 120.783 119.107 1.676 25293
1281 1 13 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.735 0.320 25293
1282 1 13 . 1 1 10 10 LEU CA C 10 51.535 51.535 50.887 0.648 25293
1283 1 13 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.085 -1.025 25293
1284 1 13 . 1 1 10 10 LEU H H 10 7.791 7.791 7.725 0.066 25293
1285 1 13 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.464 0.593 25293
1286 1 13 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.788 -2.451 25293
1287 1 13 . 1 1 12 12 VAL N N 12 115.299 115.299 117.011 -1.712 25293
1288 1 13 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.246 0.355 25293
1289 1 13 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.498 -1.397 25293
1290 1 13 . 1 1 12 12 VAL H H 12 7.971 7.971 8.247 -0.276 25293
1291 1 13 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.512 -0.181 25293
1292 1 13 . 1 1 13 13 CYS CA C 13 59.105 59.105 58.971 0.134 25293
1293 1 13 . 1 1 13 13 CYS CB C 13 48.573 48.573 27.541 21.032 25293
1294 1 13 . 1 1 13 13 CYS H H 13 8.103 8.103 7.950 0.153 25293
1295 1 13 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.966 0.503 25293
1296 1 13 . 1 1 14 14 GLY H H 14 8.433 8.433 8.611 -0.178 25293
1297 1 13 . 1 1 15 15 GLU N N 15 115.613 115.613 116.958 -1.345 25293
1298 1 13 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.619 0.048 25293
1299 1 13 . 1 1 15 15 GLU CB C 15 32.554 32.554 33.038 -0.485 25293
1300 1 13 . 1 1 15 15 GLU H H 15 7.064 7.064 7.926 -0.862 25293
1301 1 13 . 1 1 16 16 THR N N 16 115.298 115.298 112.235 3.063 25293
1302 1 13 . 1 1 16 16 THR HA H 16 4.525 4.525 4.796 -0.271 25293
1303 1 13 . 1 1 16 16 THR CB C 16 70.742 70.742 69.453 1.289 25293
1304 1 13 . 1 1 16 16 THR H H 16 8.413 8.413 7.994 0.419 25293
1305 1 13 . 1 1 17 17 CYS N N 17 115.927 115.927 124.550 -8.623 25293
1306 1 13 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.768 0.293 25293
1307 1 13 . 1 1 17 17 CYS CA C 17 62.598 62.598 57.324 5.274 25293
1308 1 13 . 1 1 17 17 CYS CB C 17 47.454 47.454 28.839 18.615 25293
1309 1 13 . 1 1 17 17 CYS H H 17 8.239 8.239 8.401 -0.162 25293
1310 1 13 . 1 1 18 18 THR N N 18 117.192 117.192 115.756 1.436 25293
1311 1 13 . 1 1 18 18 THR HA H 18 3.912 3.912 4.789 -0.877 25293
1312 1 13 . 1 1 18 18 THR CA C 18 65.404 65.404 63.296 2.108 25293
1313 1 13 . 1 1 18 18 THR H H 18 8.277 8.277 8.764 -0.487 25293
1314 1 13 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.948 -0.457 25293
1315 1 13 . 1 1 19 19 LEU CB C 19 40.963 40.963 41.999 -1.036 25293
1316 1 13 . 1 1 19 19 LEU H H 19 8.474 8.474 7.753 0.721 25293
1317 1 13 . 1 1 20 20 GLY N N 20 105.833 105.833 108.111 -2.278 25293
1318 1 13 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.554 0.404 25293
1319 1 13 . 1 1 20 20 GLY H H 20 8.123 8.123 8.410 -0.287 25293
1320 1 13 . 1 1 21 21 THR N N 21 111.926 111.926 110.876 1.050 25293
1321 1 13 . 1 1 21 21 THR HA H 21 4.653 4.653 4.387 0.266 25293
1322 1 13 . 1 1 21 21 THR CB C 21 68.777 68.777 70.018 -1.241 25293
1323 1 13 . 1 1 21 21 THR H H 21 7.658 7.658 7.605 0.053 25293
1324 1 13 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.574 0.067 25293
1325 1 13 . 1 1 22 22 CYS CB C 22 44.757 44.757 27.885 16.872 25293
1326 1 13 . 1 1 22 22 CYS H H 22 8.470 8.470 8.805 -0.335 25293
1327 1 13 . 1 1 23 23 SER N N 23 122.918 122.918 117.995 4.923 25293
1328 1 13 . 1 1 23 23 SER HA H 23 4.423 4.423 4.325 0.098 25293
1329 1 13 . 1 1 23 23 SER CA C 23 59.914 59.914 60.352 -0.438 25293
1330 1 13 . 1 1 23 23 SER CB C 23 64.597 64.597 63.637 0.960 25293
1331 1 13 . 1 1 23 23 SER H H 23 10.973 10.973 8.732 2.241 25293
1332 1 13 . 1 1 24 24 THR N N 24 124.108 124.108 115.646 8.462 25293
1333 1 13 . 1 1 24 24 THR HA H 24 3.979 3.979 4.426 -0.447 25293
1334 1 13 . 1 1 24 24 THR CA C 24 63.960 63.960 61.636 2.324 25293
1335 1 13 . 1 1 24 24 THR CB C 24 68.471 68.471 69.596 -1.125 25293
1336 1 13 . 1 1 24 24 THR H H 24 9.476 9.476 7.714 1.762 25293
1337 1 13 . 1 1 25 25 GLN N N 25 128.543 128.543 122.999 5.544 25293
1338 1 13 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.557 -0.632 25293
1339 1 13 . 1 1 25 25 GLN CA C 25 57.951 57.951 55.712 2.239 25293
1340 1 13 . 1 1 25 25 GLN CB C 25 28.195 28.195 28.673 -0.478 25293
1341 1 13 . 1 1 25 25 GLN H H 25 8.714 8.714 8.659 0.055 25293
1342 1 13 . 1 1 26 26 GLY CA C 26 45.249 45.249 45.103 0.145 25293
1343 1 13 . 1 1 26 26 GLY H H 26 8.810 8.810 8.326 0.484 25293
1344 1 13 . 1 1 27 27 CYS N N 27 117.687 117.687 117.458 0.229 25293
1345 1 13 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.722 0.351 25293
1346 1 13 . 1 1 27 27 CYS CB C 27 49.941 49.941 30.956 18.985 25293
1347 1 13 . 1 1 27 27 CYS H H 27 7.697 7.697 7.969 -0.272 25293
1348 1 13 . 1 1 28 28 THR N N 28 115.298 115.298 116.091 -0.793 25293
1349 1 13 . 1 1 28 28 THR HA H 28 4.488 4.488 4.567 -0.079 25293
1350 1 13 . 1 1 28 28 THR CA C 28 60.019 60.019 61.786 -1.767 25293
1351 1 13 . 1 1 28 28 THR CB C 28 71.515 71.515 70.224 1.291 25293
1352 1 13 . 1 1 28 28 THR H H 28 9.354 9.354 8.375 0.979 25293
1353 1 14 . 1 1 2 2 TRP N N 2 124.464 124.464 126.816 -2.352 25293
1354 1 14 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.669 -0.648 25293
1355 1 14 . 1 1 2 2 TRP CA C 2 59.121 59.121 57.921 1.200 25293
1356 1 14 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.882 -0.193 25293
1357 1 14 . 1 1 2 2 TRP H H 2 8.268 8.268 7.549 0.719 25293
1358 1 14 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.275 0.176 25293
1359 1 14 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.306 1.909 25293
1360 1 14 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.039 -0.290 25293
1361 1 14 . 1 1 4 4 ILE N N 4 126.955 126.955 119.218 7.737 25293
1362 1 14 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.862 0.324 25293
1363 1 14 . 1 1 4 4 ILE CA C 4 60.005 60.005 61.363 -1.358 25293
1364 1 14 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.239 0.170 25293
1365 1 14 . 1 1 4 4 ILE H H 4 8.276 8.276 7.432 0.844 25293
1366 1 14 . 1 1 5 5 CYS N N 5 124.228 124.228 123.618 0.610 25293
1367 1 14 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.553 0.272 25293
1368 1 14 . 1 1 5 5 CYS CB C 5 43.781 43.781 30.227 13.554 25293
1369 1 14 . 1 1 5 5 CYS H H 5 7.650 7.650 8.284 -0.634 25293
1370 1 14 . 1 1 6 6 LYS N N 6 122.395 122.395 121.883 0.512 25293
1371 1 14 . 1 1 6 6 LYS HA H 6 4.938 4.938 4.802 0.136 25293
1372 1 14 . 1 1 6 6 LYS H H 6 9.212 9.212 8.052 1.160 25293
1373 1 14 . 1 1 7 7 ARG N N 7 122.102 122.102 124.488 -2.386 25293
1374 1 14 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.205 0.506 25293
1375 1 14 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.456 2.265 25293
1376 1 14 . 1 1 7 7 ARG H H 7 8.700 8.700 8.769 -0.069 25293
1377 1 14 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.750 -0.435 25293
1378 1 14 . 1 1 8 8 ASN CA C 8 54.388 54.388 53.336 1.052 25293
1379 1 14 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.359 -0.794 25293
1380 1 14 . 1 1 8 8 ASN H H 8 7.794 7.794 8.579 -0.785 25293
1381 1 14 . 1 1 9 9 GLY N N 9 101.289 101.289 106.222 -4.933 25293
1382 1 14 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.348 -0.084 25293
1383 1 14 . 1 1 9 9 GLY H H 9 8.652 8.652 8.444 0.208 25293
1384 1 14 . 1 1 10 10 LEU N N 10 120.783 120.783 118.505 2.278 25293
1385 1 14 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.713 0.342 25293
1386 1 14 . 1 1 10 10 LEU CA C 10 51.535 51.535 50.999 0.536 25293
1387 1 14 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.107 -1.047 25293
1388 1 14 . 1 1 10 10 LEU H H 10 7.791 7.791 7.671 0.120 25293
1389 1 14 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.469 0.588 25293
1390 1 14 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.777 -2.440 25293
1391 1 14 . 1 1 12 12 VAL N N 12 115.299 115.299 118.109 -2.810 25293
1392 1 14 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.240 0.361 25293
1393 1 14 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.656 -1.555 25293
1394 1 14 . 1 1 12 12 VAL H H 12 7.971 7.971 8.034 -0.063 25293
1395 1 14 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.478 -0.147 25293
1396 1 14 . 1 1 13 13 CYS CA C 13 59.105 59.105 59.409 -0.304 25293
1397 1 14 . 1 1 13 13 CYS CB C 13 48.573 48.573 26.835 21.738 25293
1398 1 14 . 1 1 13 13 CYS H H 13 8.103 8.103 7.985 0.118 25293
1399 1 14 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.876 0.593 25293
1400 1 14 . 1 1 14 14 GLY H H 14 8.433 8.433 8.657 -0.224 25293
1401 1 14 . 1 1 15 15 GLU N N 15 115.613 115.613 116.625 -1.012 25293
1402 1 14 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.634 0.033 25293
1403 1 14 . 1 1 15 15 GLU CB C 15 32.554 32.554 32.834 -0.280 25293
1404 1 14 . 1 1 15 15 GLU H H 15 7.064 7.064 7.881 -0.817 25293
1405 1 14 . 1 1 16 16 THR N N 16 115.298 115.298 112.587 2.711 25293
1406 1 14 . 1 1 16 16 THR HA H 16 4.525 4.525 4.810 -0.285 25293
1407 1 14 . 1 1 16 16 THR CB C 16 70.742 70.742 69.679 1.063 25293
1408 1 14 . 1 1 16 16 THR H H 16 8.413 8.413 8.009 0.404 25293
1409 1 14 . 1 1 17 17 CYS N N 17 115.927 115.927 124.235 -8.308 25293
1410 1 14 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.759 0.302 25293
1411 1 14 . 1 1 17 17 CYS CA C 17 62.598 62.598 57.510 5.088 25293
1412 1 14 . 1 1 17 17 CYS CB C 17 47.454 47.454 29.131 18.323 25293
1413 1 14 . 1 1 17 17 CYS H H 17 8.239 8.239 8.556 -0.317 25293
1414 1 14 . 1 1 18 18 THR N N 18 117.192 117.192 115.889 1.303 25293
1415 1 14 . 1 1 18 18 THR HA H 18 3.912 3.912 4.784 -0.872 25293
1416 1 14 . 1 1 18 18 THR CA C 18 65.404 65.404 63.143 2.261 25293
1417 1 14 . 1 1 18 18 THR H H 18 8.277 8.277 8.874 -0.597 25293
1418 1 14 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.866 -0.375 25293
1419 1 14 . 1 1 19 19 LEU CB C 19 40.963 40.963 42.024 -1.061 25293
1420 1 14 . 1 1 19 19 LEU H H 19 8.474 8.474 7.675 0.799 25293
1421 1 14 . 1 1 20 20 GLY N N 20 105.833 105.833 108.599 -2.766 25293
1422 1 14 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.777 0.182 25293
1423 1 14 . 1 1 20 20 GLY H H 20 8.123 8.123 8.393 -0.270 25293
1424 1 14 . 1 1 21 21 THR N N 21 111.926 111.926 112.383 -0.457 25293
1425 1 14 . 1 1 21 21 THR HA H 21 4.653 4.653 4.421 0.232 25293
1426 1 14 . 1 1 21 21 THR CB C 21 68.777 68.777 69.890 -1.113 25293
1427 1 14 . 1 1 21 21 THR H H 21 7.658 7.658 7.609 0.049 25293
1428 1 14 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.346 0.295 25293
1429 1 14 . 1 1 22 22 CYS CB C 22 44.757 44.757 27.939 16.819 25293
1430 1 14 . 1 1 22 22 CYS H H 22 8.470 8.470 8.721 -0.251 25293
1431 1 14 . 1 1 23 23 SER N N 23 122.918 122.918 115.432 7.486 25293
1432 1 14 . 1 1 23 23 SER HA H 23 4.423 4.423 4.713 -0.290 25293
1433 1 14 . 1 1 23 23 SER CA C 23 59.914 59.914 58.669 1.245 25293
1434 1 14 . 1 1 23 23 SER CB C 23 64.597 64.597 63.665 0.932 25293
1435 1 14 . 1 1 23 23 SER H H 23 10.973 10.973 8.948 2.025 25293
1436 1 14 . 1 1 24 24 THR N N 24 124.108 124.108 115.610 8.498 25293
1437 1 14 . 1 1 24 24 THR HA H 24 3.979 3.979 4.446 -0.467 25293
1438 1 14 . 1 1 24 24 THR CA C 24 63.960 63.960 61.210 2.750 25293
1439 1 14 . 1 1 24 24 THR CB C 24 68.471 68.471 69.147 -0.676 25293
1440 1 14 . 1 1 24 24 THR H H 24 9.476 9.476 7.947 1.529 25293
1441 1 14 . 1 1 25 25 GLN N N 25 128.543 128.543 119.776 8.767 25293
1442 1 14 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.082 -0.157 25293
1443 1 14 . 1 1 25 25 GLN CA C 25 57.951 57.951 56.775 1.176 25293
1444 1 14 . 1 1 25 25 GLN CB C 25 28.195 28.195 27.342 0.853 25293
1445 1 14 . 1 1 25 25 GLN H H 25 8.714 8.714 8.237 0.477 25293
1446 1 14 . 1 1 26 26 GLY CA C 26 45.249 45.249 44.932 0.317 25293
1447 1 14 . 1 1 26 26 GLY H H 26 8.810 8.810 8.464 0.346 25293
1448 1 14 . 1 1 27 27 CYS N N 27 117.687 117.687 120.342 -2.655 25293
1449 1 14 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.491 0.582 25293
1450 1 14 . 1 1 27 27 CYS CB C 27 49.941 49.941 28.422 21.519 25293
1451 1 14 . 1 1 27 27 CYS H H 27 7.697 7.697 8.165 -0.468 25293
1452 1 14 . 1 1 28 28 THR N N 28 115.298 115.298 117.617 -2.319 25293
1453 1 14 . 1 1 28 28 THR HA H 28 4.488 4.488 4.605 -0.117 25293
1454 1 14 . 1 1 28 28 THR CA C 28 60.019 60.019 61.429 -1.410 25293
1455 1 14 . 1 1 28 28 THR CB C 28 71.515 71.515 69.692 1.823 25293
1456 1 14 . 1 1 28 28 THR H H 28 9.354 9.354 8.489 0.865 25293
1457 1 15 . 1 1 2 2 TRP N N 2 124.464 124.464 126.316 -1.852 25293
1458 1 15 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.680 -0.659 25293
1459 1 15 . 1 1 2 2 TRP CA C 2 59.121 59.121 58.195 0.926 25293
1460 1 15 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.845 -0.156 25293
1461 1 15 . 1 1 2 2 TRP H H 2 8.268 8.268 7.564 0.704 25293
1462 1 15 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.270 0.181 25293
1463 1 15 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.279 1.936 25293
1464 1 15 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.070 -0.320 25293
1465 1 15 . 1 1 4 4 ILE N N 4 126.955 126.955 118.952 8.003 25293
1466 1 15 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.722 0.464 25293
1467 1 15 . 1 1 4 4 ILE CA C 4 60.005 60.005 60.831 -0.826 25293
1468 1 15 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.559 -0.150 25293
1469 1 15 . 1 1 4 4 ILE H H 4 8.276 8.276 7.539 0.737 25293
1470 1 15 . 1 1 5 5 CYS N N 5 124.228 124.228 123.198 1.030 25293
1471 1 15 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.612 0.213 25293
1472 1 15 . 1 1 5 5 CYS CB C 5 43.781 43.781 29.416 14.365 25293
1473 1 15 . 1 1 5 5 CYS H H 5 7.650 7.650 8.280 -0.630 25293
1474 1 15 . 1 1 6 6 LYS N N 6 122.395 122.395 123.720 -1.325 25293
1475 1 15 . 1 1 6 6 LYS HA H 6 4.938 4.938 5.008 -0.070 25293
1476 1 15 . 1 1 6 6 LYS H H 6 9.212 9.212 8.823 0.389 25293
1477 1 15 . 1 1 7 7 ARG N N 7 122.102 122.102 125.239 -3.137 25293
1478 1 15 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.227 0.484 25293
1479 1 15 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.783 1.938 25293
1480 1 15 . 1 1 7 7 ARG H H 7 8.700 8.700 8.596 0.104 25293
1481 1 15 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.760 -0.445 25293
1482 1 15 . 1 1 8 8 ASN CA C 8 54.388 54.388 53.278 1.110 25293
1483 1 15 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.349 -0.784 25293
1484 1 15 . 1 1 8 8 ASN H H 8 7.794 7.794 8.536 -0.742 25293
1485 1 15 . 1 1 9 9 GLY N N 9 101.289 101.289 106.495 -5.206 25293
1486 1 15 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.311 -0.047 25293
1487 1 15 . 1 1 9 9 GLY H H 9 8.652 8.652 8.526 0.126 25293
1488 1 15 . 1 1 10 10 LEU N N 10 120.783 120.783 118.377 2.406 25293
1489 1 15 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.710 0.345 25293
1490 1 15 . 1 1 10 10 LEU CA C 10 51.535 51.535 51.025 0.510 25293
1491 1 15 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.058 -0.998 25293
1492 1 15 . 1 1 10 10 LEU H H 10 7.791 7.791 7.666 0.125 25293
1493 1 15 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.431 0.626 25293
1494 1 15 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.598 -2.261 25293
1495 1 15 . 1 1 12 12 VAL N N 12 115.299 115.299 116.591 -1.292 25293
1496 1 15 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.366 0.235 25293
1497 1 15 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.565 -1.464 25293
1498 1 15 . 1 1 12 12 VAL H H 12 7.971 7.971 8.290 -0.319 25293
1499 1 15 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.750 -0.419 25293
1500 1 15 . 1 1 13 13 CYS CA C 13 59.105 59.105 58.584 0.520 25293
1501 1 15 . 1 1 13 13 CYS CB C 13 48.573 48.573 29.123 19.450 25293
1502 1 15 . 1 1 13 13 CYS H H 13 8.103 8.103 8.000 0.103 25293
1503 1 15 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.923 0.546 25293
1504 1 15 . 1 1 14 14 GLY H H 14 8.433 8.433 8.774 -0.341 25293
1505 1 15 . 1 1 15 15 GLU N N 15 115.613 115.613 117.920 -2.307 25293
1506 1 15 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.534 0.133 25293
1507 1 15 . 1 1 15 15 GLU CB C 15 32.554 32.554 29.720 2.834 25293
1508 1 15 . 1 1 15 15 GLU H H 15 7.064 7.064 8.086 -1.022 25293
1509 1 15 . 1 1 16 16 THR N N 16 115.298 115.298 113.803 1.495 25293
1510 1 15 . 1 1 16 16 THR HA H 16 4.525 4.525 4.212 0.313 25293
1511 1 15 . 1 1 16 16 THR CB C 16 70.742 70.742 68.575 2.167 25293
1512 1 15 . 1 1 16 16 THR H H 16 8.413 8.413 7.995 0.418 25293
1513 1 15 . 1 1 17 17 CYS N N 17 115.927 115.927 124.928 -9.001 25293
1514 1 15 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.606 0.455 25293
1515 1 15 . 1 1 17 17 CYS CA C 17 62.598 62.598 57.202 5.396 25293
1516 1 15 . 1 1 17 17 CYS CB C 17 47.454 47.454 28.863 18.591 25293
1517 1 15 . 1 1 17 17 CYS H H 17 8.239 8.239 8.287 -0.048 25293
1518 1 15 . 1 1 18 18 THR N N 18 117.192 117.192 115.007 2.185 25293
1519 1 15 . 1 1 18 18 THR HA H 18 3.912 3.912 4.804 -0.892 25293
1520 1 15 . 1 1 18 18 THR CA C 18 65.404 65.404 62.759 2.645 25293
1521 1 15 . 1 1 18 18 THR H H 18 8.277 8.277 8.903 -0.626 25293
1522 1 15 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.892 -0.401 25293
1523 1 15 . 1 1 19 19 LEU CB C 19 40.963 40.963 41.969 -1.006 25293
1524 1 15 . 1 1 19 19 LEU H H 19 8.474 8.474 7.865 0.609 25293
1525 1 15 . 1 1 20 20 GLY N N 20 105.833 105.833 107.832 -1.999 25293
1526 1 15 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.689 0.270 25293
1527 1 15 . 1 1 20 20 GLY H H 20 8.123 8.123 8.414 -0.291 25293
1528 1 15 . 1 1 21 21 THR N N 21 111.926 111.926 111.597 0.329 25293
1529 1 15 . 1 1 21 21 THR HA H 21 4.653 4.653 4.411 0.242 25293
1530 1 15 . 1 1 21 21 THR CB C 21 68.777 68.777 70.308 -1.531 25293
1531 1 15 . 1 1 21 21 THR H H 21 7.658 7.658 7.522 0.136 25293
1532 1 15 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.580 0.061 25293
1533 1 15 . 1 1 22 22 CYS CB C 22 44.757 44.757 27.522 17.235 25293
1534 1 15 . 1 1 22 22 CYS H H 22 8.470 8.470 8.836 -0.366 25293
1535 1 15 . 1 1 23 23 SER N N 23 122.918 122.918 119.247 3.671 25293
1536 1 15 . 1 1 23 23 SER HA H 23 4.423 4.423 4.306 0.117 25293
1537 1 15 . 1 1 23 23 SER CA C 23 59.914 59.914 60.166 -0.252 25293
1538 1 15 . 1 1 23 23 SER CB C 23 64.597 64.597 63.460 1.137 25293
1539 1 15 . 1 1 23 23 SER H H 23 10.973 10.973 8.689 2.284 25293
1540 1 15 . 1 1 24 24 THR N N 24 124.108 124.108 115.013 9.095 25293
1541 1 15 . 1 1 24 24 THR HA H 24 3.979 3.979 4.396 -0.417 25293
1542 1 15 . 1 1 24 24 THR CA C 24 63.960 63.960 61.442 2.518 25293
1543 1 15 . 1 1 24 24 THR CB C 24 68.471 68.471 69.767 -1.296 25293
1544 1 15 . 1 1 24 24 THR H H 24 9.476 9.476 7.665 1.811 25293
1545 1 15 . 1 1 25 25 GLN N N 25 128.543 128.543 122.717 5.826 25293
1546 1 15 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.452 -0.527 25293
1547 1 15 . 1 1 25 25 GLN CA C 25 57.951 57.951 56.069 1.882 25293
1548 1 15 . 1 1 25 25 GLN CB C 25 28.195 28.195 27.500 0.695 25293
1549 1 15 . 1 1 25 25 GLN H H 25 8.714 8.714 8.658 0.056 25293
1550 1 15 . 1 1 26 26 GLY CA C 26 45.249 45.249 45.521 -0.272 25293
1551 1 15 . 1 1 26 26 GLY H H 26 8.810 8.810 8.268 0.542 25293
1552 1 15 . 1 1 27 27 CYS N N 27 117.687 117.687 120.159 -2.472 25293
1553 1 15 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.471 0.602 25293
1554 1 15 . 1 1 27 27 CYS CB C 27 49.941 49.941 28.216 21.725 25293
1555 1 15 . 1 1 27 27 CYS H H 27 7.697 7.697 8.110 -0.413 25293
1556 1 15 . 1 1 28 28 THR N N 28 115.298 115.298 114.727 0.571 25293
1557 1 15 . 1 1 28 28 THR HA H 28 4.488 4.488 4.658 -0.170 25293
1558 1 15 . 1 1 28 28 THR CA C 28 60.019 60.019 60.851 -0.832 25293
1559 1 15 . 1 1 28 28 THR CB C 28 71.515 71.515 70.782 0.733 25293
1560 1 15 . 1 1 28 28 THR H H 28 9.354 9.354 8.434 0.920 25293
1561 1 16 . 1 1 2 2 TRP N N 2 124.464 124.464 125.889 -1.425 25293
1562 1 16 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.658 -0.637 25293
1563 1 16 . 1 1 2 2 TRP CA C 2 59.121 59.121 57.880 1.241 25293
1564 1 16 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.858 -0.169 25293
1565 1 16 . 1 1 2 2 TRP H H 2 8.268 8.268 7.497 0.771 25293
1566 1 16 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.260 0.191 25293
1567 1 16 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.263 1.952 25293
1568 1 16 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.044 -0.294 25293
1569 1 16 . 1 1 4 4 ILE N N 4 126.955 126.955 118.842 8.113 25293
1570 1 16 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.725 0.461 25293
1571 1 16 . 1 1 4 4 ILE CA C 4 60.005 60.005 60.865 -0.861 25293
1572 1 16 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.565 -0.156 25293
1573 1 16 . 1 1 4 4 ILE H H 4 8.276 8.276 7.582 0.694 25293
1574 1 16 . 1 1 5 5 CYS N N 5 124.228 124.228 123.038 1.190 25293
1575 1 16 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.754 0.071 25293
1576 1 16 . 1 1 5 5 CYS CB C 5 43.781 43.781 30.020 13.761 25293
1577 1 16 . 1 1 5 5 CYS H H 5 7.650 7.650 8.279 -0.629 25293
1578 1 16 . 1 1 6 6 LYS N N 6 122.395 122.395 122.853 -0.458 25293
1579 1 16 . 1 1 6 6 LYS HA H 6 4.938 4.938 5.039 -0.101 25293
1580 1 16 . 1 1 6 6 LYS H H 6 9.212 9.212 8.866 0.346 25293
1581 1 16 . 1 1 7 7 ARG N N 7 122.102 122.102 125.308 -3.206 25293
1582 1 16 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.232 0.479 25293
1583 1 16 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.657 2.064 25293
1584 1 16 . 1 1 7 7 ARG H H 7 8.700 8.700 8.858 -0.158 25293
1585 1 16 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.878 -0.563 25293
1586 1 16 . 1 1 8 8 ASN CA C 8 54.388 54.388 52.911 1.477 25293
1587 1 16 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.795 -1.230 25293
1588 1 16 . 1 1 8 8 ASN H H 8 7.794 7.794 8.426 -0.632 25293
1589 1 16 . 1 1 9 9 GLY N N 9 101.289 101.289 106.640 -5.351 25293
1590 1 16 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.230 0.034 25293
1591 1 16 . 1 1 9 9 GLY H H 9 8.652 8.652 8.525 0.127 25293
1592 1 16 . 1 1 10 10 LEU N N 10 120.783 120.783 118.335 2.448 25293
1593 1 16 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.695 0.360 25293
1594 1 16 . 1 1 10 10 LEU CA C 10 51.535 51.535 51.156 0.379 25293
1595 1 16 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.379 -1.319 25293
1596 1 16 . 1 1 10 10 LEU H H 10 7.791 7.791 7.693 0.098 25293
1597 1 16 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.487 0.570 25293
1598 1 16 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.820 -2.483 25293
1599 1 16 . 1 1 12 12 VAL N N 12 115.299 115.299 118.146 -2.847 25293
1600 1 16 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.253 0.348 25293
1601 1 16 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.612 -1.511 25293
1602 1 16 . 1 1 12 12 VAL H H 12 7.971 7.971 8.027 -0.056 25293
1603 1 16 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.443 -0.112 25293
1604 1 16 . 1 1 13 13 CYS CA C 13 59.105 59.105 59.909 -0.804 25293
1605 1 16 . 1 1 13 13 CYS CB C 13 48.573 48.573 26.715 21.858 25293
1606 1 16 . 1 1 13 13 CYS H H 13 8.103 8.103 7.940 0.163 25293
1607 1 16 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.700 0.769 25293
1608 1 16 . 1 1 14 14 GLY H H 14 8.433 8.433 8.837 -0.404 25293
1609 1 16 . 1 1 15 15 GLU N N 15 115.613 115.613 117.659 -2.046 25293
1610 1 16 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.535 0.132 25293
1611 1 16 . 1 1 15 15 GLU CB C 15 32.554 32.554 29.494 3.060 25293
1612 1 16 . 1 1 15 15 GLU H H 15 7.064 7.064 7.959 -0.895 25293
1613 1 16 . 1 1 16 16 THR N N 16 115.298 115.298 113.825 1.473 25293
1614 1 16 . 1 1 16 16 THR HA H 16 4.525 4.525 4.204 0.321 25293
1615 1 16 . 1 1 16 16 THR CB C 16 70.742 70.742 68.704 2.038 25293
1616 1 16 . 1 1 16 16 THR H H 16 8.413 8.413 8.091 0.322 25293
1617 1 16 . 1 1 17 17 CYS N N 17 115.927 115.927 123.859 -7.932 25293
1618 1 16 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.659 0.402 25293
1619 1 16 . 1 1 17 17 CYS CA C 17 62.598 62.598 57.354 5.244 25293
1620 1 16 . 1 1 17 17 CYS CB C 17 47.454 47.454 28.979 18.476 25293
1621 1 16 . 1 1 17 17 CYS H H 17 8.239 8.239 8.341 -0.102 25293
1622 1 16 . 1 1 18 18 THR N N 18 117.192 117.192 114.927 2.265 25293
1623 1 16 . 1 1 18 18 THR HA H 18 3.912 3.912 4.779 -0.867 25293
1624 1 16 . 1 1 18 18 THR CA C 18 65.404 65.404 62.907 2.497 25293
1625 1 16 . 1 1 18 18 THR H H 18 8.277 8.277 8.926 -0.649 25293
1626 1 16 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.859 -0.368 25293
1627 1 16 . 1 1 19 19 LEU CB C 19 40.963 40.963 41.833 -0.870 25293
1628 1 16 . 1 1 19 19 LEU H H 19 8.474 8.474 7.861 0.613 25293
1629 1 16 . 1 1 20 20 GLY N N 20 105.833 105.833 108.015 -2.182 25293
1630 1 16 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.718 0.241 25293
1631 1 16 . 1 1 20 20 GLY H H 20 8.123 8.123 8.438 -0.316 25293
1632 1 16 . 1 1 21 21 THR N N 21 111.926 111.926 111.659 0.267 25293
1633 1 16 . 1 1 21 21 THR HA H 21 4.653 4.653 4.407 0.246 25293
1634 1 16 . 1 1 21 21 THR CB C 21 68.777 68.777 70.121 -1.343 25293
1635 1 16 . 1 1 21 21 THR H H 21 7.658 7.658 7.558 0.100 25293
1636 1 16 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.580 0.061 25293
1637 1 16 . 1 1 22 22 CYS CB C 22 44.757 44.757 27.777 16.980 25293
1638 1 16 . 1 1 22 22 CYS H H 22 8.470 8.470 8.683 -0.213 25293
1639 1 16 . 1 1 23 23 SER N N 23 122.918 122.918 118.483 4.435 25293
1640 1 16 . 1 1 23 23 SER HA H 23 4.423 4.423 4.407 0.016 25293
1641 1 16 . 1 1 23 23 SER CA C 23 59.914 59.914 60.877 -0.962 25293
1642 1 16 . 1 1 23 23 SER CB C 23 64.597 64.597 63.719 0.878 25293
1643 1 16 . 1 1 23 23 SER H H 23 10.973 10.973 8.679 2.294 25293
1644 1 16 . 1 1 24 24 THR N N 24 124.108 124.108 115.719 8.389 25293
1645 1 16 . 1 1 24 24 THR HA H 24 3.979 3.979 4.296 -0.317 25293
1646 1 16 . 1 1 24 24 THR CA C 24 63.960 63.960 61.815 2.145 25293
1647 1 16 . 1 1 24 24 THR CB C 24 68.471 68.471 69.653 -1.182 25293
1648 1 16 . 1 1 24 24 THR H H 24 9.476 9.476 8.383 1.093 25293
1649 1 16 . 1 1 25 25 GLN N N 25 128.543 128.543 121.536 7.007 25293
1650 1 16 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.451 -0.526 25293
1651 1 16 . 1 1 25 25 GLN CA C 25 57.951 57.951 55.560 2.391 25293
1652 1 16 . 1 1 25 25 GLN CB C 25 28.195 28.195 27.662 0.533 25293
1653 1 16 . 1 1 25 25 GLN H H 25 8.714 8.714 8.498 0.216 25293
1654 1 16 . 1 1 26 26 GLY CA C 26 45.249 45.249 45.003 0.246 25293
1655 1 16 . 1 1 26 26 GLY H H 26 8.810 8.810 8.394 0.416 25293
1656 1 16 . 1 1 27 27 CYS N N 27 117.687 117.687 120.324 -2.637 25293
1657 1 16 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.400 0.673 25293
1658 1 16 . 1 1 27 27 CYS CB C 27 49.941 49.941 27.317 22.624 25293
1659 1 16 . 1 1 27 27 CYS H H 27 7.697 7.697 8.213 -0.516 25293
1660 1 16 . 1 1 28 28 THR N N 28 115.298 115.298 114.009 1.289 25293
1661 1 16 . 1 1 28 28 THR HA H 28 4.488 4.488 4.589 -0.101 25293
1662 1 16 . 1 1 28 28 THR CA C 28 60.019 60.019 61.315 -1.296 25293
1663 1 16 . 1 1 28 28 THR CB C 28 71.515 71.515 70.943 0.572 25293
1664 1 16 . 1 1 28 28 THR H H 28 9.354 9.354 8.409 0.945 25293
1665 1 17 . 1 1 2 2 TRP N N 2 124.464 124.464 123.344 1.120 25293
1666 1 17 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.464 -0.443 25293
1667 1 17 . 1 1 2 2 TRP CA C 2 59.121 59.121 58.355 0.766 25293
1668 1 17 . 1 1 2 2 TRP CB C 2 29.689 29.689 28.741 0.948 25293
1669 1 17 . 1 1 2 2 TRP H H 2 8.268 8.268 8.182 0.086 25293
1670 1 17 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.344 0.107 25293
1671 1 17 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.222 1.993 25293
1672 1 17 . 1 1 3 3 PRO CB C 3 31.750 31.750 31.978 -0.228 25293
1673 1 17 . 1 1 4 4 ILE N N 4 126.955 126.955 117.773 9.182 25293
1674 1 17 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.946 0.240 25293
1675 1 17 . 1 1 4 4 ILE CA C 4 60.005 60.005 60.287 -0.282 25293
1676 1 17 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.791 -0.382 25293
1677 1 17 . 1 1 4 4 ILE H H 4 8.276 8.276 7.233 1.043 25293
1678 1 17 . 1 1 5 5 CYS N N 5 124.228 124.228 125.124 -0.896 25293
1679 1 17 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.944 -0.119 25293
1680 1 17 . 1 1 5 5 CYS CB C 5 43.781 43.781 29.084 14.697 25293
1681 1 17 . 1 1 5 5 CYS H H 5 7.650 7.650 8.225 -0.575 25293
1682 1 17 . 1 1 6 6 LYS N N 6 122.395 122.395 122.670 -0.275 25293
1683 1 17 . 1 1 6 6 LYS HA H 6 4.938 4.938 5.038 -0.100 25293
1684 1 17 . 1 1 6 6 LYS H H 6 9.212 9.212 8.645 0.567 25293
1685 1 17 . 1 1 7 7 ARG N N 7 122.102 122.102 126.309 -4.207 25293
1686 1 17 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.124 0.587 25293
1687 1 17 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.714 2.007 25293
1688 1 17 . 1 1 7 7 ARG H H 7 8.700 8.700 8.291 0.409 25293
1689 1 17 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.795 -0.480 25293
1690 1 17 . 1 1 8 8 ASN CA C 8 54.388 54.388 52.973 1.415 25293
1691 1 17 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.871 -1.306 25293
1692 1 17 . 1 1 8 8 ASN H H 8 7.794 7.794 8.469 -0.675 25293
1693 1 17 . 1 1 9 9 GLY N N 9 101.289 101.289 106.541 -5.252 25293
1694 1 17 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.192 0.072 25293
1695 1 17 . 1 1 9 9 GLY H H 9 8.652 8.652 8.475 0.177 25293
1696 1 17 . 1 1 10 10 LEU N N 10 120.783 120.783 118.896 1.887 25293
1697 1 17 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.738 0.317 25293
1698 1 17 . 1 1 10 10 LEU CA C 10 51.535 51.535 51.201 0.334 25293
1699 1 17 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.296 -1.236 25293
1700 1 17 . 1 1 10 10 LEU H H 10 7.791 7.791 7.724 0.067 25293
1701 1 17 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.466 0.591 25293
1702 1 17 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.696 -2.359 25293
1703 1 17 . 1 1 12 12 VAL N N 12 115.299 115.299 115.874 -0.575 25293
1704 1 17 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.457 0.144 25293
1705 1 17 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.578 -1.478 25293
1706 1 17 . 1 1 12 12 VAL H H 12 7.971 7.971 8.012 -0.041 25293
1707 1 17 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.736 -0.405 25293
1708 1 17 . 1 1 13 13 CYS CA C 13 59.105 59.105 58.573 0.532 25293
1709 1 17 . 1 1 13 13 CYS CB C 13 48.573 48.573 28.962 19.611 25293
1710 1 17 . 1 1 13 13 CYS H H 13 8.103 8.103 8.200 -0.097 25293
1711 1 17 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.471 0.998 25293
1712 1 17 . 1 1 14 14 GLY H H 14 8.433 8.433 8.674 -0.241 25293
1713 1 17 . 1 1 15 15 GLU N N 15 115.613 115.613 117.543 -1.930 25293
1714 1 17 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.730 -0.063 25293
1715 1 17 . 1 1 15 15 GLU CB C 15 32.554 32.554 31.959 0.595 25293
1716 1 17 . 1 1 15 15 GLU H H 15 7.064 7.064 7.895 -0.831 25293
1717 1 17 . 1 1 16 16 THR N N 16 115.298 115.298 113.515 1.783 25293
1718 1 17 . 1 1 16 16 THR HA H 16 4.525 4.525 5.078 -0.553 25293
1719 1 17 . 1 1 16 16 THR CB C 16 70.742 70.742 69.677 1.065 25293
1720 1 17 . 1 1 16 16 THR H H 16 8.413 8.413 8.320 0.093 25293
1721 1 17 . 1 1 17 17 CYS N N 17 115.927 115.927 123.534 -7.607 25293
1722 1 17 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.812 0.249 25293
1723 1 17 . 1 1 17 17 CYS CA C 17 62.598 62.598 56.983 5.615 25293
1724 1 17 . 1 1 17 17 CYS CB C 17 47.454 47.454 29.853 17.601 25293
1725 1 17 . 1 1 17 17 CYS H H 17 8.239 8.239 8.484 -0.245 25293
1726 1 17 . 1 1 18 18 THR N N 18 117.192 117.192 115.838 1.354 25293
1727 1 17 . 1 1 18 18 THR HA H 18 3.912 3.912 4.760 -0.848 25293
1728 1 17 . 1 1 18 18 THR CA C 18 65.404 65.404 63.327 2.077 25293
1729 1 17 . 1 1 18 18 THR H H 18 8.277 8.277 8.825 -0.548 25293
1730 1 17 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.897 -0.406 25293
1731 1 17 . 1 1 19 19 LEU CB C 19 40.963 40.963 42.196 -1.233 25293
1732 1 17 . 1 1 19 19 LEU H H 19 8.474 8.474 7.718 0.756 25293
1733 1 17 . 1 1 20 20 GLY N N 20 105.833 105.833 107.931 -2.098 25293
1734 1 17 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.622 0.337 25293
1735 1 17 . 1 1 20 20 GLY H H 20 8.123 8.123 8.441 -0.318 25293
1736 1 17 . 1 1 21 21 THR N N 21 111.926 111.926 112.614 -0.688 25293
1737 1 17 . 1 1 21 21 THR HA H 21 4.653 4.653 4.392 0.261 25293
1738 1 17 . 1 1 21 21 THR CB C 21 68.777 68.777 70.434 -1.657 25293
1739 1 17 . 1 1 21 21 THR H H 21 7.658 7.658 7.532 0.126 25293
1740 1 17 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.465 0.176 25293
1741 1 17 . 1 1 22 22 CYS CB C 22 44.757 44.757 28.171 16.586 25293
1742 1 17 . 1 1 22 22 CYS H H 22 8.470 8.470 8.695 -0.225 25293
1743 1 17 . 1 1 23 23 SER N N 23 122.918 122.918 114.671 8.247 25293
1744 1 17 . 1 1 23 23 SER HA H 23 4.423 4.423 4.666 -0.243 25293
1745 1 17 . 1 1 23 23 SER CA C 23 59.914 59.914 58.919 0.995 25293
1746 1 17 . 1 1 23 23 SER CB C 23 64.597 64.597 63.502 1.095 25293
1747 1 17 . 1 1 23 23 SER H H 23 10.973 10.973 8.763 2.210 25293
1748 1 17 . 1 1 24 24 THR N N 24 124.108 124.108 116.051 8.057 25293
1749 1 17 . 1 1 24 24 THR HA H 24 3.979 3.979 4.370 -0.391 25293
1750 1 17 . 1 1 24 24 THR CA C 24 63.960 63.960 62.173 1.787 25293
1751 1 17 . 1 1 24 24 THR CB C 24 68.471 68.471 68.845 -0.374 25293
1752 1 17 . 1 1 24 24 THR H H 24 9.476 9.476 8.026 1.450 25293
1753 1 17 . 1 1 25 25 GLN N N 25 128.543 128.543 118.858 9.685 25293
1754 1 17 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.125 -0.200 25293
1755 1 17 . 1 1 25 25 GLN CA C 25 57.951 57.951 57.005 0.945 25293
1756 1 17 . 1 1 25 25 GLN CB C 25 28.195 28.195 27.779 0.416 25293
1757 1 17 . 1 1 25 25 GLN H H 25 8.714 8.714 8.345 0.369 25293
1758 1 17 . 1 1 26 26 GLY CA C 26 45.249 45.249 44.919 0.330 25293
1759 1 17 . 1 1 26 26 GLY H H 26 8.810 8.810 8.410 0.400 25293
1760 1 17 . 1 1 27 27 CYS N N 27 117.687 117.687 117.944 -0.257 25293
1761 1 17 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.799 0.274 25293
1762 1 17 . 1 1 27 27 CYS CB C 27 49.941 49.941 30.035 19.906 25293
1763 1 17 . 1 1 27 27 CYS H H 27 7.697 7.697 7.914 -0.217 25293
1764 1 17 . 1 1 28 28 THR N N 28 115.298 115.298 115.492 -0.194 25293
1765 1 17 . 1 1 28 28 THR HA H 28 4.488 4.488 4.683 -0.195 25293
1766 1 17 . 1 1 28 28 THR CA C 28 60.019 60.019 61.112 -1.093 25293
1767 1 17 . 1 1 28 28 THR CB C 28 71.515 71.515 70.955 0.560 25293
1768 1 17 . 1 1 28 28 THR H H 28 9.354 9.354 8.630 0.724 25293
1769 1 18 . 1 1 2 2 TRP N N 2 124.464 124.464 125.828 -1.364 25293
1770 1 18 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.667 -0.646 25293
1771 1 18 . 1 1 2 2 TRP CA C 2 59.121 59.121 57.861 1.260 25293
1772 1 18 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.848 -0.159 25293
1773 1 18 . 1 1 2 2 TRP H H 2 8.268 8.268 7.457 0.811 25293
1774 1 18 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.266 0.185 25293
1775 1 18 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.266 1.950 25293
1776 1 18 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.013 -0.263 25293
1777 1 18 . 1 1 4 4 ILE N N 4 126.955 126.955 118.940 8.015 25293
1778 1 18 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.739 0.447 25293
1779 1 18 . 1 1 4 4 ILE CA C 4 60.005 60.005 61.492 -1.487 25293
1780 1 18 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.275 0.134 25293
1781 1 18 . 1 1 4 4 ILE H H 4 8.276 8.276 7.445 0.831 25293
1782 1 18 . 1 1 5 5 CYS N N 5 124.228 124.228 122.773 1.455 25293
1783 1 18 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.667 0.158 25293
1784 1 18 . 1 1 5 5 CYS CB C 5 43.781 43.781 30.321 13.460 25293
1785 1 18 . 1 1 5 5 CYS H H 5 7.650 7.650 8.142 -0.492 25293
1786 1 18 . 1 1 6 6 LYS N N 6 122.395 122.395 121.325 1.070 25293
1787 1 18 . 1 1 6 6 LYS HA H 6 4.938 4.938 4.918 0.020 25293
1788 1 18 . 1 1 6 6 LYS H H 6 9.212 9.212 8.822 0.390 25293
1789 1 18 . 1 1 7 7 ARG N N 7 122.102 122.102 124.928 -2.826 25293
1790 1 18 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.182 0.529 25293
1791 1 18 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.658 2.063 25293
1792 1 18 . 1 1 7 7 ARG H H 7 8.700 8.700 8.739 -0.039 25293
1793 1 18 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.857 -0.542 25293
1794 1 18 . 1 1 8 8 ASN CA C 8 54.388 54.388 53.016 1.372 25293
1795 1 18 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.522 -0.957 25293
1796 1 18 . 1 1 8 8 ASN H H 8 7.794 7.794 8.359 -0.565 25293
1797 1 18 . 1 1 9 9 GLY N N 9 101.289 101.289 107.258 -5.969 25293
1798 1 18 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.603 -0.339 25293
1799 1 18 . 1 1 9 9 GLY H H 9 8.652 8.652 8.603 0.049 25293
1800 1 18 . 1 1 10 10 LEU N N 10 120.783 120.783 118.257 2.526 25293
1801 1 18 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.709 0.346 25293
1802 1 18 . 1 1 10 10 LEU CA C 10 51.535 51.535 51.117 0.418 25293
1803 1 18 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.398 -1.338 25293
1804 1 18 . 1 1 10 10 LEU H H 10 7.791 7.791 7.664 0.127 25293
1805 1 18 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.462 0.595 25293
1806 1 18 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.527 -2.190 25293
1807 1 18 . 1 1 12 12 VAL N N 12 115.299 115.299 116.315 -1.016 25293
1808 1 18 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.218 0.383 25293
1809 1 18 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.815 -1.714 25293
1810 1 18 . 1 1 12 12 VAL H H 12 7.971 7.971 8.042 -0.071 25293
1811 1 18 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.493 -0.162 25293
1812 1 18 . 1 1 13 13 CYS CA C 13 59.105 59.105 59.725 -0.620 25293
1813 1 18 . 1 1 13 13 CYS CB C 13 48.573 48.573 27.192 21.381 25293
1814 1 18 . 1 1 13 13 CYS H H 13 8.103 8.103 8.102 0.001 25293
1815 1 18 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.351 1.118 25293
1816 1 18 . 1 1 14 14 GLY H H 14 8.433 8.433 8.648 -0.215 25293
1817 1 18 . 1 1 15 15 GLU N N 15 115.613 115.613 117.397 -1.784 25293
1818 1 18 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.613 0.054 25293
1819 1 18 . 1 1 15 15 GLU CB C 15 32.554 32.554 31.871 0.683 25293
1820 1 18 . 1 1 15 15 GLU H H 15 7.064 7.064 8.066 -1.002 25293
1821 1 18 . 1 1 16 16 THR N N 16 115.298 115.298 111.690 3.608 25293
1822 1 18 . 1 1 16 16 THR HA H 16 4.525 4.525 4.916 -0.391 25293
1823 1 18 . 1 1 16 16 THR CB C 16 70.742 70.742 69.817 0.925 25293
1824 1 18 . 1 1 16 16 THR H H 16 8.413 8.413 8.229 0.184 25293
1825 1 18 . 1 1 17 17 CYS N N 17 115.927 115.927 123.821 -7.894 25293
1826 1 18 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.796 0.265 25293
1827 1 18 . 1 1 17 17 CYS CA C 17 62.598 62.598 57.508 5.090 25293
1828 1 18 . 1 1 17 17 CYS CB C 17 47.454 47.454 28.868 18.586 25293
1829 1 18 . 1 1 17 17 CYS H H 17 8.239 8.239 8.474 -0.235 25293
1830 1 18 . 1 1 18 18 THR N N 18 117.192 117.192 114.783 2.409 25293
1831 1 18 . 1 1 18 18 THR HA H 18 3.912 3.912 4.790 -0.878 25293
1832 1 18 . 1 1 18 18 THR CA C 18 65.404 65.404 63.728 1.676 25293
1833 1 18 . 1 1 18 18 THR H H 18 8.277 8.277 8.780 -0.503 25293
1834 1 18 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.777 -0.286 25293
1835 1 18 . 1 1 19 19 LEU CB C 19 40.963 40.963 41.755 -0.792 25293
1836 1 18 . 1 1 19 19 LEU H H 19 8.474 8.474 7.710 0.764 25293
1837 1 18 . 1 1 20 20 GLY N N 20 105.833 105.833 108.444 -2.611 25293
1838 1 18 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.505 0.454 25293
1839 1 18 . 1 1 20 20 GLY H H 20 8.123 8.123 8.571 -0.448 25293
1840 1 18 . 1 1 21 21 THR N N 21 111.926 111.926 112.675 -0.749 25293
1841 1 18 . 1 1 21 21 THR HA H 21 4.653 4.653 4.389 0.264 25293
1842 1 18 . 1 1 21 21 THR CB C 21 68.777 68.777 70.606 -1.829 25293
1843 1 18 . 1 1 21 21 THR H H 21 7.658 7.658 7.607 0.051 25293
1844 1 18 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.629 0.012 25293
1845 1 18 . 1 1 22 22 CYS CB C 22 44.757 44.757 27.675 17.082 25293
1846 1 18 . 1 1 22 22 CYS H H 22 8.470 8.470 8.561 -0.091 25293
1847 1 18 . 1 1 23 23 SER N N 23 122.918 122.918 119.098 3.820 25293
1848 1 18 . 1 1 23 23 SER HA H 23 4.423 4.423 4.255 0.168 25293
1849 1 18 . 1 1 23 23 SER CA C 23 59.914 59.914 60.419 -0.505 25293
1850 1 18 . 1 1 23 23 SER CB C 23 64.597 64.597 63.549 1.048 25293
1851 1 18 . 1 1 23 23 SER H H 23 10.973 10.973 8.629 2.344 25293
1852 1 18 . 1 1 24 24 THR N N 24 124.108 124.108 116.363 7.745 25293
1853 1 18 . 1 1 24 24 THR HA H 24 3.979 3.979 4.430 -0.451 25293
1854 1 18 . 1 1 24 24 THR CA C 24 63.960 63.960 61.361 2.599 25293
1855 1 18 . 1 1 24 24 THR CB C 24 68.471 68.471 69.892 -1.421 25293
1856 1 18 . 1 1 24 24 THR H H 24 9.476 9.476 7.670 1.806 25293
1857 1 18 . 1 1 25 25 GLN N N 25 128.543 128.543 120.603 7.940 25293
1858 1 18 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.535 -0.610 25293
1859 1 18 . 1 1 25 25 GLN CA C 25 57.951 57.951 55.437 2.514 25293
1860 1 18 . 1 1 25 25 GLN CB C 25 28.195 28.195 29.018 -0.823 25293
1861 1 18 . 1 1 25 25 GLN H H 25 8.714 8.714 8.511 0.203 25293
1862 1 18 . 1 1 26 26 GLY CA C 26 45.249 45.249 44.816 0.433 25293
1863 1 18 . 1 1 26 26 GLY H H 26 8.810 8.810 8.587 0.223 25293
1864 1 18 . 1 1 27 27 CYS N N 27 117.687 117.687 120.136 -2.449 25293
1865 1 18 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.528 0.545 25293
1866 1 18 . 1 1 27 27 CYS CB C 27 49.941 49.941 28.104 21.837 25293
1867 1 18 . 1 1 27 27 CYS H H 27 7.697 7.697 8.038 -0.341 25293
1868 1 18 . 1 1 28 28 THR N N 28 115.298 115.298 115.304 -0.006 25293
1869 1 18 . 1 1 28 28 THR HA H 28 4.488 4.488 4.631 -0.143 25293
1870 1 18 . 1 1 28 28 THR CA C 28 60.019 60.019 60.832 -0.813 25293
1871 1 18 . 1 1 28 28 THR CB C 28 71.515 71.515 70.561 0.954 25293
1872 1 18 . 1 1 28 28 THR H H 28 9.354 9.354 8.673 0.681 25293
1873 1 19 . 1 1 2 2 TRP N N 2 124.464 124.464 126.984 -2.520 25293
1874 1 19 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.734 -0.713 25293
1875 1 19 . 1 1 2 2 TRP CA C 2 59.121 59.121 58.521 0.600 25293
1876 1 19 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.773 -0.084 25293
1877 1 19 . 1 1 2 2 TRP H H 2 8.268 8.268 7.538 0.730 25293
1878 1 19 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.346 0.105 25293
1879 1 19 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.315 1.900 25293
1880 1 19 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.142 -0.391 25293
1881 1 19 . 1 1 4 4 ILE N N 4 126.955 126.955 119.269 7.686 25293
1882 1 19 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.721 0.465 25293
1883 1 19 . 1 1 4 4 ILE CA C 4 60.005 60.005 61.258 -1.254 25293
1884 1 19 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.162 0.247 25293
1885 1 19 . 1 1 4 4 ILE H H 4 8.276 8.276 7.440 0.836 25293
1886 1 19 . 1 1 5 5 CYS N N 5 124.228 124.228 123.462 0.766 25293
1887 1 19 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.966 -0.141 25293
1888 1 19 . 1 1 5 5 CYS CB C 5 43.781 43.781 29.613 14.168 25293
1889 1 19 . 1 1 5 5 CYS H H 5 7.650 7.650 8.150 -0.500 25293
1890 1 19 . 1 1 6 6 LYS N N 6 122.395 122.395 121.770 0.625 25293
1891 1 19 . 1 1 6 6 LYS HA H 6 4.938 4.938 4.710 0.228 25293
1892 1 19 . 1 1 6 6 LYS H H 6 9.212 9.212 8.648 0.564 25293
1893 1 19 . 1 1 7 7 ARG N N 7 122.102 122.102 125.261 -3.159 25293
1894 1 19 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.447 0.264 25293
1895 1 19 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.929 1.792 25293
1896 1 19 . 1 1 7 7 ARG H H 7 8.700 8.700 8.608 0.092 25293
1897 1 19 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.765 -0.450 25293
1898 1 19 . 1 1 8 8 ASN CA C 8 54.388 54.388 53.078 1.310 25293
1899 1 19 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.565 -1.000 25293
1900 1 19 . 1 1 8 8 ASN H H 8 7.794 7.794 8.492 -0.698 25293
1901 1 19 . 1 1 9 9 GLY N N 9 101.289 101.289 106.498 -5.209 25293
1902 1 19 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.539 -0.275 25293
1903 1 19 . 1 1 9 9 GLY H H 9 8.652 8.652 8.542 0.110 25293
1904 1 19 . 1 1 10 10 LEU N N 10 120.783 120.783 118.560 2.223 25293
1905 1 19 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.732 0.323 25293
1906 1 19 . 1 1 10 10 LEU CA C 10 51.535 51.535 50.963 0.572 25293
1907 1 19 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.256 -1.196 25293
1908 1 19 . 1 1 10 10 LEU H H 10 7.791 7.791 7.667 0.124 25293
1909 1 19 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.445 0.612 25293
1910 1 19 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.864 -2.527 25293
1911 1 19 . 1 1 12 12 VAL N N 12 115.299 115.299 118.028 -2.729 25293
1912 1 19 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.319 0.282 25293
1913 1 19 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.378 -1.277 25293
1914 1 19 . 1 1 12 12 VAL H H 12 7.971 7.971 8.168 -0.197 25293
1915 1 19 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.688 -0.357 25293
1916 1 19 . 1 1 13 13 CYS CA C 13 59.105 59.105 58.673 0.432 25293
1917 1 19 . 1 1 13 13 CYS CB C 13 48.573 48.573 28.811 19.762 25293
1918 1 19 . 1 1 13 13 CYS H H 13 8.103 8.103 7.899 0.204 25293
1919 1 19 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.619 0.850 25293
1920 1 19 . 1 1 14 14 GLY H H 14 8.433 8.433 8.636 -0.204 25293
1921 1 19 . 1 1 15 15 GLU N N 15 115.613 115.613 117.801 -2.188 25293
1922 1 19 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.731 -0.064 25293
1923 1 19 . 1 1 15 15 GLU CB C 15 32.554 32.554 31.937 0.617 25293
1924 1 19 . 1 1 15 15 GLU H H 15 7.064 7.064 7.925 -0.861 25293
1925 1 19 . 1 1 16 16 THR N N 16 115.298 115.298 112.865 2.433 25293
1926 1 19 . 1 1 16 16 THR HA H 16 4.525 4.525 4.812 -0.287 25293
1927 1 19 . 1 1 16 16 THR CB C 16 70.742 70.742 69.603 1.139 25293
1928 1 19 . 1 1 16 16 THR H H 16 8.413 8.413 8.289 0.124 25293
1929 1 19 . 1 1 17 17 CYS N N 17 115.927 115.927 123.754 -7.827 25293
1930 1 19 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.769 0.292 25293
1931 1 19 . 1 1 17 17 CYS CA C 17 62.598 62.598 57.208 5.390 25293
1932 1 19 . 1 1 17 17 CYS CB C 17 47.454 47.454 29.235 18.219 25293
1933 1 19 . 1 1 17 17 CYS H H 17 8.239 8.239 8.571 -0.332 25293
1934 1 19 . 1 1 18 18 THR N N 18 117.192 117.192 116.704 0.488 25293
1935 1 19 . 1 1 18 18 THR HA H 18 3.912 3.912 4.755 -0.843 25293
1936 1 19 . 1 1 18 18 THR CA C 18 65.404 65.404 63.204 2.200 25293
1937 1 19 . 1 1 18 18 THR H H 18 8.277 8.277 8.861 -0.584 25293
1938 1 19 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.796 -0.305 25293
1939 1 19 . 1 1 19 19 LEU CB C 19 40.963 40.963 42.089 -1.126 25293
1940 1 19 . 1 1 19 19 LEU H H 19 8.474 8.474 7.694 0.780 25293
1941 1 19 . 1 1 20 20 GLY N N 20 105.833 105.833 108.526 -2.693 25293
1942 1 19 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.439 0.520 25293
1943 1 19 . 1 1 20 20 GLY H H 20 8.123 8.123 8.540 -0.417 25293
1944 1 19 . 1 1 21 21 THR N N 21 111.926 111.926 112.751 -0.825 25293
1945 1 19 . 1 1 21 21 THR HA H 21 4.653 4.653 4.404 0.249 25293
1946 1 19 . 1 1 21 21 THR CB C 21 68.777 68.777 70.529 -1.752 25293
1947 1 19 . 1 1 21 21 THR H H 21 7.658 7.658 7.537 0.121 25293
1948 1 19 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.431 0.210 25293
1949 1 19 . 1 1 22 22 CYS CB C 22 44.757 44.757 28.512 16.245 25293
1950 1 19 . 1 1 22 22 CYS H H 22 8.470 8.470 9.026 -0.556 25293
1951 1 19 . 1 1 23 23 SER N N 23 122.918 122.918 115.703 7.215 25293
1952 1 19 . 1 1 23 23 SER HA H 23 4.423 4.423 4.505 -0.082 25293
1953 1 19 . 1 1 23 23 SER CA C 23 59.914 59.914 59.272 0.642 25293
1954 1 19 . 1 1 23 23 SER CB C 23 64.597 64.597 63.428 1.169 25293
1955 1 19 . 1 1 23 23 SER H H 23 10.973 10.973 8.931 2.042 25293
1956 1 19 . 1 1 24 24 THR N N 24 124.108 124.108 117.012 7.096 25293
1957 1 19 . 1 1 24 24 THR HA H 24 3.979 3.979 4.224 -0.245 25293
1958 1 19 . 1 1 24 24 THR CA C 24 63.960 63.960 63.147 0.813 25293
1959 1 19 . 1 1 24 24 THR CB C 24 68.471 68.471 69.537 -1.066 25293
1960 1 19 . 1 1 24 24 THR H H 24 9.476 9.476 7.659 1.817 25293
1961 1 19 . 1 1 25 25 GLN N N 25 128.543 128.543 120.429 8.114 25293
1962 1 19 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.444 -0.519 25293
1963 1 19 . 1 1 25 25 GLN CA C 25 57.951 57.951 56.063 1.888 25293
1964 1 19 . 1 1 25 25 GLN CB C 25 28.195 28.195 28.531 -0.336 25293
1965 1 19 . 1 1 25 25 GLN H H 25 8.714 8.714 8.559 0.155 25293
1966 1 19 . 1 1 26 26 GLY CA C 26 45.249 45.249 45.351 -0.102 25293
1967 1 19 . 1 1 26 26 GLY H H 26 8.810 8.810 8.122 0.688 25293
1968 1 19 . 1 1 27 27 CYS N N 27 117.687 117.687 118.012 -0.325 25293
1969 1 19 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.775 0.298 25293
1970 1 19 . 1 1 27 27 CYS CB C 27 49.941 49.941 30.338 19.603 25293
1971 1 19 . 1 1 27 27 CYS H H 27 7.697 7.697 7.982 -0.285 25293
1972 1 19 . 1 1 28 28 THR N N 28 115.298 115.298 115.036 0.262 25293
1973 1 19 . 1 1 28 28 THR HA H 28 4.488 4.488 4.677 -0.189 25293
1974 1 19 . 1 1 28 28 THR CA C 28 60.019 60.019 61.061 -1.042 25293
1975 1 19 . 1 1 28 28 THR CB C 28 71.515 71.515 71.335 0.179 25293
1976 1 19 . 1 1 28 28 THR H H 28 9.354 9.354 8.266 1.088 25293
1977 1 20 . 1 1 2 2 TRP N N 2 124.464 124.464 127.536 -3.072 25293
1978 1 20 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.665 -0.644 25293
1979 1 20 . 1 1 2 2 TRP CA C 2 59.121 59.121 57.932 1.188 25293
1980 1 20 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.909 -0.220 25293
1981 1 20 . 1 1 2 2 TRP H H 2 8.268 8.268 7.630 0.638 25293
1982 1 20 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.260 0.191 25293
1983 1 20 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.273 1.942 25293
1984 1 20 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.042 -0.292 25293
1985 1 20 . 1 1 4 4 ILE N N 4 126.955 126.955 118.857 8.098 25293
1986 1 20 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.726 0.460 25293
1987 1 20 . 1 1 4 4 ILE CA C 4 60.005 60.005 60.837 -0.832 25293
1988 1 20 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.562 -0.153 25293
1989 1 20 . 1 1 4 4 ILE H H 4 8.276 8.276 7.588 0.688 25293
1990 1 20 . 1 1 5 5 CYS N N 5 124.228 124.228 123.040 1.188 25293
1991 1 20 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.597 0.228 25293
1992 1 20 . 1 1 5 5 CYS CB C 5 43.781 43.781 30.121 13.660 25293
1993 1 20 . 1 1 5 5 CYS H H 5 7.650 7.650 8.277 -0.627 25293
1994 1 20 . 1 1 6 6 LYS N N 6 122.395 122.395 121.991 0.404 25293
1995 1 20 . 1 1 6 6 LYS HA H 6 4.938 4.938 4.991 -0.053 25293
1996 1 20 . 1 1 6 6 LYS H H 6 9.212 9.212 8.768 0.444 25293
1997 1 20 . 1 1 7 7 ARG N N 7 122.102 122.102 124.614 -2.512 25293
1998 1 20 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.107 0.604 25293
1999 1 20 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.340 2.381 25293
2000 1 20 . 1 1 7 7 ARG H H 7 8.700 8.700 8.691 0.009 25293
2001 1 20 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.790 -0.475 25293
2002 1 20 . 1 1 8 8 ASN CA C 8 54.388 54.388 52.986 1.402 25293
2003 1 20 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.409 -0.844 25293
2004 1 20 . 1 1 8 8 ASN H H 8 7.794 7.794 8.257 -0.463 25293
2005 1 20 . 1 1 9 9 GLY N N 9 101.289 101.289 106.325 -5.036 25293
2006 1 20 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.278 -0.014 25293
2007 1 20 . 1 1 9 9 GLY H H 9 8.652 8.652 8.475 0.177 25293
2008 1 20 . 1 1 10 10 LEU N N 10 120.783 120.783 118.998 1.785 25293
2009 1 20 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.757 0.298 25293
2010 1 20 . 1 1 10 10 LEU CA C 10 51.535 51.535 50.960 0.575 25293
2011 1 20 . 1 1 10 10 LEU CB C 10 44.060 44.060 44.913 -0.853 25293
2012 1 20 . 1 1 10 10 LEU H H 10 7.791 7.791 7.733 0.058 25293
2013 1 20 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.438 0.619 25293
2014 1 20 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.651 -2.314 25293
2015 1 20 . 1 1 12 12 VAL N N 12 115.299 115.299 116.415 -1.116 25293
2016 1 20 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.396 0.205 25293
2017 1 20 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.506 -1.405 25293
2018 1 20 . 1 1 12 12 VAL H H 12 7.971 7.971 8.303 -0.332 25293
2019 1 20 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.719 -0.388 25293
2020 1 20 . 1 1 13 13 CYS CA C 13 59.105 59.105 58.804 0.301 25293
2021 1 20 . 1 1 13 13 CYS CB C 13 48.573 48.573 29.219 19.354 25293
2022 1 20 . 1 1 13 13 CYS H H 13 8.103 8.103 8.066 0.037 25293
2023 1 20 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.928 0.541 25293
2024 1 20 . 1 1 14 14 GLY H H 14 8.433 8.433 8.766 -0.333 25293
2025 1 20 . 1 1 15 15 GLU N N 15 115.613 115.613 117.646 -2.033 25293
2026 1 20 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.508 0.159 25293
2027 1 20 . 1 1 15 15 GLU CB C 15 32.554 32.554 29.753 2.801 25293
2028 1 20 . 1 1 15 15 GLU H H 15 7.064 7.064 8.100 -1.036 25293
2029 1 20 . 1 1 16 16 THR N N 16 115.298 115.298 113.873 1.425 25293
2030 1 20 . 1 1 16 16 THR HA H 16 4.525 4.525 4.236 0.289 25293
2031 1 20 . 1 1 16 16 THR CB C 16 70.742 70.742 68.446 2.296 25293
2032 1 20 . 1 1 16 16 THR H H 16 8.413 8.413 8.012 0.401 25293
2033 1 20 . 1 1 17 17 CYS N N 17 115.927 115.927 124.666 -8.739 25293
2034 1 20 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.642 0.419 25293
2035 1 20 . 1 1 17 17 CYS CA C 17 62.598 62.598 57.908 4.689 25293
2036 1 20 . 1 1 17 17 CYS CB C 17 47.454 47.454 28.613 18.841 25293
2037 1 20 . 1 1 17 17 CYS H H 17 8.239 8.239 8.307 -0.068 25293
2038 1 20 . 1 1 18 18 THR N N 18 117.192 117.192 115.259 1.933 25293
2039 1 20 . 1 1 18 18 THR HA H 18 3.912 3.912 4.772 -0.860 25293
2040 1 20 . 1 1 18 18 THR CA C 18 65.404 65.404 63.154 2.250 25293
2041 1 20 . 1 1 18 18 THR H H 18 8.277 8.277 8.949 -0.672 25293
2042 1 20 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.951 -0.460 25293
2043 1 20 . 1 1 19 19 LEU CB C 19 40.963 40.963 42.018 -1.055 25293
2044 1 20 . 1 1 19 19 LEU H H 19 8.474 8.474 7.733 0.741 25293
2045 1 20 . 1 1 20 20 GLY N N 20 105.833 105.833 108.010 -2.177 25293
2046 1 20 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.605 0.354 25293
2047 1 20 . 1 1 20 20 GLY H H 20 8.123 8.123 8.425 -0.302 25293
2048 1 20 . 1 1 21 21 THR N N 21 111.926 111.926 110.967 0.959 25293
2049 1 20 . 1 1 21 21 THR HA H 21 4.653 4.653 4.386 0.267 25293
2050 1 20 . 1 1 21 21 THR CB C 21 68.777 68.777 69.962 -1.185 25293
2051 1 20 . 1 1 21 21 THR H H 21 7.658 7.658 7.574 0.084 25293
2052 1 20 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.470 0.171 25293
2053 1 20 . 1 1 22 22 CYS CB C 22 44.757 44.757 28.497 16.260 25293
2054 1 20 . 1 1 22 22 CYS H H 22 8.470 8.470 8.756 -0.286 25293
2055 1 20 . 1 1 23 23 SER N N 23 122.918 122.918 114.829 8.089 25293
2056 1 20 . 1 1 23 23 SER HA H 23 4.423 4.423 4.665 -0.242 25293
2057 1 20 . 1 1 23 23 SER CA C 23 59.914 59.914 58.900 1.014 25293
2058 1 20 . 1 1 23 23 SER CB C 23 64.597 64.597 64.303 0.294 25293
2059 1 20 . 1 1 23 23 SER H H 23 10.973 10.973 8.991 1.982 25293
2060 1 20 . 1 1 24 24 THR N N 24 124.108 124.108 115.714 8.394 25293
2061 1 20 . 1 1 24 24 THR HA H 24 3.979 3.979 4.440 -0.461 25293
2062 1 20 . 1 1 24 24 THR CA C 24 63.960 63.960 60.996 2.964 25293
2063 1 20 . 1 1 24 24 THR CB C 24 68.471 68.471 68.887 -0.416 25293
2064 1 20 . 1 1 24 24 THR H H 24 9.476 9.476 7.925 1.551 25293
2065 1 20 . 1 1 25 25 GLN N N 25 128.543 128.543 118.024 10.519 25293
2066 1 20 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.051 -0.126 25293
2067 1 20 . 1 1 25 25 GLN CA C 25 57.951 57.951 56.860 1.091 25293
2068 1 20 . 1 1 25 25 GLN CB C 25 28.195 28.195 26.955 1.240 25293
2069 1 20 . 1 1 25 25 GLN H H 25 8.714 8.714 8.533 0.181 25293
2070 1 20 . 1 1 26 26 GLY CA C 26 45.249 45.249 44.986 0.263 25293
2071 1 20 . 1 1 26 26 GLY H H 26 8.810 8.810 8.468 0.342 25293
2072 1 20 . 1 1 27 27 CYS N N 27 117.687 117.687 117.221 0.466 25293
2073 1 20 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.736 0.337 25293
2074 1 20 . 1 1 27 27 CYS CB C 27 49.941 49.941 31.527 18.414 25293
2075 1 20 . 1 1 27 27 CYS H H 27 7.697 7.697 7.814 -0.117 25293
2076 1 20 . 1 1 28 28 THR N N 28 115.298 115.298 115.252 0.046 25293
2077 1 20 . 1 1 28 28 THR HA H 28 4.488 4.488 4.621 -0.133 25293
2078 1 20 . 1 1 28 28 THR CA C 28 60.019 60.019 61.203 -1.184 25293
2079 1 20 . 1 1 28 28 THR CB C 28 71.515 71.515 70.137 1.378 25293
2080 1 20 . 1 1 28 28 THR H H 28 9.354 9.354 8.473 0.881 25293
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Entity_delta_chem_shifts_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Data_low_range
_SPARTA_output.Data_high_range
_SPARTA_output.Entry_ID
1 1 1 "Average Difference" N 19 4.274 -0.225 4.385 25293
2 1 1 "Average Difference" HA 31 0.386 -0.059 0.387 25293
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25293
4 1 1 "Average Difference" CA 16 1.854 -0.937 1.652 25293
5 1 1 "Average Difference" CB 21 9.187 -4.154 8.397 25293
6 1 1 "Average Difference" HN 25 0.746 -0.205 0.732 25293
7 1 2 "Average Difference" N 19 4.178 -0.239 4.285 25293
8 1 2 "Average Difference" HA 31 0.385 -0.071 0.385 25293
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25293
10 1 2 "Average Difference" CA 16 1.774 -0.908 1.574 25293
11 1 2 "Average Difference" CB 21 9.123 -4.279 8.257 25293
12 1 2 "Average Difference" HN 25 0.705 -0.156 0.701 25293
13 1 3 "Average Difference" N 19 4.361 -0.437 4.458 25293
14 1 3 "Average Difference" HA 31 0.402 -0.023 0.408 25293
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25293
16 1 3 "Average Difference" CA 16 1.822 -0.883 1.645 25293
17 1 3 "Average Difference" CB 21 8.938 -4.032 8.174 25293
18 1 3 "Average Difference" HN 25 0.749 -0.204 0.736 25293
19 1 4 "Average Difference" N 19 4.807 -0.592 4.901 25293
20 1 4 "Average Difference" HA 31 0.385 -0.062 0.386 25293
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25293
22 1 4 "Average Difference" CA 16 1.796 -0.923 1.592 25293
23 1 4 "Average Difference" CB 21 9.087 -4.258 8.226 25293
24 1 4 "Average Difference" HN 25 0.751 -0.207 0.737 25293
25 1 5 "Average Difference" N 19 4.176 -0.263 4.282 25293
26 1 5 "Average Difference" HA 31 0.395 -0.060 0.397 25293
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25293
28 1 5 "Average Difference" CA 16 1.896 -0.965 1.685 25293
29 1 5 "Average Difference" CB 21 9.285 -4.194 8.488 25293
30 1 5 "Average Difference" HN 25 0.745 -0.212 0.729 25293
31 1 6 "Average Difference" N 19 4.294 -0.517 4.380 25293
32 1 6 "Average Difference" HA 31 0.382 -0.048 0.385 25293
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25293
34 1 6 "Average Difference" CA 16 1.869 -0.908 1.687 25293
35 1 6 "Average Difference" CB 21 9.060 -4.068 8.296 25293
36 1 6 "Average Difference" HN 25 0.740 -0.200 0.727 25293
37 1 7 "Average Difference" N 19 4.382 -0.519 4.470 25293
38 1 7 "Average Difference" HA 31 0.385 -0.083 0.382 25293
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25293
40 1 7 "Average Difference" CA 16 1.810 -0.887 1.630 25293
41 1 7 "Average Difference" CB 21 9.210 -4.253 8.371 25293
42 1 7 "Average Difference" HN 25 0.685 -0.120 0.688 25293
43 1 8 "Average Difference" N 19 4.231 -0.315 4.335 25293
44 1 8 "Average Difference" HA 31 0.397 -0.034 0.402 25293
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25293
46 1 8 "Average Difference" CA 16 1.698 -0.903 1.486 25293
47 1 8 "Average Difference" CB 21 8.724 -4.174 7.849 25293
48 1 8 "Average Difference" HN 25 0.744 -0.193 0.733 25293
49 1 9 "Average Difference" N 19 4.342 0.136 4.459 25293
50 1 9 "Average Difference" HA 31 0.399 -0.072 0.399 25293
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25293
52 1 9 "Average Difference" CA 16 1.746 -0.946 1.516 25293
53 1 9 "Average Difference" CB 21 9.134 -4.317 8.248 25293
54 1 9 "Average Difference" HN 25 0.736 -0.178 0.729 25293
55 1 10 "Average Difference" N 19 4.395 -0.251 4.508 25293
56 1 10 "Average Difference" HA 31 0.393 -0.073 0.393 25293
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25293
58 1 10 "Average Difference" CA 16 1.896 -1.013 1.655 25293
59 1 10 "Average Difference" CB 21 9.112 -4.270 8.249 25293
60 1 10 "Average Difference" HN 25 0.697 -0.161 0.693 25293
61 1 11 "Average Difference" N 19 4.152 -0.458 4.239 25293
62 1 11 "Average Difference" HA 31 0.386 -0.064 0.387 25293
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25293
64 1 11 "Average Difference" CA 16 1.840 -0.881 1.668 25293
65 1 11 "Average Difference" CB 21 9.097 -4.113 8.315 25293
66 1 11 "Average Difference" HN 25 0.749 -0.268 0.713 25293
67 1 12 "Average Difference" N 19 4.798 -0.578 4.894 25293
68 1 12 "Average Difference" HA 31 0.377 -0.074 0.376 25293
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25293
70 1 12 "Average Difference" CA 16 1.824 -1.057 1.535 25293
71 1 12 "Average Difference" CB 21 8.924 -4.186 8.076 25293
72 1 12 "Average Difference" HN 25 0.700 -0.163 0.695 25293
73 1 13 "Average Difference" N 19 4.165 -0.546 4.242 25293
74 1 13 "Average Difference" HA 31 0.399 -0.027 0.405 25293
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25293
76 1 13 "Average Difference" CA 16 1.853 -0.905 1.670 25293
77 1 13 "Average Difference" CB 21 8.875 -4.044 8.095 25293
78 1 13 "Average Difference" HN 25 0.774 -0.252 0.747 25293
79 1 14 "Average Difference" N 19 4.666 -0.521 4.764 25293
80 1 14 "Average Difference" HA 31 0.385 -0.071 0.385 25293
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25293
82 1 14 "Average Difference" CA 16 1.810 -0.947 1.592 25293
83 1 14 "Average Difference" CB 21 9.160 -4.267 8.306 25293
84 1 14 "Average Difference" HN 25 0.736 -0.207 0.721 25293
85 1 15 "Average Difference" N 19 4.284 -0.317 4.389 25293
86 1 15 "Average Difference" HA 31 0.407 -0.071 0.407 25293
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25293
88 1 15 "Average Difference" CA 16 1.841 -1.002 1.596 25293
89 1 15 "Average Difference" CB 21 9.082 -4.329 8.181 25293
90 1 15 "Average Difference" HN 25 0.760 -0.171 0.756 25293
91 1 16 "Average Difference" N 19 4.289 -0.463 4.381 25293
92 1 16 "Average Difference" HA 31 0.398 -0.085 0.395 25293
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25293
94 1 16 "Average Difference" CA 16 1.878 -0.918 1.692 25293
95 1 16 "Average Difference" CB 21 9.370 -4.395 8.480 25293
96 1 16 "Average Difference" HN 25 0.691 -0.145 0.690 25293
97 1 17 "Average Difference" N 19 4.779 -0.912 4.820 25293
98 1 17 "Average Difference" HA 31 0.363 0.010 0.369 25293
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25293
100 1 17 "Average Difference" CA 16 1.775 -1.051 1.476 25293
101 1 17 "Average Difference" CB 21 8.744 -4.040 7.946 25293
102 1 17 "Average Difference" HN 25 0.697 -0.179 0.687 25293
103 1 18 "Average Difference" N 19 4.327 -0.627 4.398 25293
104 1 18 "Average Difference" HA 31 0.404 -0.061 0.406 25293
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25293
106 1 18 "Average Difference" CA 16 1.846 -0.945 1.637 25293
107 1 18 "Average Difference" CB 21 9.199 -4.127 8.425 25293
108 1 18 "Average Difference" HN 25 0.740 -0.179 0.733 25293
109 1 19 "Average Difference" N 19 4.380 -0.496 4.471 25293
110 1 19 "Average Difference" HA 31 0.375 -0.018 0.381 25293
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25293
112 1 19 "Average Difference" CA 16 1.740 -0.903 1.537 25293
113 1 19 "Average Difference" CB 21 8.712 -3.923 7.971 25293
114 1 19 "Average Difference" HN 25 0.748 -0.194 0.738 25293
115 1 20 "Average Difference" N 19 4.874 -0.980 4.905 25293
116 1 20 "Average Difference" HA 31 0.390 -0.053 0.392 25293
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25293
118 1 20 "Average Difference" CA 16 1.736 -1.034 1.440 25293
119 1 20 "Average Difference" CB 21 8.601 -4.199 7.692 25293
120 1 20 "Average Difference" HN 25 0.682 -0.159 0.677 25293
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Model_type average
_Entity_delta_chem_shifts.Entry_ID 25293
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 TRP N N 2 124.464 124.464 126.490 -2.026 25293
2 1 . 1 1 2 2 TRP HA H 2 4.021 4.021 4.664 -0.643 25293
3 1 . 1 1 2 2 TRP CA C 2 59.121 59.121 58.108 1.013 25293
4 1 . 1 1 2 2 TRP CB C 2 29.689 29.689 29.791 -0.102 25293
5 1 . 1 1 2 2 TRP H H 2 8.268 8.268 7.571 0.697 25293
6 1 . 1 1 3 3 PRO HA H 3 3.451 3.451 3.281 0.170 25293
7 1 . 1 1 3 3 PRO CA C 3 65.215 65.215 63.291 1.925 25293
8 1 . 1 1 3 3 PRO CB C 3 31.750 31.750 32.056 -0.306 25293
9 1 . 1 1 4 4 ILE N N 4 126.955 126.955 119.046 7.909 25293
10 1 . 1 1 4 4 ILE HA H 4 4.186 4.186 3.747 0.439 25293
11 1 . 1 1 4 4 ILE CA C 4 60.005 60.005 61.061 -1.056 25293
12 1 . 1 1 4 4 ILE CB C 4 37.409 37.409 37.406 0.003 25293
13 1 . 1 1 4 4 ILE H H 4 8.276 8.276 7.474 0.802 25293
14 1 . 1 1 5 5 CYS N N 5 124.228 124.228 123.468 0.760 25293
15 1 . 1 1 5 5 CYS HA H 5 4.825 4.825 4.673 0.152 25293
16 1 . 1 1 5 5 CYS CB C 5 43.781 43.781 29.899 13.882 25293
17 1 . 1 1 5 5 CYS H H 5 7.650 7.650 8.225 -0.575 25293
18 1 . 1 1 6 6 LYS N N 6 122.395 122.395 122.036 0.358 25293
19 1 . 1 1 6 6 LYS HA H 6 4.938 4.938 4.943 -0.005 25293
20 1 . 1 1 6 6 LYS H H 6 9.212 9.212 8.473 0.739 25293
21 1 . 1 1 7 7 ARG N N 7 122.102 122.102 125.278 -3.176 25293
22 1 . 1 1 7 7 ARG HA H 7 4.711 4.711 4.232 0.479 25293
23 1 . 1 1 7 7 ARG CB C 7 32.721 32.721 30.718 2.003 25293
24 1 . 1 1 7 7 ARG H H 7 8.700 8.700 8.613 0.087 25293
25 1 . 1 1 8 8 ASN HA H 8 4.315 4.315 4.789 -0.474 25293
26 1 . 1 1 8 8 ASN CA C 8 54.388 54.388 53.023 1.365 25293
27 1 . 1 1 8 8 ASN CB C 8 37.565 37.565 38.553 -0.988 25293
28 1 . 1 1 8 8 ASN H H 8 7.794 7.794 8.432 -0.638 25293
29 1 . 1 1 9 9 GLY N N 9 101.289 101.289 106.488 -5.199 25293
30 1 . 1 1 9 9 GLY CA C 9 45.264 45.264 45.292 -0.028 25293
31 1 . 1 1 9 9 GLY H H 9 8.652 8.652 8.498 0.154 25293
32 1 . 1 1 10 10 LEU N N 10 120.783 120.783 118.571 2.212 25293
33 1 . 1 1 10 10 LEU HA H 10 5.055 5.055 4.720 0.335 25293
34 1 . 1 1 10 10 LEU CA C 10 51.535 51.535 51.066 0.469 25293
35 1 . 1 1 10 10 LEU CB C 10 44.060 44.060 45.234 -1.174 25293
36 1 . 1 1 10 10 LEU H H 10 7.791 7.791 7.687 0.104 25293
37 1 . 1 1 11 11 PRO HA H 11 5.057 5.057 4.458 0.599 25293
38 1 . 1 1 11 11 PRO CB C 11 28.337 28.337 30.683 -2.346 25293
39 1 . 1 1 12 12 VAL N N 12 115.299 115.299 117.068 -1.769 25293
40 1 . 1 1 12 12 VAL HA H 12 4.601 4.601 4.305 0.296 25293
41 1 . 1 1 12 12 VAL CB C 12 31.101 31.101 32.578 -1.477 25293
42 1 . 1 1 12 12 VAL H H 12 7.971 7.971 8.120 -0.149 25293
43 1 . 1 1 13 13 CYS HA H 13 4.331 4.331 4.580 -0.249 25293
44 1 . 1 1 13 13 CYS CA C 13 59.105 59.105 59.076 0.028 25293
45 1 . 1 1 13 13 CYS CB C 13 48.573 48.573 27.990 20.583 25293
46 1 . 1 1 13 13 CYS H H 13 8.103 8.103 8.028 0.075 25293
47 1 . 1 1 14 14 GLY CA C 14 46.469 46.469 45.803 0.666 25293
48 1 . 1 1 14 14 GLY H H 14 8.433 8.433 8.689 -0.256 25293
49 1 . 1 1 15 15 GLU N N 15 115.613 115.613 117.461 -1.848 25293
50 1 . 1 1 15 15 GLU HA H 15 4.667 4.667 4.594 0.073 25293
51 1 . 1 1 15 15 GLU CB C 15 32.554 32.554 31.297 1.257 25293
52 1 . 1 1 15 15 GLU H H 15 7.064 7.064 8.000 -0.936 25293
53 1 . 1 1 16 16 THR N N 16 115.298 115.298 113.147 2.151 25293
54 1 . 1 1 16 16 THR HA H 16 4.525 4.525 4.553 -0.028 25293
55 1 . 1 1 16 16 THR CB C 16 70.742 70.742 69.167 1.575 25293
56 1 . 1 1 16 16 THR H H 16 8.413 8.413 8.070 0.343 25293
57 1 . 1 1 17 17 CYS N N 17 115.927 115.927 124.238 -8.311 25293
58 1 . 1 1 17 17 CYS HA H 17 5.061 5.061 4.732 0.329 25293
59 1 . 1 1 17 17 CYS CA C 17 62.598 62.598 57.283 5.315 25293
60 1 . 1 1 17 17 CYS CB C 17 47.454 47.454 29.094 18.360 25293
61 1 . 1 1 17 17 CYS H H 17 8.239 8.239 8.417 -0.178 25293
62 1 . 1 1 18 18 THR N N 18 117.192 117.192 115.560 1.632 25293
63 1 . 1 1 18 18 THR HA H 18 3.912 3.912 4.782 -0.870 25293
64 1 . 1 1 18 18 THR CA C 18 65.404 65.404 63.221 2.183 25293
65 1 . 1 1 18 18 THR H H 18 8.277 8.277 8.850 -0.573 25293
66 1 . 1 1 19 19 LEU HA H 19 4.491 4.491 4.872 -0.381 25293
67 1 . 1 1 19 19 LEU CB C 19 40.963 40.963 41.987 -1.024 25293
68 1 . 1 1 19 19 LEU H H 19 8.474 8.474 7.759 0.715 25293
69 1 . 1 1 20 20 GLY N N 20 105.833 105.833 108.090 -2.256 25293
70 1 . 1 1 20 20 GLY CA C 20 45.959 45.959 45.608 0.351 25293
71 1 . 1 1 20 20 GLY H H 20 8.123 8.123 8.411 -0.288 25293
72 1 . 1 1 21 21 THR N N 21 111.926 111.926 111.862 0.064 25293
73 1 . 1 1 21 21 THR HA H 21 4.653 4.653 4.388 0.265 25293
74 1 . 1 1 21 21 THR CB C 21 68.777 68.777 70.133 -1.356 25293
75 1 . 1 1 21 21 THR H H 21 7.658 7.658 7.567 0.091 25293
76 1 . 1 1 22 22 CYS HA H 22 4.641 4.641 4.530 0.111 25293
77 1 . 1 1 22 22 CYS CB C 22 44.757 44.757 27.900 16.857 25293
78 1 . 1 1 22 22 CYS H H 22 8.470 8.470 8.748 -0.278 25293
79 1 . 1 1 23 23 SER N N 23 122.918 122.918 117.364 5.554 25293
80 1 . 1 1 23 23 SER HA H 23 4.423 4.423 4.445 -0.022 25293
81 1 . 1 1 23 23 SER CA C 23 59.914 59.914 59.891 0.023 25293
82 1 . 1 1 23 23 SER CB C 23 64.597 64.597 63.608 0.989 25293
83 1 . 1 1 23 23 SER H H 23 10.973 10.973 8.761 2.212 25293
84 1 . 1 1 24 24 THR N N 24 124.108 124.108 115.675 8.433 25293
85 1 . 1 1 24 24 THR HA H 24 3.979 3.979 4.359 -0.380 25293
86 1 . 1 1 24 24 THR CA C 24 63.960 63.960 61.957 2.003 25293
87 1 . 1 1 24 24 THR CB C 24 68.471 68.471 69.536 -1.065 25293
88 1 . 1 1 24 24 THR H H 24 9.476 9.476 7.928 1.548 25293
89 1 . 1 1 25 25 GLN N N 25 128.543 128.543 121.267 7.276 25293
90 1 . 1 1 25 25 GLN HA H 25 3.925 3.925 4.356 -0.431 25293
91 1 . 1 1 25 25 GLN CA C 25 57.951 57.951 56.058 1.893 25293
92 1 . 1 1 25 25 GLN CB C 25 28.195 28.195 28.146 0.049 25293
93 1 . 1 1 25 25 GLN H H 25 8.714 8.714 8.512 0.202 25293
94 1 . 1 1 26 26 GLY CA C 26 45.249 45.249 44.978 0.271 25293
95 1 . 1 1 26 26 GLY H H 26 8.810 8.810 8.408 0.402 25293
96 1 . 1 1 27 27 CYS N N 27 117.687 117.687 119.498 -1.811 25293
97 1 . 1 1 27 27 CYS HA H 27 5.073 5.073 4.568 0.505 25293
98 1 . 1 1 27 27 CYS CB C 27 49.941 49.941 28.847 21.094 25293
99 1 . 1 1 27 27 CYS H H 27 7.697 7.697 8.074 -0.377 25293
100 1 . 1 1 28 28 THR N N 28 115.298 115.298 116.586 -1.288 25293
101 1 . 1 1 28 28 THR HA H 28 4.488 4.488 4.643 -0.155 25293
102 1 . 1 1 28 28 THR CA C 28 60.019 60.019 61.306 -1.287 25293
103 1 . 1 1 28 28 THR CB C 28 71.515 71.515 70.526 0.989 25293
104 1 . 1 1 28 28 THR H H 28 9.354 9.354 8.587 0.767 25293
stop_
save_