data_25585
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25585
_Entry.PDB_ID 2N24
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 25585
_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 3 3 CYS N N 3 120.614 120.614 123.907 -3.293 25585
2 1 1 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.546 0.253 25585
3 1 1 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.219 -5.428 25585
4 1 1 . 1 1 3 3 CYS CB C 3 42.170 42.170 30.057 12.113 25585
5 1 1 . 1 1 3 3 CYS H H 3 7.958 7.958 7.585 0.373 25585
6 1 1 . 1 1 4 4 GLN N N 4 121.450 121.450 120.793 0.657 25585
7 1 1 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.122 0.058 25585
8 1 1 . 1 1 4 4 GLN CA C 4 54.557 54.557 53.067 1.490 25585
9 1 1 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.416 -1.225 25585
10 1 1 . 1 1 4 4 GLN H H 4 8.737 8.737 8.156 0.581 25585
11 1 1 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.207 0.202 25585
12 1 1 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.177 0.177 25585
13 1 1 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.767 -0.057 25585
14 1 1 . 1 1 6 6 GLY N N 6 111.865 111.865 110.835 1.030 25585
15 1 1 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.934 -0.871 25585
16 1 1 . 1 1 6 6 GLY H H 6 8.948 8.948 8.673 0.275 25585
17 1 1 . 1 1 7 7 TYR N N 7 120.136 120.136 119.637 0.499 25585
18 1 1 . 1 1 7 7 TYR HA H 7 5.057 5.057 5.075 -0.018 25585
19 1 1 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.518 -0.125 25585
20 1 1 . 1 1 7 7 TYR CB C 7 41.345 41.345 42.104 -0.759 25585
21 1 1 . 1 1 7 7 TYR H H 7 8.300 8.300 7.616 0.684 25585
22 1 1 . 1 1 8 8 ALA N N 8 121.599 121.599 122.606 -1.007 25585
23 1 1 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.674 0.012 25585
24 1 1 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.710 0.232 25585
25 1 1 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.150 0.007 25585
26 1 1 . 1 1 8 8 ALA H H 8 9.286 9.286 8.912 0.374 25585
27 1 1 . 1 1 9 9 TYR N N 9 124.797 124.797 124.170 0.627 25585
28 1 1 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.237 0.101 25585
29 1 1 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.491 0.824 25585
30 1 1 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.272 0.526 25585
31 1 1 . 1 1 9 9 TYR H H 9 9.112 9.112 8.701 0.411 25585
32 1 1 . 1 1 10 10 ASN N N 10 128.087 128.087 125.649 2.438 25585
33 1 1 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.931 0.148 25585
34 1 1 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.511 -0.339 25585
35 1 1 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.072 -1.248 25585
36 1 1 . 1 1 10 10 ASN H H 10 8.210 8.210 8.547 -0.337 25585
37 1 1 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.099 -0.034 25585
38 1 1 . 1 1 11 11 PRO CA C 11 63.988 63.988 64.129 -0.141 25585
39 1 1 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.526 0.517 25585
40 1 1 . 1 1 12 12 VAL N N 12 119.341 119.341 115.117 4.224 25585
41 1 1 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.039 -0.281 25585
42 1 1 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.242 1.861 25585
43 1 1 . 1 1 12 12 VAL CB C 12 31.723 31.723 32.059 -0.336 25585
44 1 1 . 1 1 12 12 VAL H H 12 7.570 7.570 7.519 0.051 25585
45 1 1 . 1 1 13 13 LEU N N 13 116.412 116.412 120.254 -3.842 25585
46 1 1 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.715 -0.426 25585
47 1 1 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.316 0.504 25585
48 1 1 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.673 -0.689 25585
49 1 1 . 1 1 13 13 LEU H H 13 6.902 6.902 7.708 -0.806 25585
50 1 1 . 1 1 14 14 GLY N N 14 108.651 108.651 107.535 1.116 25585
51 1 1 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.083 1.160 25585
52 1 1 . 1 1 14 14 GLY H H 14 8.387 8.387 8.569 -0.182 25585
53 1 1 . 1 1 15 15 ILE N N 15 109.703 109.703 114.065 -4.362 25585
54 1 1 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.810 0.019 25585
55 1 1 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.787 -0.110 25585
56 1 1 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.362 3.011 25585
57 1 1 . 1 1 15 15 ILE H H 15 6.727 6.727 7.303 -0.576 25585
58 1 1 . 1 1 16 16 CYS N N 16 120.648 120.648 119.785 0.863 25585
59 1 1 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.281 -0.089 25585
60 1 1 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.447 -2.454 25585
61 1 1 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.474 15.650 25585
62 1 1 . 1 1 16 16 CYS H H 16 8.811 8.811 8.685 0.126 25585
63 1 1 . 1 1 17 17 THR N N 17 116.440 116.440 115.538 0.902 25585
64 1 1 . 1 1 17 17 THR HA H 17 4.859 4.859 4.834 0.025 25585
65 1 1 . 1 1 17 17 THR CB C 17 69.862 69.862 71.108 -1.246 25585
66 1 1 . 1 1 17 17 THR H H 17 9.357 9.357 9.150 0.207 25585
67 1 1 . 1 1 18 18 ILE N N 18 124.956 124.956 123.238 1.718 25585
68 1 1 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.102 0.290 25585
69 1 1 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.703 0.505 25585
70 1 1 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.248 0.688 25585
71 1 1 . 1 1 18 18 ILE H H 18 8.493 8.493 8.356 0.137 25585
72 1 1 . 1 1 19 19 THR N N 19 119.997 119.997 122.410 -2.413 25585
73 1 1 . 1 1 19 19 THR HA H 19 4.331 4.331 4.399 -0.068 25585
74 1 1 . 1 1 19 19 THR CA C 19 61.222 61.222 60.419 0.804 25585
75 1 1 . 1 1 19 19 THR CB C 19 69.839 69.839 70.257 -0.418 25585
76 1 1 . 1 1 19 19 THR H H 19 8.060 8.060 8.122 -0.062 25585
77 1 1 . 1 1 20 20 LEU N N 20 125.150 125.150 126.078 -0.928 25585
78 1 1 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.045 0.242 25585
79 1 1 . 1 1 20 20 LEU CA C 20 56.119 56.119 57.310 -1.191 25585
80 1 1 . 1 1 20 20 LEU CB C 20 42.079 42.079 41.727 0.352 25585
81 1 1 . 1 1 20 20 LEU H H 20 8.354 8.354 8.652 -0.298 25585
82 1 1 . 1 1 21 21 SER N N 21 115.796 115.796 113.214 2.582 25585
83 1 1 . 1 1 21 21 SER HA H 21 4.350 4.350 3.344 1.006 25585
84 1 1 . 1 1 21 21 SER CA C 21 58.899 58.899 60.549 -1.650 25585
85 1 1 . 1 1 21 21 SER CB C 21 63.363 63.363 62.996 0.367 25585
86 1 1 . 1 1 21 21 SER H H 21 8.274 8.274 7.913 0.361 25585
87 1 1 . 1 1 22 22 ARG N N 22 122.561 122.561 120.652 1.909 25585
88 1 1 . 1 1 22 22 ARG HA H 22 4.289 4.289 3.870 0.419 25585
89 1 1 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.223 -3.277 25585
90 1 1 . 1 1 22 22 ARG CB C 22 30.369 30.369 30.165 0.204 25585
91 1 1 . 1 1 22 22 ARG H H 22 8.149 8.149 7.274 0.875 25585
92 1 1 . 1 1 23 23 ILE N N 23 121.335 121.335 118.859 2.476 25585
93 1 1 . 1 1 23 23 ILE HA H 23 4.001 4.001 3.832 0.169 25585
94 1 1 . 1 1 23 23 ILE CA C 23 61.671 61.671 64.067 -2.396 25585
95 1 1 . 1 1 23 23 ILE CB C 23 38.383 38.383 38.379 0.004 25585
96 1 1 . 1 1 23 23 ILE H H 23 8.002 8.002 7.511 0.491 25585
97 1 1 . 1 1 24 24 GLU N N 24 122.372 122.372 117.986 4.386 25585
98 1 1 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.556 -0.347 25585
99 1 1 . 1 1 24 24 GLU CA C 24 56.115 56.115 56.009 0.106 25585
100 1 1 . 1 1 24 24 GLU CB C 24 29.306 29.306 29.886 -0.580 25585
101 1 1 . 1 1 24 24 GLU H H 24 8.317 8.317 8.507 -0.190 25585
102 1 1 . 1 1 25 25 HIS N N 25 118.365 118.365 121.802 -3.437 25585
103 1 1 . 1 1 25 25 HIS HA H 25 5.022 5.022 4.889 0.133 25585
104 1 1 . 1 1 25 25 HIS CA C 25 52.772 52.772 53.731 -0.959 25585
105 1 1 . 1 1 25 25 HIS CB C 25 28.551 28.551 29.778 -1.227 25585
106 1 1 . 1 1 25 25 HIS H H 25 8.323 8.323 8.709 -0.386 25585
107 1 1 . 1 1 26 26 PRO HA H 26 4.468 4.468 3.493 0.975 25585
108 1 1 . 1 1 26 26 PRO CA C 26 63.834 63.834 64.689 -0.855 25585
109 1 1 . 1 1 26 26 PRO CB C 26 31.936 31.936 31.687 0.249 25585
110 1 1 . 1 1 27 27 GLY N N 27 108.880 108.880 103.585 5.295 25585
111 1 1 . 1 1 27 27 GLY CA C 27 45.212 45.212 46.214 -1.002 25585
112 1 1 . 1 1 27 27 GLY H H 27 8.594 8.594 8.422 0.172 25585
113 1 1 . 1 1 28 28 ASN N N 28 118.144 118.144 122.499 -4.355 25585
114 1 1 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.580 0.085 25585
115 1 1 . 1 1 28 28 ASN CA C 28 52.967 52.967 55.348 -2.381 25585
116 1 1 . 1 1 28 28 ASN CB C 28 38.579 38.579 38.890 -0.311 25585
117 1 1 . 1 1 28 28 ASN H H 28 8.154 8.154 7.895 0.259 25585
118 1 1 . 1 1 29 29 TYR N N 29 119.962 119.962 114.653 5.309 25585
119 1 1 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.885 -0.365 25585
120 1 1 . 1 1 29 29 TYR CA C 29 57.544 57.544 54.956 2.588 25585
121 1 1 . 1 1 29 29 TYR CB C 29 39.011 39.011 37.941 1.069 25585
122 1 1 . 1 1 29 29 TYR H H 29 8.058 8.058 7.715 0.343 25585
123 1 1 . 1 1 30 30 ASP N N 30 120.874 120.874 122.394 -1.520 25585
124 1 1 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.166 0.513 25585
125 1 1 . 1 1 30 30 ASP CA C 30 52.827 52.827 55.636 -2.809 25585
126 1 1 . 1 1 30 30 ASP CB C 30 38.567 38.567 41.024 -2.457 25585
127 1 1 . 1 1 30 30 ASP H H 30 8.226 8.226 7.993 0.233 25585
128 1 2 . 1 1 3 3 CYS N N 3 120.614 120.614 123.563 -2.949 25585
129 1 2 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.512 0.287 25585
130 1 2 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.805 -6.013 25585
131 1 2 . 1 1 3 3 CYS CB C 3 42.170 42.170 29.750 12.420 25585
132 1 2 . 1 1 3 3 CYS H H 3 7.958 7.958 7.576 0.382 25585
133 1 2 . 1 1 4 4 GLN N N 4 121.450 121.450 120.866 0.584 25585
134 1 2 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.143 0.037 25585
135 1 2 . 1 1 4 4 GLN CA C 4 54.557 54.557 52.985 1.572 25585
136 1 2 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.423 -1.232 25585
137 1 2 . 1 1 4 4 GLN H H 4 8.737 8.737 8.149 0.588 25585
138 1 2 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.187 0.222 25585
139 1 2 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.292 0.062 25585
140 1 2 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.747 -0.037 25585
141 1 2 . 1 1 6 6 GLY N N 6 111.865 111.865 109.986 1.879 25585
142 1 2 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.534 -0.471 25585
143 1 2 . 1 1 6 6 GLY H H 6 8.948 8.948 8.577 0.371 25585
144 1 2 . 1 1 7 7 TYR N N 7 120.136 120.136 119.820 0.316 25585
145 1 2 . 1 1 7 7 TYR HA H 7 5.057 5.057 4.992 0.065 25585
146 1 2 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.523 -0.130 25585
147 1 2 . 1 1 7 7 TYR CB C 7 41.345 41.345 41.925 -0.580 25585
148 1 2 . 1 1 7 7 TYR H H 7 8.300 8.300 7.619 0.681 25585
149 1 2 . 1 1 8 8 ALA N N 8 121.599 121.599 123.030 -1.431 25585
150 1 2 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.679 0.007 25585
151 1 2 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.577 0.365 25585
152 1 2 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.026 0.131 25585
153 1 2 . 1 1 8 8 ALA H H 8 9.286 9.286 8.958 0.328 25585
154 1 2 . 1 1 9 9 TYR N N 9 124.797 124.797 124.988 -0.191 25585
155 1 2 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.217 0.121 25585
156 1 2 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.198 1.117 25585
157 1 2 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.107 0.691 25585
158 1 2 . 1 1 9 9 TYR H H 9 9.112 9.112 8.728 0.384 25585
159 1 2 . 1 1 10 10 ASN N N 10 128.087 128.087 125.983 2.104 25585
160 1 2 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.881 0.198 25585
161 1 2 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.506 -0.334 25585
162 1 2 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.343 -1.518 25585
163 1 2 . 1 1 10 10 ASN H H 10 8.210 8.210 8.534 -0.324 25585
164 1 2 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.392 -0.327 25585
165 1 2 . 1 1 11 11 PRO CA C 11 63.988 63.988 64.207 -0.219 25585
166 1 2 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.627 0.416 25585
167 1 2 . 1 1 12 12 VAL N N 12 119.341 119.341 116.118 3.223 25585
168 1 2 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.095 -0.337 25585
169 1 2 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.384 1.719 25585
170 1 2 . 1 1 12 12 VAL CB C 12 31.723 31.723 31.834 -0.111 25585
171 1 2 . 1 1 12 12 VAL H H 12 7.570 7.570 7.527 0.043 25585
172 1 2 . 1 1 13 13 LEU N N 13 116.412 116.412 120.139 -3.727 25585
173 1 2 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.744 -0.455 25585
174 1 2 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.238 0.582 25585
175 1 2 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.450 -0.466 25585
176 1 2 . 1 1 13 13 LEU H H 13 6.902 6.902 7.519 -0.617 25585
177 1 2 . 1 1 14 14 GLY N N 14 108.651 108.651 107.435 1.216 25585
178 1 2 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.047 1.196 25585
179 1 2 . 1 1 14 14 GLY H H 14 8.387 8.387 8.549 -0.162 25585
180 1 2 . 1 1 15 15 ILE N N 15 109.703 109.703 113.655 -3.952 25585
181 1 2 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.740 0.089 25585
182 1 2 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.932 -0.255 25585
183 1 2 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.299 3.074 25585
184 1 2 . 1 1 15 15 ILE H H 15 6.727 6.727 7.414 -0.687 25585
185 1 2 . 1 1 16 16 CYS N N 16 120.648 120.648 120.211 0.437 25585
186 1 2 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.294 -0.102 25585
187 1 2 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.830 -2.837 25585
188 1 2 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.167 15.957 25585
189 1 2 . 1 1 16 16 CYS H H 16 8.811 8.811 8.709 0.102 25585
190 1 2 . 1 1 17 17 THR N N 17 116.440 116.440 114.964 1.476 25585
191 1 2 . 1 1 17 17 THR HA H 17 4.859 4.859 4.844 0.015 25585
192 1 2 . 1 1 17 17 THR CB C 17 69.862 69.862 71.725 -1.863 25585
193 1 2 . 1 1 17 17 THR H H 17 9.357 9.357 8.890 0.467 25585
194 1 2 . 1 1 18 18 ILE N N 18 124.956 124.956 123.787 1.169 25585
195 1 2 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.202 0.190 25585
196 1 2 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.390 0.818 25585
197 1 2 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.346 0.590 25585
198 1 2 . 1 1 18 18 ILE H H 18 8.493 8.493 8.361 0.132 25585
199 1 2 . 1 1 19 19 THR N N 19 119.997 119.997 122.457 -2.460 25585
200 1 2 . 1 1 19 19 THR HA H 19 4.331 4.331 4.303 0.028 25585
201 1 2 . 1 1 19 19 THR CA C 19 61.222 61.222 60.631 0.591 25585
202 1 2 . 1 1 19 19 THR CB C 19 69.839 69.839 70.211 -0.372 25585
203 1 2 . 1 1 19 19 THR H H 19 8.060 8.060 7.978 0.082 25585
204 1 2 . 1 1 20 20 LEU N N 20 125.150 125.150 128.004 -2.854 25585
205 1 2 . 1 1 20 20 LEU HA H 20 4.287 4.287 3.986 0.301 25585
206 1 2 . 1 1 20 20 LEU CA C 20 56.119 56.119 57.245 -1.126 25585
207 1 2 . 1 1 20 20 LEU CB C 20 42.079 42.079 41.776 0.303 25585
208 1 2 . 1 1 20 20 LEU H H 20 8.354 8.354 8.654 -0.300 25585
209 1 2 . 1 1 21 21 SER N N 21 115.796 115.796 113.583 2.213 25585
210 1 2 . 1 1 21 21 SER HA H 21 4.350 4.350 4.151 0.199 25585
211 1 2 . 1 1 21 21 SER CA C 21 58.899 58.899 60.824 -1.925 25585
212 1 2 . 1 1 21 21 SER CB C 21 63.363 63.363 62.679 0.684 25585
213 1 2 . 1 1 21 21 SER H H 21 8.274 8.274 7.609 0.665 25585
214 1 2 . 1 1 22 22 ARG N N 22 122.561 122.561 120.924 1.637 25585
215 1 2 . 1 1 22 22 ARG HA H 22 4.289 4.289 4.077 0.212 25585
216 1 2 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.499 -3.553 25585
217 1 2 . 1 1 22 22 ARG CB C 22 30.369 30.369 30.143 0.226 25585
218 1 2 . 1 1 22 22 ARG H H 22 8.149 8.149 7.566 0.583 25585
219 1 2 . 1 1 23 23 ILE N N 23 121.335 121.335 118.718 2.617 25585
220 1 2 . 1 1 23 23 ILE HA H 23 4.001 4.001 3.985 0.016 25585
221 1 2 . 1 1 23 23 ILE CA C 23 61.671 61.671 62.959 -1.288 25585
222 1 2 . 1 1 23 23 ILE CB C 23 38.383 38.383 37.888 0.495 25585
223 1 2 . 1 1 23 23 ILE H H 23 8.002 8.002 7.388 0.614 25585
224 1 2 . 1 1 24 24 GLU N N 24 122.372 122.372 117.668 4.704 25585
225 1 2 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.445 -0.236 25585
226 1 2 . 1 1 24 24 GLU CA C 24 56.115 56.115 56.161 -0.046 25585
227 1 2 . 1 1 24 24 GLU CB C 24 29.306 29.306 29.868 -0.562 25585
228 1 2 . 1 1 24 24 GLU H H 24 8.317 8.317 8.620 -0.303 25585
229 1 2 . 1 1 25 25 HIS N N 25 118.365 118.365 119.891 -1.526 25585
230 1 2 . 1 1 25 25 HIS HA H 25 5.022 5.022 5.035 -0.013 25585
231 1 2 . 1 1 25 25 HIS CA C 25 52.772 52.772 54.124 -1.352 25585
232 1 2 . 1 1 25 25 HIS CB C 25 28.551 28.551 30.808 -2.257 25585
233 1 2 . 1 1 25 25 HIS H H 25 8.323 8.323 8.292 0.031 25585
234 1 2 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.411 0.057 25585
235 1 2 . 1 1 26 26 PRO CA C 26 63.834 63.834 64.657 -0.824 25585
236 1 2 . 1 1 26 26 PRO CB C 26 31.936 31.936 32.031 -0.095 25585
237 1 2 . 1 1 27 27 GLY N N 27 108.880 108.880 106.580 2.300 25585
238 1 2 . 1 1 27 27 GLY CA C 27 45.212 45.212 46.776 -1.565 25585
239 1 2 . 1 1 27 27 GLY H H 27 8.594 8.594 8.685 -0.091 25585
240 1 2 . 1 1 28 28 ASN N N 28 118.144 118.144 119.854 -1.710 25585
241 1 2 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.345 0.320 25585
242 1 2 . 1 1 28 28 ASN CA C 28 52.967 52.967 55.486 -2.519 25585
243 1 2 . 1 1 28 28 ASN CB C 28 38.579 38.579 38.727 -0.148 25585
244 1 2 . 1 1 28 28 ASN H H 28 8.154 8.154 8.452 -0.298 25585
245 1 2 . 1 1 29 29 TYR N N 29 119.962 119.962 117.064 2.898 25585
246 1 2 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.763 -0.243 25585
247 1 2 . 1 1 29 29 TYR CA C 29 57.544 57.544 56.930 0.614 25585
248 1 2 . 1 1 29 29 TYR CB C 29 39.011 39.011 37.337 1.674 25585
249 1 2 . 1 1 29 29 TYR H H 29 8.058 8.058 7.771 0.287 25585
250 1 2 . 1 1 30 30 ASP N N 30 120.874 120.874 121.920 -1.046 25585
251 1 2 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.477 0.202 25585
252 1 2 . 1 1 30 30 ASP CA C 30 52.827 52.827 55.605 -2.778 25585
253 1 2 . 1 1 30 30 ASP CB C 30 38.567 38.567 41.208 -2.641 25585
254 1 2 . 1 1 30 30 ASP H H 30 8.226 8.226 8.611 -0.385 25585
255 1 3 . 1 1 3 3 CYS N N 3 120.614 120.614 123.813 -3.199 25585
256 1 3 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.537 0.262 25585
257 1 3 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.178 -5.386 25585
258 1 3 . 1 1 3 3 CYS CB C 3 42.170 42.170 30.226 11.944 25585
259 1 3 . 1 1 3 3 CYS H H 3 7.958 7.958 7.583 0.375 25585
260 1 3 . 1 1 4 4 GLN N N 4 121.450 121.450 120.649 0.801 25585
261 1 3 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.160 0.020 25585
262 1 3 . 1 1 4 4 GLN CA C 4 54.557 54.557 52.945 1.612 25585
263 1 3 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.446 -1.255 25585
264 1 3 . 1 1 4 4 GLN H H 4 8.737 8.737 8.144 0.593 25585
265 1 3 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.313 0.096 25585
266 1 3 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.450 -0.096 25585
267 1 3 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.489 0.221 25585
268 1 3 . 1 1 6 6 GLY N N 6 111.865 111.865 110.589 1.276 25585
269 1 3 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.604 -0.541 25585
270 1 3 . 1 1 6 6 GLY H H 6 8.948 8.948 8.706 0.242 25585
271 1 3 . 1 1 7 7 TYR N N 7 120.136 120.136 119.515 0.621 25585
272 1 3 . 1 1 7 7 TYR HA H 7 5.057 5.057 5.048 0.009 25585
273 1 3 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.509 -0.116 25585
274 1 3 . 1 1 7 7 TYR CB C 7 41.345 41.345 42.184 -0.838 25585
275 1 3 . 1 1 7 7 TYR H H 7 8.300 8.300 7.667 0.633 25585
276 1 3 . 1 1 8 8 ALA N N 8 121.599 121.599 123.027 -1.428 25585
277 1 3 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.702 -0.016 25585
278 1 3 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.676 0.266 25585
279 1 3 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.154 0.003 25585
280 1 3 . 1 1 8 8 ALA H H 8 9.286 9.286 8.827 0.459 25585
281 1 3 . 1 1 9 9 TYR N N 9 124.797 124.797 124.394 0.403 25585
282 1 3 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.232 0.106 25585
283 1 3 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.457 0.858 25585
284 1 3 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.237 0.561 25585
285 1 3 . 1 1 9 9 TYR H H 9 9.112 9.112 8.722 0.390 25585
286 1 3 . 1 1 10 10 ASN N N 10 128.087 128.087 125.703 2.384 25585
287 1 3 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.931 0.148 25585
288 1 3 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.523 -0.351 25585
289 1 3 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.086 -1.262 25585
290 1 3 . 1 1 10 10 ASN H H 10 8.210 8.210 8.422 -0.212 25585
291 1 3 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.150 -0.085 25585
292 1 3 . 1 1 11 11 PRO CA C 11 63.988 63.988 64.306 -0.318 25585
293 1 3 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.541 0.502 25585
294 1 3 . 1 1 12 12 VAL N N 12 119.341 119.341 115.400 3.941 25585
295 1 3 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.082 -0.324 25585
296 1 3 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.491 1.612 25585
297 1 3 . 1 1 12 12 VAL CB C 12 31.723 31.723 31.913 -0.190 25585
298 1 3 . 1 1 12 12 VAL H H 12 7.570 7.570 7.493 0.077 25585
299 1 3 . 1 1 13 13 LEU N N 13 116.412 116.412 120.013 -3.601 25585
300 1 3 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.758 -0.469 25585
301 1 3 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.189 0.631 25585
302 1 3 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.553 -0.569 25585
303 1 3 . 1 1 13 13 LEU H H 13 6.902 6.902 7.726 -0.824 25585
304 1 3 . 1 1 14 14 GLY N N 14 108.651 108.651 107.160 1.491 25585
305 1 3 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.141 1.102 25585
306 1 3 . 1 1 14 14 GLY H H 14 8.387 8.387 8.595 -0.208 25585
307 1 3 . 1 1 15 15 ILE N N 15 109.703 109.703 113.899 -4.196 25585
308 1 3 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.789 0.040 25585
309 1 3 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.954 -0.277 25585
310 1 3 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.360 3.013 25585
311 1 3 . 1 1 15 15 ILE H H 15 6.727 6.727 7.333 -0.606 25585
312 1 3 . 1 1 16 16 CYS N N 16 120.648 120.648 119.690 0.958 25585
313 1 3 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.248 -0.056 25585
314 1 3 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.708 -2.715 25585
315 1 3 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.154 15.970 25585
316 1 3 . 1 1 16 16 CYS H H 16 8.811 8.811 8.723 0.088 25585
317 1 3 . 1 1 17 17 THR N N 17 116.440 116.440 114.835 1.605 25585
318 1 3 . 1 1 17 17 THR HA H 17 4.859 4.859 4.922 -0.063 25585
319 1 3 . 1 1 17 17 THR CB C 17 69.862 69.862 72.001 -2.139 25585
320 1 3 . 1 1 17 17 THR H H 17 9.357 9.357 8.924 0.433 25585
321 1 3 . 1 1 18 18 ILE N N 18 124.956 124.956 123.977 0.979 25585
322 1 3 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.104 0.288 25585
323 1 3 . 1 1 18 18 ILE CA C 18 62.208 62.208 62.087 0.121 25585
324 1 3 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.391 0.544 25585
325 1 3 . 1 1 18 18 ILE H H 18 8.493 8.493 8.451 0.042 25585
326 1 3 . 1 1 19 19 THR N N 19 119.997 119.997 122.544 -2.547 25585
327 1 3 . 1 1 19 19 THR HA H 19 4.331 4.331 4.523 -0.192 25585
328 1 3 . 1 1 19 19 THR CA C 19 61.222 61.222 59.855 1.367 25585
329 1 3 . 1 1 19 19 THR CB C 19 69.839 69.839 70.556 -0.717 25585
330 1 3 . 1 1 19 19 THR H H 19 8.060 8.060 8.238 -0.178 25585
331 1 3 . 1 1 20 20 LEU N N 20 125.150 125.150 124.658 0.492 25585
332 1 3 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.174 0.113 25585
333 1 3 . 1 1 20 20 LEU CA C 20 56.119 56.119 57.258 -1.139 25585
334 1 3 . 1 1 20 20 LEU CB C 20 42.079 42.079 42.038 0.041 25585
335 1 3 . 1 1 20 20 LEU H H 20 8.354 8.354 8.584 -0.230 25585
336 1 3 . 1 1 21 21 SER N N 21 115.796 115.796 115.100 0.696 25585
337 1 3 . 1 1 21 21 SER HA H 21 4.350 4.350 4.169 0.181 25585
338 1 3 . 1 1 21 21 SER CA C 21 58.899 58.899 61.587 -2.688 25585
339 1 3 . 1 1 21 21 SER CB C 21 63.363 63.363 62.754 0.609 25585
340 1 3 . 1 1 21 21 SER H H 21 8.274 8.274 8.023 0.251 25585
341 1 3 . 1 1 22 22 ARG N N 22 122.561 122.561 121.308 1.253 25585
342 1 3 . 1 1 22 22 ARG HA H 22 4.289 4.289 4.027 0.262 25585
343 1 3 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.635 -3.689 25585
344 1 3 . 1 1 22 22 ARG CB C 22 30.369 30.369 30.010 0.359 25585
345 1 3 . 1 1 22 22 ARG H H 22 8.149 8.149 7.496 0.653 25585
346 1 3 . 1 1 23 23 ILE N N 23 121.335 121.335 119.648 1.687 25585
347 1 3 . 1 1 23 23 ILE HA H 23 4.001 4.001 3.828 0.173 25585
348 1 3 . 1 1 23 23 ILE CA C 23 61.671 61.671 63.841 -2.170 25585
349 1 3 . 1 1 23 23 ILE CB C 23 38.383 38.383 37.704 0.679 25585
350 1 3 . 1 1 23 23 ILE H H 23 8.002 8.002 8.352 -0.350 25585
351 1 3 . 1 1 24 24 GLU N N 24 122.372 122.372 113.747 8.625 25585
352 1 3 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.328 -0.119 25585
353 1 3 . 1 1 24 24 GLU CA C 24 56.115 56.115 55.629 0.486 25585
354 1 3 . 1 1 24 24 GLU CB C 24 29.306 29.306 30.642 -1.336 25585
355 1 3 . 1 1 24 24 GLU H H 24 8.317 8.317 8.483 -0.166 25585
356 1 3 . 1 1 25 25 HIS N N 25 118.365 118.365 118.909 -0.544 25585
357 1 3 . 1 1 25 25 HIS HA H 25 5.022 5.022 4.890 0.132 25585
358 1 3 . 1 1 25 25 HIS CA C 25 52.772 52.772 53.797 -1.024 25585
359 1 3 . 1 1 25 25 HIS CB C 25 28.551 28.551 29.379 -0.828 25585
360 1 3 . 1 1 25 25 HIS H H 25 8.323 8.323 7.678 0.645 25585
361 1 3 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.435 0.033 25585
362 1 3 . 1 1 26 26 PRO CA C 26 63.834 63.834 64.192 -0.358 25585
363 1 3 . 1 1 26 26 PRO CB C 26 31.936 31.936 31.920 0.016 25585
364 1 3 . 1 1 27 27 GLY N N 27 108.880 108.880 106.289 2.591 25585
365 1 3 . 1 1 27 27 GLY CA C 27 45.212 45.212 44.973 0.239 25585
366 1 3 . 1 1 27 27 GLY H H 27 8.594 8.594 8.366 0.228 25585
367 1 3 . 1 1 28 28 ASN N N 28 118.144 118.144 118.519 -0.375 25585
368 1 3 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.182 0.483 25585
369 1 3 . 1 1 28 28 ASN CA C 28 52.967 52.967 53.755 -0.788 25585
370 1 3 . 1 1 28 28 ASN CB C 28 38.579 38.579 37.659 0.920 25585
371 1 3 . 1 1 28 28 ASN H H 28 8.154 8.154 7.674 0.480 25585
372 1 3 . 1 1 29 29 TYR N N 29 119.962 119.962 113.514 6.448 25585
373 1 3 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.238 0.282 25585
374 1 3 . 1 1 29 29 TYR CA C 29 57.544 57.544 58.840 -1.296 25585
375 1 3 . 1 1 29 29 TYR CB C 29 39.011 39.011 36.381 2.630 25585
376 1 3 . 1 1 29 29 TYR H H 29 8.058 8.058 7.836 0.222 25585
377 1 3 . 1 1 30 30 ASP N N 30 120.874 120.874 116.648 4.226 25585
378 1 3 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.297 0.382 25585
379 1 3 . 1 1 30 30 ASP CA C 30 52.827 52.827 55.696 -2.869 25585
380 1 3 . 1 1 30 30 ASP CB C 30 38.567 38.567 40.132 -1.565 25585
381 1 3 . 1 1 30 30 ASP H H 30 8.226 8.226 7.934 0.292 25585
382 1 4 . 1 1 3 3 CYS N N 3 120.614 120.614 124.102 -3.488 25585
383 1 4 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.581 0.218 25585
384 1 4 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.275 -5.483 25585
385 1 4 . 1 1 3 3 CYS CB C 3 42.170 42.170 30.072 12.098 25585
386 1 4 . 1 1 3 3 CYS H H 3 7.958 7.958 7.648 0.310 25585
387 1 4 . 1 1 4 4 GLN N N 4 121.450 121.450 120.923 0.527 25585
388 1 4 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.157 0.023 25585
389 1 4 . 1 1 4 4 GLN CA C 4 54.557 54.557 53.062 1.495 25585
390 1 4 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.409 -1.218 25585
391 1 4 . 1 1 4 4 GLN H H 4 8.737 8.737 8.183 0.554 25585
392 1 4 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.234 0.175 25585
393 1 4 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.329 0.025 25585
394 1 4 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.761 -0.051 25585
395 1 4 . 1 1 6 6 GLY N N 6 111.865 111.865 109.237 2.628 25585
396 1 4 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.317 -0.254 25585
397 1 4 . 1 1 6 6 GLY H H 6 8.948 8.948 8.334 0.614 25585
398 1 4 . 1 1 7 7 TYR N N 7 120.136 120.136 119.389 0.747 25585
399 1 4 . 1 1 7 7 TYR HA H 7 5.057 5.057 5.002 0.055 25585
400 1 4 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.391 0.002 25585
401 1 4 . 1 1 7 7 TYR CB C 7 41.345 41.345 42.189 -0.844 25585
402 1 4 . 1 1 7 7 TYR H H 7 8.300 8.300 7.455 0.845 25585
403 1 4 . 1 1 8 8 ALA N N 8 121.599 121.599 122.759 -1.160 25585
404 1 4 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.750 -0.064 25585
405 1 4 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.720 0.222 25585
406 1 4 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.209 -0.052 25585
407 1 4 . 1 1 8 8 ALA H H 8 9.286 9.286 8.931 0.355 25585
408 1 4 . 1 1 9 9 TYR N N 9 124.797 124.797 124.436 0.361 25585
409 1 4 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.241 0.097 25585
410 1 4 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.541 0.774 25585
411 1 4 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.250 0.548 25585
412 1 4 . 1 1 9 9 TYR H H 9 9.112 9.112 8.748 0.364 25585
413 1 4 . 1 1 10 10 ASN N N 10 128.087 128.087 125.713 2.374 25585
414 1 4 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.935 0.144 25585
415 1 4 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.527 -0.355 25585
416 1 4 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.080 -1.256 25585
417 1 4 . 1 1 10 10 ASN H H 10 8.210 8.210 8.418 -0.208 25585
418 1 4 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.101 -0.036 25585
419 1 4 . 1 1 11 11 PRO CA C 11 63.988 63.988 63.996 -0.008 25585
420 1 4 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.507 0.536 25585
421 1 4 . 1 1 12 12 VAL N N 12 119.341 119.341 115.564 3.777 25585
422 1 4 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.084 -0.326 25585
423 1 4 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.314 1.789 25585
424 1 4 . 1 1 12 12 VAL CB C 12 31.723 31.723 31.633 0.090 25585
425 1 4 . 1 1 12 12 VAL H H 12 7.570 7.570 7.463 0.107 25585
426 1 4 . 1 1 13 13 LEU N N 13 116.412 116.412 120.356 -3.944 25585
427 1 4 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.665 -0.376 25585
428 1 4 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.371 0.449 25585
429 1 4 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.617 -0.633 25585
430 1 4 . 1 1 13 13 LEU H H 13 6.902 6.902 7.673 -0.771 25585
431 1 4 . 1 1 14 14 GLY N N 14 108.651 108.651 106.614 2.037 25585
432 1 4 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.192 1.051 25585
433 1 4 . 1 1 14 14 GLY H H 14 8.387 8.387 8.460 -0.073 25585
434 1 4 . 1 1 15 15 ILE N N 15 109.703 109.703 113.150 -3.447 25585
435 1 4 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.777 0.052 25585
436 1 4 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.721 -0.044 25585
437 1 4 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.314 3.059 25585
438 1 4 . 1 1 15 15 ILE H H 15 6.727 6.727 7.294 -0.567 25585
439 1 4 . 1 1 16 16 CYS N N 16 120.648 120.648 120.421 0.227 25585
440 1 4 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.264 -0.072 25585
441 1 4 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.588 -2.595 25585
442 1 4 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.137 15.987 25585
443 1 4 . 1 1 16 16 CYS H H 16 8.811 8.811 8.658 0.153 25585
444 1 4 . 1 1 17 17 THR N N 17 116.440 116.440 115.327 1.113 25585
445 1 4 . 1 1 17 17 THR HA H 17 4.859 4.859 4.832 0.027 25585
446 1 4 . 1 1 17 17 THR CB C 17 69.862 69.862 71.683 -1.821 25585
447 1 4 . 1 1 17 17 THR H H 17 9.357 9.357 8.919 0.438 25585
448 1 4 . 1 1 18 18 ILE N N 18 124.956 124.956 123.904 1.052 25585
449 1 4 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.106 0.286 25585
450 1 4 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.842 0.366 25585
451 1 4 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.364 0.571 25585
452 1 4 . 1 1 18 18 ILE H H 18 8.493 8.493 8.428 0.065 25585
453 1 4 . 1 1 19 19 THR N N 19 119.997 119.997 122.019 -2.022 25585
454 1 4 . 1 1 19 19 THR HA H 19 4.331 4.331 4.450 -0.119 25585
455 1 4 . 1 1 19 19 THR CA C 19 61.222 61.222 59.552 1.670 25585
456 1 4 . 1 1 19 19 THR CB C 19 69.839 69.839 70.589 -0.750 25585
457 1 4 . 1 1 19 19 THR H H 19 8.060 8.060 7.936 0.124 25585
458 1 4 . 1 1 20 20 LEU N N 20 125.150 125.150 123.923 1.227 25585
459 1 4 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.169 0.118 25585
460 1 4 . 1 1 20 20 LEU CA C 20 56.119 56.119 57.411 -1.292 25585
461 1 4 . 1 1 20 20 LEU CB C 20 42.079 42.079 41.748 0.331 25585
462 1 4 . 1 1 20 20 LEU H H 20 8.354 8.354 8.683 -0.329 25585
463 1 4 . 1 1 21 21 SER N N 21 115.796 115.796 114.415 1.381 25585
464 1 4 . 1 1 21 21 SER HA H 21 4.350 4.350 4.318 0.032 25585
465 1 4 . 1 1 21 21 SER CA C 21 58.899 58.899 60.716 -1.817 25585
466 1 4 . 1 1 21 21 SER CB C 21 63.363 63.363 63.189 0.174 25585
467 1 4 . 1 1 21 21 SER H H 21 8.274 8.274 8.315 -0.041 25585
468 1 4 . 1 1 22 22 ARG N N 22 122.561 122.561 121.247 1.314 25585
469 1 4 . 1 1 22 22 ARG HA H 22 4.289 4.289 3.975 0.314 25585
470 1 4 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.094 -3.148 25585
471 1 4 . 1 1 22 22 ARG CB C 22 30.369 30.369 29.246 1.123 25585
472 1 4 . 1 1 22 22 ARG H H 22 8.149 8.149 7.630 0.519 25585
473 1 4 . 1 1 23 23 ILE N N 23 121.335 121.335 120.984 0.351 25585
474 1 4 . 1 1 23 23 ILE HA H 23 4.001 4.001 3.835 0.166 25585
475 1 4 . 1 1 23 23 ILE CA C 23 61.671 61.671 63.671 -2.000 25585
476 1 4 . 1 1 23 23 ILE CB C 23 38.383 38.383 38.124 0.259 25585
477 1 4 . 1 1 23 23 ILE H H 23 8.002 8.002 7.872 0.130 25585
478 1 4 . 1 1 24 24 GLU N N 24 122.372 122.372 116.116 6.256 25585
479 1 4 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.392 -0.183 25585
480 1 4 . 1 1 24 24 GLU CA C 24 56.115 56.115 55.570 0.545 25585
481 1 4 . 1 1 24 24 GLU CB C 24 29.306 29.306 29.276 0.030 25585
482 1 4 . 1 1 24 24 GLU H H 24 8.317 8.317 8.403 -0.086 25585
483 1 4 . 1 1 25 25 HIS N N 25 118.365 118.365 119.728 -1.363 25585
484 1 4 . 1 1 25 25 HIS HA H 25 5.022 5.022 5.034 -0.012 25585
485 1 4 . 1 1 25 25 HIS CA C 25 52.772 52.772 54.368 -1.596 25585
486 1 4 . 1 1 25 25 HIS CB C 25 28.551 28.551 29.812 -1.261 25585
487 1 4 . 1 1 25 25 HIS H H 25 8.323 8.323 7.929 0.394 25585
488 1 4 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.606 -0.138 25585
489 1 4 . 1 1 26 26 PRO CA C 26 63.834 63.834 64.023 -0.189 25585
490 1 4 . 1 1 26 26 PRO CB C 26 31.936 31.936 31.795 0.141 25585
491 1 4 . 1 1 27 27 GLY N N 27 108.880 108.880 107.776 1.104 25585
492 1 4 . 1 1 27 27 GLY CA C 27 45.212 45.212 46.341 -1.129 25585
493 1 4 . 1 1 27 27 GLY H H 27 8.594 8.594 8.680 -0.086 25585
494 1 4 . 1 1 28 28 ASN N N 28 118.144 118.144 120.525 -2.381 25585
495 1 4 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.521 0.144 25585
496 1 4 . 1 1 28 28 ASN CA C 28 52.967 52.967 55.316 -2.349 25585
497 1 4 . 1 1 28 28 ASN CB C 28 38.579 38.579 38.255 0.324 25585
498 1 4 . 1 1 28 28 ASN H H 28 8.154 8.154 8.024 0.130 25585
499 1 4 . 1 1 29 29 TYR N N 29 119.962 119.962 115.783 4.179 25585
500 1 4 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.676 -0.156 25585
501 1 4 . 1 1 29 29 TYR CA C 29 57.544 57.544 56.574 0.970 25585
502 1 4 . 1 1 29 29 TYR CB C 29 39.011 39.011 38.195 0.816 25585
503 1 4 . 1 1 29 29 TYR H H 29 8.058 8.058 7.906 0.152 25585
504 1 4 . 1 1 30 30 ASP N N 30 120.874 120.874 122.556 -1.682 25585
505 1 4 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.684 -0.005 25585
506 1 4 . 1 1 30 30 ASP CA C 30 52.827 52.827 53.697 -0.870 25585
507 1 4 . 1 1 30 30 ASP CB C 30 38.567 38.567 39.613 -1.046 25585
508 1 4 . 1 1 30 30 ASP H H 30 8.226 8.226 7.657 0.569 25585
509 1 5 . 1 1 3 3 CYS N N 3 120.614 120.614 123.933 -3.319 25585
510 1 5 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.527 0.272 25585
511 1 5 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.224 -5.432 25585
512 1 5 . 1 1 3 3 CYS CB C 3 42.170 42.170 30.078 12.092 25585
513 1 5 . 1 1 3 3 CYS H H 3 7.958 7.958 7.669 0.289 25585
514 1 5 . 1 1 4 4 GLN N N 4 121.450 121.450 121.492 -0.042 25585
515 1 5 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.053 0.127 25585
516 1 5 . 1 1 4 4 GLN CA C 4 54.557 54.557 53.457 1.100 25585
517 1 5 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.169 -0.979 25585
518 1 5 . 1 1 4 4 GLN H H 4 8.737 8.737 8.183 0.554 25585
519 1 5 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.366 0.043 25585
520 1 5 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.197 0.157 25585
521 1 5 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.979 -0.269 25585
522 1 5 . 1 1 6 6 GLY N N 6 111.865 111.865 110.000 1.865 25585
523 1 5 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.281 -0.218 25585
524 1 5 . 1 1 6 6 GLY H H 6 8.948 8.948 8.659 0.289 25585
525 1 5 . 1 1 7 7 TYR N N 7 120.136 120.136 119.774 0.362 25585
526 1 5 . 1 1 7 7 TYR HA H 7 5.057 5.057 4.983 0.074 25585
527 1 5 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.541 -0.147 25585
528 1 5 . 1 1 7 7 TYR CB C 7 41.345 41.345 41.912 -0.567 25585
529 1 5 . 1 1 7 7 TYR H H 7 8.300 8.300 7.581 0.719 25585
530 1 5 . 1 1 8 8 ALA N N 8 121.599 121.599 122.667 -1.068 25585
531 1 5 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.708 -0.022 25585
532 1 5 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.629 0.313 25585
533 1 5 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.153 0.004 25585
534 1 5 . 1 1 8 8 ALA H H 8 9.286 9.286 8.946 0.340 25585
535 1 5 . 1 1 9 9 TYR N N 9 124.797 124.797 124.352 0.445 25585
536 1 5 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.258 0.080 25585
537 1 5 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.413 0.902 25585
538 1 5 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.303 0.495 25585
539 1 5 . 1 1 9 9 TYR H H 9 9.112 9.112 8.728 0.384 25585
540 1 5 . 1 1 10 10 ASN N N 10 128.087 128.087 125.699 2.388 25585
541 1 5 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.936 0.143 25585
542 1 5 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.520 -0.348 25585
543 1 5 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.075 -1.251 25585
544 1 5 . 1 1 10 10 ASN H H 10 8.210 8.210 8.381 -0.171 25585
545 1 5 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.116 -0.051 25585
546 1 5 . 1 1 11 11 PRO CA C 11 63.988 63.988 64.121 -0.133 25585
547 1 5 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.550 0.493 25585
548 1 5 . 1 1 12 12 VAL N N 12 119.341 119.341 115.206 4.135 25585
549 1 5 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.039 -0.281 25585
550 1 5 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.252 1.851 25585
551 1 5 . 1 1 12 12 VAL CB C 12 31.723 31.723 32.063 -0.340 25585
552 1 5 . 1 1 12 12 VAL H H 12 7.570 7.570 7.526 0.044 25585
553 1 5 . 1 1 13 13 LEU N N 13 116.412 116.412 120.218 -3.806 25585
554 1 5 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.719 -0.430 25585
555 1 5 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.292 0.528 25585
556 1 5 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.685 -0.701 25585
557 1 5 . 1 1 13 13 LEU H H 13 6.902 6.902 7.696 -0.794 25585
558 1 5 . 1 1 14 14 GLY N N 14 108.651 108.651 106.750 1.901 25585
559 1 5 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.200 1.042 25585
560 1 5 . 1 1 14 14 GLY H H 14 8.387 8.387 8.438 -0.051 25585
561 1 5 . 1 1 15 15 ILE N N 15 109.703 109.703 113.109 -3.406 25585
562 1 5 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.776 0.053 25585
563 1 5 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.698 -0.021 25585
564 1 5 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.403 2.970 25585
565 1 5 . 1 1 15 15 ILE H H 15 6.727 6.727 7.294 -0.567 25585
566 1 5 . 1 1 16 16 CYS N N 16 120.648 120.648 120.236 0.412 25585
567 1 5 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.351 -0.159 25585
568 1 5 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.401 -2.408 25585
569 1 5 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.033 16.091 25585
570 1 5 . 1 1 16 16 CYS H H 16 8.811 8.811 8.683 0.128 25585
571 1 5 . 1 1 17 17 THR N N 17 116.440 116.440 114.501 1.939 25585
572 1 5 . 1 1 17 17 THR HA H 17 4.859 4.859 4.816 0.043 25585
573 1 5 . 1 1 17 17 THR CB C 17 69.862 69.862 70.965 -1.103 25585
574 1 5 . 1 1 17 17 THR H H 17 9.357 9.357 9.099 0.258 25585
575 1 5 . 1 1 18 18 ILE N N 18 124.956 124.956 123.162 1.794 25585
576 1 5 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.014 0.378 25585
577 1 5 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.638 0.570 25585
578 1 5 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.528 0.407 25585
579 1 5 . 1 1 18 18 ILE H H 18 8.493 8.493 8.271 0.222 25585
580 1 5 . 1 1 19 19 THR N N 19 119.997 119.997 121.915 -1.918 25585
581 1 5 . 1 1 19 19 THR HA H 19 4.331 4.331 4.430 -0.099 25585
582 1 5 . 1 1 19 19 THR CA C 19 61.222 61.222 60.385 0.837 25585
583 1 5 . 1 1 19 19 THR CB C 19 69.839 69.839 70.554 -0.715 25585
584 1 5 . 1 1 19 19 THR H H 19 8.060 8.060 7.837 0.223 25585
585 1 5 . 1 1 20 20 LEU N N 20 125.150 125.150 128.098 -2.948 25585
586 1 5 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.116 0.171 25585
587 1 5 . 1 1 20 20 LEU CA C 20 56.119 56.119 57.426 -1.308 25585
588 1 5 . 1 1 20 20 LEU CB C 20 42.079 42.079 42.030 0.049 25585
589 1 5 . 1 1 20 20 LEU H H 20 8.354 8.354 8.833 -0.479 25585
590 1 5 . 1 1 21 21 SER N N 21 115.796 115.796 114.716 1.080 25585
591 1 5 . 1 1 21 21 SER HA H 21 4.350 4.350 4.302 0.048 25585
592 1 5 . 1 1 21 21 SER CA C 21 58.899 58.899 60.976 -2.077 25585
593 1 5 . 1 1 21 21 SER CB C 21 63.363 63.363 62.699 0.664 25585
594 1 5 . 1 1 21 21 SER H H 21 8.274 8.274 8.139 0.135 25585
595 1 5 . 1 1 22 22 ARG N N 22 122.561 122.561 121.655 0.906 25585
596 1 5 . 1 1 22 22 ARG HA H 22 4.289 4.289 4.025 0.264 25585
597 1 5 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.646 -3.700 25585
598 1 5 . 1 1 22 22 ARG CB C 22 30.369 30.369 30.122 0.247 25585
599 1 5 . 1 1 22 22 ARG H H 22 8.149 8.149 7.629 0.520 25585
600 1 5 . 1 1 23 23 ILE N N 23 121.335 121.335 118.887 2.448 25585
601 1 5 . 1 1 23 23 ILE HA H 23 4.001 4.001 3.813 0.188 25585
602 1 5 . 1 1 23 23 ILE CA C 23 61.671 61.671 63.728 -2.057 25585
603 1 5 . 1 1 23 23 ILE CB C 23 38.383 38.383 37.614 0.769 25585
604 1 5 . 1 1 23 23 ILE H H 23 8.002 8.002 7.588 0.414 25585
605 1 5 . 1 1 24 24 GLU N N 24 122.372 122.372 113.581 8.791 25585
606 1 5 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.368 -0.159 25585
607 1 5 . 1 1 24 24 GLU CA C 24 56.115 56.115 55.490 0.625 25585
608 1 5 . 1 1 24 24 GLU CB C 24 29.306 29.306 30.976 -1.670 25585
609 1 5 . 1 1 24 24 GLU H H 24 8.317 8.317 8.480 -0.163 25585
610 1 5 . 1 1 25 25 HIS N N 25 118.365 118.365 118.905 -0.540 25585
611 1 5 . 1 1 25 25 HIS HA H 25 5.022 5.022 4.884 0.138 25585
612 1 5 . 1 1 25 25 HIS CA C 25 52.772 52.772 53.814 -1.042 25585
613 1 5 . 1 1 25 25 HIS CB C 25 28.551 28.551 29.406 -0.855 25585
614 1 5 . 1 1 25 25 HIS H H 25 8.323 8.323 7.616 0.707 25585
615 1 5 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.388 0.080 25585
616 1 5 . 1 1 26 26 PRO CA C 26 63.834 63.834 64.034 -0.200 25585
617 1 5 . 1 1 26 26 PRO CB C 26 31.936 31.936 31.785 0.151 25585
618 1 5 . 1 1 27 27 GLY N N 27 108.880 108.880 105.815 3.065 25585
619 1 5 . 1 1 27 27 GLY CA C 27 45.212 45.212 45.178 0.034 25585
620 1 5 . 1 1 27 27 GLY H H 27 8.594 8.594 8.553 0.041 25585
621 1 5 . 1 1 28 28 ASN N N 28 118.144 118.144 117.311 0.833 25585
622 1 5 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.262 0.403 25585
623 1 5 . 1 1 28 28 ASN CA C 28 52.967 52.967 53.595 -0.628 25585
624 1 5 . 1 1 28 28 ASN CB C 28 38.579 38.579 37.271 1.308 25585
625 1 5 . 1 1 28 28 ASN H H 28 8.154 8.154 7.679 0.475 25585
626 1 5 . 1 1 29 29 TYR N N 29 119.962 119.962 112.452 7.510 25585
627 1 5 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.211 0.309 25585
628 1 5 . 1 1 29 29 TYR CA C 29 57.544 57.544 58.870 -1.326 25585
629 1 5 . 1 1 29 29 TYR CB C 29 39.011 39.011 36.087 2.924 25585
630 1 5 . 1 1 29 29 TYR H H 29 8.058 8.058 7.786 0.272 25585
631 1 5 . 1 1 30 30 ASP N N 30 120.874 120.874 116.094 4.780 25585
632 1 5 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.221 0.458 25585
633 1 5 . 1 1 30 30 ASP CA C 30 52.827 52.827 55.694 -2.867 25585
634 1 5 . 1 1 30 30 ASP CB C 30 38.567 38.567 39.998 -1.431 25585
635 1 5 . 1 1 30 30 ASP H H 30 8.226 8.226 7.971 0.255 25585
636 1 6 . 1 1 3 3 CYS N N 3 120.614 120.614 123.462 -2.848 25585
637 1 6 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.540 0.259 25585
638 1 6 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.831 -6.039 25585
639 1 6 . 1 1 3 3 CYS CB C 3 42.170 42.170 29.742 12.428 25585
640 1 6 . 1 1 3 3 CYS H H 3 7.958 7.958 7.575 0.383 25585
641 1 6 . 1 1 4 4 GLN N N 4 121.450 121.450 120.735 0.715 25585
642 1 6 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.189 -0.009 25585
643 1 6 . 1 1 4 4 GLN CA C 4 54.557 54.557 53.005 1.552 25585
644 1 6 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.466 -1.275 25585
645 1 6 . 1 1 4 4 GLN H H 4 8.737 8.737 8.187 0.550 25585
646 1 6 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.296 0.113 25585
647 1 6 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.257 0.096 25585
648 1 6 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.801 -0.091 25585
649 1 6 . 1 1 6 6 GLY N N 6 111.865 111.865 110.787 1.078 25585
650 1 6 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.674 -0.611 25585
651 1 6 . 1 1 6 6 GLY H H 6 8.948 8.948 8.730 0.218 25585
652 1 6 . 1 1 7 7 TYR N N 7 120.136 120.136 119.809 0.327 25585
653 1 6 . 1 1 7 7 TYR HA H 7 5.057 5.057 5.178 -0.121 25585
654 1 6 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.536 -0.143 25585
655 1 6 . 1 1 7 7 TYR CB C 7 41.345 41.345 42.149 -0.804 25585
656 1 6 . 1 1 7 7 TYR H H 7 8.300 8.300 7.692 0.608 25585
657 1 6 . 1 1 8 8 ALA N N 8 121.599 121.599 122.701 -1.102 25585
658 1 6 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.703 -0.017 25585
659 1 6 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.661 0.281 25585
660 1 6 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.175 -0.018 25585
661 1 6 . 1 1 8 8 ALA H H 8 9.286 9.286 9.064 0.222 25585
662 1 6 . 1 1 9 9 TYR N N 9 124.797 124.797 124.592 0.205 25585
663 1 6 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.245 0.093 25585
664 1 6 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.304 1.011 25585
665 1 6 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.135 0.663 25585
666 1 6 . 1 1 9 9 TYR H H 9 9.112 9.112 8.723 0.389 25585
667 1 6 . 1 1 10 10 ASN N N 10 128.087 128.087 125.877 2.210 25585
668 1 6 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.892 0.187 25585
669 1 6 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.501 -0.329 25585
670 1 6 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.392 -1.567 25585
671 1 6 . 1 1 10 10 ASN H H 10 8.210 8.210 8.676 -0.466 25585
672 1 6 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.348 -0.283 25585
673 1 6 . 1 1 11 11 PRO CA C 11 63.988 63.988 63.950 0.037 25585
674 1 6 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.641 0.402 25585
675 1 6 . 1 1 12 12 VAL N N 12 119.341 119.341 116.088 3.253 25585
676 1 6 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.105 -0.347 25585
677 1 6 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.292 1.811 25585
678 1 6 . 1 1 12 12 VAL CB C 12 31.723 31.723 31.632 0.091 25585
679 1 6 . 1 1 12 12 VAL H H 12 7.570 7.570 7.511 0.059 25585
680 1 6 . 1 1 13 13 LEU N N 13 116.412 116.412 120.360 -3.948 25585
681 1 6 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.680 -0.391 25585
682 1 6 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.359 0.461 25585
683 1 6 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.679 -0.695 25585
684 1 6 . 1 1 13 13 LEU H H 13 6.902 6.902 7.533 -0.631 25585
685 1 6 . 1 1 14 14 GLY N N 14 108.651 108.651 106.650 2.001 25585
686 1 6 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.210 1.033 25585
687 1 6 . 1 1 14 14 GLY H H 14 8.387 8.387 8.451 -0.064 25585
688 1 6 . 1 1 15 15 ILE N N 15 109.703 109.703 113.058 -3.355 25585
689 1 6 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.752 0.077 25585
690 1 6 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.820 -0.143 25585
691 1 6 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.132 3.241 25585
692 1 6 . 1 1 15 15 ILE H H 15 6.727 6.727 7.381 -0.654 25585
693 1 6 . 1 1 16 16 CYS N N 16 120.648 120.648 119.854 0.794 25585
694 1 6 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.358 -0.166 25585
695 1 6 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.518 -2.525 25585
696 1 6 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.456 15.668 25585
697 1 6 . 1 1 16 16 CYS H H 16 8.811 8.811 8.720 0.091 25585
698 1 6 . 1 1 17 17 THR N N 17 116.440 116.440 115.438 1.002 25585
699 1 6 . 1 1 17 17 THR HA H 17 4.859 4.859 4.856 0.003 25585
700 1 6 . 1 1 17 17 THR CB C 17 69.862 69.862 71.130 -1.268 25585
701 1 6 . 1 1 17 17 THR H H 17 9.357 9.357 9.213 0.144 25585
702 1 6 . 1 1 18 18 ILE N N 18 124.956 124.956 122.864 2.092 25585
703 1 6 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.152 0.240 25585
704 1 6 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.656 0.552 25585
705 1 6 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.261 0.674 25585
706 1 6 . 1 1 18 18 ILE H H 18 8.493 8.493 8.327 0.166 25585
707 1 6 . 1 1 19 19 THR N N 19 119.997 119.997 122.314 -2.317 25585
708 1 6 . 1 1 19 19 THR HA H 19 4.331 4.331 4.439 -0.108 25585
709 1 6 . 1 1 19 19 THR CA C 19 61.222 61.222 60.118 1.104 25585
710 1 6 . 1 1 19 19 THR CB C 19 69.839 69.839 70.450 -0.611 25585
711 1 6 . 1 1 19 19 THR H H 19 8.060 8.060 8.253 -0.193 25585
712 1 6 . 1 1 20 20 LEU N N 20 125.150 125.150 125.455 -0.305 25585
713 1 6 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.225 0.062 25585
714 1 6 . 1 1 20 20 LEU CA C 20 56.119 56.119 57.297 -1.178 25585
715 1 6 . 1 1 20 20 LEU CB C 20 42.079 42.079 41.212 0.867 25585
716 1 6 . 1 1 20 20 LEU H H 20 8.354 8.354 8.805 -0.451 25585
717 1 6 . 1 1 21 21 SER N N 21 115.796 115.796 114.322 1.474 25585
718 1 6 . 1 1 21 21 SER HA H 21 4.350 4.350 4.320 0.030 25585
719 1 6 . 1 1 21 21 SER CA C 21 58.899 58.899 60.439 -1.540 25585
720 1 6 . 1 1 21 21 SER CB C 21 63.363 63.363 63.136 0.227 25585
721 1 6 . 1 1 21 21 SER H H 21 8.274 8.274 8.324 -0.050 25585
722 1 6 . 1 1 22 22 ARG N N 22 122.561 122.561 122.073 0.488 25585
723 1 6 . 1 1 22 22 ARG HA H 22 4.289 4.289 4.108 0.181 25585
724 1 6 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.480 -3.534 25585
725 1 6 . 1 1 22 22 ARG CB C 22 30.369 30.369 29.953 0.416 25585
726 1 6 . 1 1 22 22 ARG H H 22 8.149 8.149 7.623 0.526 25585
727 1 6 . 1 1 23 23 ILE N N 23 121.335 121.335 118.497 2.838 25585
728 1 6 . 1 1 23 23 ILE HA H 23 4.001 4.001 3.658 0.343 25585
729 1 6 . 1 1 23 23 ILE CA C 23 61.671 61.671 64.081 -2.410 25585
730 1 6 . 1 1 23 23 ILE CB C 23 38.383 38.383 37.985 0.398 25585
731 1 6 . 1 1 23 23 ILE H H 23 8.002 8.002 7.788 0.214 25585
732 1 6 . 1 1 24 24 GLU N N 24 122.372 122.372 114.941 7.431 25585
733 1 6 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.325 -0.116 25585
734 1 6 . 1 1 24 24 GLU CA C 24 56.115 56.115 55.651 0.464 25585
735 1 6 . 1 1 24 24 GLU CB C 24 29.306 29.306 31.742 -2.436 25585
736 1 6 . 1 1 24 24 GLU H H 24 8.317 8.317 8.259 0.058 25585
737 1 6 . 1 1 25 25 HIS N N 25 118.365 118.365 117.914 0.451 25585
738 1 6 . 1 1 25 25 HIS HA H 25 5.022 5.022 4.556 0.466 25585
739 1 6 . 1 1 25 25 HIS CA C 25 52.772 52.772 55.669 -2.897 25585
740 1 6 . 1 1 25 25 HIS CB C 25 28.551 28.551 27.938 0.613 25585
741 1 6 . 1 1 25 25 HIS H H 25 8.323 8.323 8.148 0.175 25585
742 1 6 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.378 0.090 25585
743 1 6 . 1 1 26 26 PRO CA C 26 63.834 63.834 65.351 -1.517 25585
744 1 6 . 1 1 26 26 PRO CB C 26 31.936 31.936 31.782 0.154 25585
745 1 6 . 1 1 27 27 GLY N N 27 108.880 108.880 105.367 3.513 25585
746 1 6 . 1 1 27 27 GLY CA C 27 45.212 45.212 47.003 -1.791 25585
747 1 6 . 1 1 27 27 GLY H H 27 8.594 8.594 8.762 -0.168 25585
748 1 6 . 1 1 28 28 ASN N N 28 118.144 118.144 119.514 -1.370 25585
749 1 6 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.523 0.142 25585
750 1 6 . 1 1 28 28 ASN CA C 28 52.967 52.967 55.040 -2.073 25585
751 1 6 . 1 1 28 28 ASN CB C 28 38.579 38.579 38.650 -0.071 25585
752 1 6 . 1 1 28 28 ASN H H 28 8.154 8.154 7.930 0.224 25585
753 1 6 . 1 1 29 29 TYR N N 29 119.962 119.962 115.869 4.093 25585
754 1 6 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.575 -0.055 25585
755 1 6 . 1 1 29 29 TYR CA C 29 57.544 57.544 58.449 -0.905 25585
756 1 6 . 1 1 29 29 TYR CB C 29 39.011 39.011 38.944 0.067 25585
757 1 6 . 1 1 29 29 TYR H H 29 8.058 8.058 7.659 0.399 25585
758 1 6 . 1 1 30 30 ASP N N 30 120.874 120.874 118.780 2.094 25585
759 1 6 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.324 0.355 25585
760 1 6 . 1 1 30 30 ASP CA C 30 52.827 52.827 54.745 -1.918 25585
761 1 6 . 1 1 30 30 ASP CB C 30 38.567 38.567 39.620 -1.053 25585
762 1 6 . 1 1 30 30 ASP H H 30 8.226 8.226 7.865 0.361 25585
763 1 7 . 1 1 3 3 CYS N N 3 120.614 120.614 123.473 -2.859 25585
764 1 7 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.529 0.270 25585
765 1 7 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.822 -6.030 25585
766 1 7 . 1 1 3 3 CYS CB C 3 42.170 42.170 29.786 12.384 25585
767 1 7 . 1 1 3 3 CYS H H 3 7.958 7.958 7.598 0.360 25585
768 1 7 . 1 1 4 4 GLN N N 4 121.450 121.450 120.657 0.793 25585
769 1 7 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.179 0.001 25585
770 1 7 . 1 1 4 4 GLN CA C 4 54.557 54.557 52.964 1.593 25585
771 1 7 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.483 -1.292 25585
772 1 7 . 1 1 4 4 GLN H H 4 8.737 8.737 8.166 0.571 25585
773 1 7 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.230 0.179 25585
774 1 7 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.241 0.113 25585
775 1 7 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.809 -0.099 25585
776 1 7 . 1 1 6 6 GLY N N 6 111.865 111.865 110.443 1.422 25585
777 1 7 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.917 -0.854 25585
778 1 7 . 1 1 6 6 GLY H H 6 8.948 8.948 8.671 0.277 25585
779 1 7 . 1 1 7 7 TYR N N 7 120.136 120.136 119.655 0.481 25585
780 1 7 . 1 1 7 7 TYR HA H 7 5.057 5.057 5.047 0.010 25585
781 1 7 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.538 -0.145 25585
782 1 7 . 1 1 7 7 TYR CB C 7 41.345 41.345 42.115 -0.770 25585
783 1 7 . 1 1 7 7 TYR H H 7 8.300 8.300 7.628 0.672 25585
784 1 7 . 1 1 8 8 ALA N N 8 121.599 121.599 122.840 -1.241 25585
785 1 7 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.666 0.020 25585
786 1 7 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.610 0.332 25585
787 1 7 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.082 0.075 25585
788 1 7 . 1 1 8 8 ALA H H 8 9.286 9.286 8.947 0.339 25585
789 1 7 . 1 1 9 9 TYR N N 9 124.797 124.797 124.708 0.089 25585
790 1 7 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.224 0.114 25585
791 1 7 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.269 1.046 25585
792 1 7 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.124 0.674 25585
793 1 7 . 1 1 9 9 TYR H H 9 9.112 9.112 8.706 0.406 25585
794 1 7 . 1 1 10 10 ASN N N 10 128.087 128.087 125.891 2.196 25585
795 1 7 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.877 0.202 25585
796 1 7 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.482 -0.310 25585
797 1 7 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.360 -1.536 25585
798 1 7 . 1 1 10 10 ASN H H 10 8.210 8.210 8.676 -0.466 25585
799 1 7 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.361 -0.296 25585
800 1 7 . 1 1 11 11 PRO CA C 11 63.988 63.988 64.172 -0.184 25585
801 1 7 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.662 0.381 25585
802 1 7 . 1 1 12 12 VAL N N 12 119.341 119.341 115.774 3.567 25585
803 1 7 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.063 -0.305 25585
804 1 7 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.417 1.686 25585
805 1 7 . 1 1 12 12 VAL CB C 12 31.723 31.723 32.066 -0.343 25585
806 1 7 . 1 1 12 12 VAL H H 12 7.570 7.570 7.557 0.013 25585
807 1 7 . 1 1 13 13 LEU N N 13 116.412 116.412 120.218 -3.806 25585
808 1 7 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.753 -0.464 25585
809 1 7 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.267 0.553 25585
810 1 7 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.487 -0.503 25585
811 1 7 . 1 1 13 13 LEU H H 13 6.902 6.902 7.541 -0.639 25585
812 1 7 . 1 1 14 14 GLY N N 14 108.651 108.651 106.544 2.107 25585
813 1 7 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.197 1.046 25585
814 1 7 . 1 1 14 14 GLY H H 14 8.387 8.387 8.431 -0.044 25585
815 1 7 . 1 1 15 15 ILE N N 15 109.703 109.703 112.983 -3.280 25585
816 1 7 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.747 0.082 25585
817 1 7 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.831 -0.155 25585
818 1 7 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.122 3.251 25585
819 1 7 . 1 1 15 15 ILE H H 15 6.727 6.727 7.379 -0.652 25585
820 1 7 . 1 1 16 16 CYS N N 16 120.648 120.648 120.367 0.281 25585
821 1 7 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.388 -0.196 25585
822 1 7 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.483 -2.490 25585
823 1 7 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.252 15.872 25585
824 1 7 . 1 1 16 16 CYS H H 16 8.811 8.811 8.654 0.157 25585
825 1 7 . 1 1 17 17 THR N N 17 116.440 116.440 115.255 1.185 25585
826 1 7 . 1 1 17 17 THR HA H 17 4.859 4.859 4.854 0.005 25585
827 1 7 . 1 1 17 17 THR CB C 17 69.862 69.862 71.658 -1.796 25585
828 1 7 . 1 1 17 17 THR H H 17 9.357 9.357 8.957 0.400 25585
829 1 7 . 1 1 18 18 ILE N N 18 124.956 124.956 123.674 1.282 25585
830 1 7 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.163 0.229 25585
831 1 7 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.508 0.700 25585
832 1 7 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.276 0.659 25585
833 1 7 . 1 1 18 18 ILE H H 18 8.493 8.493 8.411 0.082 25585
834 1 7 . 1 1 19 19 THR N N 19 119.997 119.997 121.952 -1.955 25585
835 1 7 . 1 1 19 19 THR HA H 19 4.331 4.331 4.440 -0.109 25585
836 1 7 . 1 1 19 19 THR CA C 19 61.222 61.222 60.048 1.174 25585
837 1 7 . 1 1 19 19 THR CB C 19 69.839 69.839 70.588 -0.749 25585
838 1 7 . 1 1 19 19 THR H H 19 8.060 8.060 8.050 0.010 25585
839 1 7 . 1 1 20 20 LEU N N 20 125.150 125.150 127.057 -1.907 25585
840 1 7 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.068 0.219 25585
841 1 7 . 1 1 20 20 LEU CA C 20 56.119 56.119 57.260 -1.141 25585
842 1 7 . 1 1 20 20 LEU CB C 20 42.079 42.079 41.972 0.106 25585
843 1 7 . 1 1 20 20 LEU H H 20 8.354 8.354 8.818 -0.464 25585
844 1 7 . 1 1 21 21 SER N N 21 115.796 115.796 114.778 1.018 25585
845 1 7 . 1 1 21 21 SER HA H 21 4.350 4.350 4.010 0.340 25585
846 1 7 . 1 1 21 21 SER CA C 21 58.899 58.899 61.479 -2.580 25585
847 1 7 . 1 1 21 21 SER CB C 21 63.363 63.363 62.596 0.767 25585
848 1 7 . 1 1 21 21 SER H H 21 8.274 8.274 8.076 0.198 25585
849 1 7 . 1 1 22 22 ARG N N 22 122.561 122.561 120.940 1.621 25585
850 1 7 . 1 1 22 22 ARG HA H 22 4.289 4.289 4.074 0.215 25585
851 1 7 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.628 -3.682 25585
852 1 7 . 1 1 22 22 ARG CB C 22 30.369 30.369 29.988 0.381 25585
853 1 7 . 1 1 22 22 ARG H H 22 8.149 8.149 7.436 0.713 25585
854 1 7 . 1 1 23 23 ILE N N 23 121.335 121.335 119.820 1.515 25585
855 1 7 . 1 1 23 23 ILE HA H 23 4.001 4.001 3.862 0.139 25585
856 1 7 . 1 1 23 23 ILE CA C 23 61.671 61.671 63.946 -2.275 25585
857 1 7 . 1 1 23 23 ILE CB C 23 38.383 38.383 37.794 0.589 25585
858 1 7 . 1 1 23 23 ILE H H 23 8.002 8.002 7.633 0.369 25585
859 1 7 . 1 1 24 24 GLU N N 24 122.372 122.372 115.011 7.361 25585
860 1 7 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.437 -0.228 25585
861 1 7 . 1 1 24 24 GLU CA C 24 56.115 56.115 55.648 0.467 25585
862 1 7 . 1 1 24 24 GLU CB C 24 29.306 29.306 30.611 -1.305 25585
863 1 7 . 1 1 24 24 GLU H H 24 8.317 8.317 8.569 -0.252 25585
864 1 7 . 1 1 25 25 HIS N N 25 118.365 118.365 119.651 -1.286 25585
865 1 7 . 1 1 25 25 HIS HA H 25 5.022 5.022 4.905 0.117 25585
866 1 7 . 1 1 25 25 HIS CA C 25 52.772 52.772 53.919 -1.147 25585
867 1 7 . 1 1 25 25 HIS CB C 25 28.551 28.551 29.479 -0.928 25585
868 1 7 . 1 1 25 25 HIS H H 25 8.323 8.323 7.917 0.406 25585
869 1 7 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.281 0.187 25585
870 1 7 . 1 1 26 26 PRO CA C 26 63.834 63.834 64.340 -0.506 25585
871 1 7 . 1 1 26 26 PRO CB C 26 31.936 31.936 31.943 -0.007 25585
872 1 7 . 1 1 27 27 GLY N N 27 108.880 108.880 104.085 4.795 25585
873 1 7 . 1 1 27 27 GLY CA C 27 45.212 45.212 45.266 -0.054 25585
874 1 7 . 1 1 27 27 GLY H H 27 8.594 8.594 8.591 0.003 25585
875 1 7 . 1 1 28 28 ASN N N 28 118.144 118.144 117.563 0.581 25585
876 1 7 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.315 0.350 25585
877 1 7 . 1 1 28 28 ASN CA C 28 52.967 52.967 53.675 -0.708 25585
878 1 7 . 1 1 28 28 ASN CB C 28 38.579 38.579 37.313 1.266 25585
879 1 7 . 1 1 28 28 ASN H H 28 8.154 8.154 7.760 0.394 25585
880 1 7 . 1 1 29 29 TYR N N 29 119.962 119.962 112.129 7.833 25585
881 1 7 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.171 0.349 25585
882 1 7 . 1 1 29 29 TYR CA C 29 57.544 57.544 58.389 -0.845 25585
883 1 7 . 1 1 29 29 TYR CB C 29 39.011 39.011 36.259 2.752 25585
884 1 7 . 1 1 29 29 TYR H H 29 8.058 8.058 7.872 0.186 25585
885 1 7 . 1 1 30 30 ASP N N 30 120.874 120.874 117.036 3.838 25585
886 1 7 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.259 0.420 25585
887 1 7 . 1 1 30 30 ASP CA C 30 52.827 52.827 55.434 -2.607 25585
888 1 7 . 1 1 30 30 ASP CB C 30 38.567 38.567 40.182 -1.615 25585
889 1 7 . 1 1 30 30 ASP H H 30 8.226 8.226 8.058 0.168 25585
890 1 8 . 1 1 3 3 CYS N N 3 120.614 120.614 124.016 -3.402 25585
891 1 8 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.564 0.235 25585
892 1 8 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.230 -5.438 25585
893 1 8 . 1 1 3 3 CYS CB C 3 42.170 42.170 30.053 12.117 25585
894 1 8 . 1 1 3 3 CYS H H 3 7.958 7.958 7.614 0.344 25585
895 1 8 . 1 1 4 4 GLN N N 4 121.450 121.450 120.919 0.531 25585
896 1 8 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.121 0.059 25585
897 1 8 . 1 1 4 4 GLN CA C 4 54.557 54.557 53.106 1.451 25585
898 1 8 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.379 -1.188 25585
899 1 8 . 1 1 4 4 GLN H H 4 8.737 8.737 8.181 0.556 25585
900 1 8 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.204 0.205 25585
901 1 8 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.214 0.140 25585
902 1 8 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.753 -0.043 25585
903 1 8 . 1 1 6 6 GLY N N 6 111.865 111.865 110.622 1.243 25585
904 1 8 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.922 -0.859 25585
905 1 8 . 1 1 6 6 GLY H H 6 8.948 8.948 8.675 0.273 25585
906 1 8 . 1 1 7 7 TYR N N 7 120.136 120.136 119.718 0.418 25585
907 1 8 . 1 1 7 7 TYR HA H 7 5.057 5.057 5.108 -0.051 25585
908 1 8 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.467 -0.074 25585
909 1 8 . 1 1 7 7 TYR CB C 7 41.345 41.345 42.105 -0.760 25585
910 1 8 . 1 1 7 7 TYR H H 7 8.300 8.300 7.648 0.652 25585
911 1 8 . 1 1 8 8 ALA N N 8 121.599 121.599 122.753 -1.154 25585
912 1 8 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.692 -0.006 25585
913 1 8 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.647 0.295 25585
914 1 8 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.135 0.022 25585
915 1 8 . 1 1 8 8 ALA H H 8 9.286 9.286 9.008 0.278 25585
916 1 8 . 1 1 9 9 TYR N N 9 124.797 124.797 124.683 0.114 25585
917 1 8 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.231 0.107 25585
918 1 8 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.292 1.023 25585
919 1 8 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.100 0.698 25585
920 1 8 . 1 1 9 9 TYR H H 9 9.112 9.112 8.728 0.384 25585
921 1 8 . 1 1 10 10 ASN N N 10 128.087 128.087 125.949 2.138 25585
922 1 8 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.893 0.186 25585
923 1 8 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.505 -0.333 25585
924 1 8 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.386 -1.562 25585
925 1 8 . 1 1 10 10 ASN H H 10 8.210 8.210 8.770 -0.560 25585
926 1 8 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.359 -0.294 25585
927 1 8 . 1 1 11 11 PRO CA C 11 63.988 63.988 64.071 -0.083 25585
928 1 8 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.663 0.380 25585
929 1 8 . 1 1 12 12 VAL N N 12 119.341 119.341 115.739 3.602 25585
930 1 8 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.062 -0.304 25585
931 1 8 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.172 1.931 25585
932 1 8 . 1 1 12 12 VAL CB C 12 31.723 31.723 32.024 -0.301 25585
933 1 8 . 1 1 12 12 VAL H H 12 7.570 7.570 7.574 -0.004 25585
934 1 8 . 1 1 13 13 LEU N N 13 116.412 116.412 120.228 -3.816 25585
935 1 8 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.725 -0.436 25585
936 1 8 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.361 0.459 25585
937 1 8 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.652 -0.668 25585
938 1 8 . 1 1 13 13 LEU H H 13 6.902 6.902 7.566 -0.664 25585
939 1 8 . 1 1 14 14 GLY N N 14 108.651 108.651 106.564 2.087 25585
940 1 8 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.207 1.036 25585
941 1 8 . 1 1 14 14 GLY H H 14 8.387 8.387 8.450 -0.063 25585
942 1 8 . 1 1 15 15 ILE N N 15 109.703 109.703 113.047 -3.344 25585
943 1 8 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.752 0.077 25585
944 1 8 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.836 -0.159 25585
945 1 8 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.100 3.272 25585
946 1 8 . 1 1 15 15 ILE H H 15 6.727 6.727 7.392 -0.665 25585
947 1 8 . 1 1 16 16 CYS N N 16 120.648 120.648 120.125 0.523 25585
948 1 8 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.444 -0.252 25585
949 1 8 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.794 -2.801 25585
950 1 8 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.417 15.707 25585
951 1 8 . 1 1 16 16 CYS H H 16 8.811 8.811 8.705 0.106 25585
952 1 8 . 1 1 17 17 THR N N 17 116.440 116.440 114.921 1.519 25585
953 1 8 . 1 1 17 17 THR HA H 17 4.859 4.859 4.840 0.019 25585
954 1 8 . 1 1 17 17 THR CB C 17 69.862 69.862 71.713 -1.851 25585
955 1 8 . 1 1 17 17 THR H H 17 9.357 9.357 8.990 0.367 25585
956 1 8 . 1 1 18 18 ILE N N 18 124.956 124.956 123.615 1.341 25585
957 1 8 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.062 0.330 25585
958 1 8 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.493 0.715 25585
959 1 8 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.164 0.771 25585
960 1 8 . 1 1 18 18 ILE H H 18 8.493 8.493 8.297 0.196 25585
961 1 8 . 1 1 19 19 THR N N 19 119.997 119.997 122.255 -2.258 25585
962 1 8 . 1 1 19 19 THR HA H 19 4.331 4.331 4.464 -0.133 25585
963 1 8 . 1 1 19 19 THR CA C 19 61.222 61.222 60.041 1.181 25585
964 1 8 . 1 1 19 19 THR CB C 19 69.839 69.839 70.678 -0.839 25585
965 1 8 . 1 1 19 19 THR H H 19 8.060 8.060 8.182 -0.122 25585
966 1 8 . 1 1 20 20 LEU N N 20 125.150 125.150 126.195 -1.045 25585
967 1 8 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.145 0.142 25585
968 1 8 . 1 1 20 20 LEU CA C 20 56.119 56.119 57.057 -0.938 25585
969 1 8 . 1 1 20 20 LEU CB C 20 42.079 42.079 41.799 0.280 25585
970 1 8 . 1 1 20 20 LEU H H 20 8.354 8.354 8.676 -0.322 25585
971 1 8 . 1 1 21 21 SER N N 21 115.796 115.796 115.327 0.469 25585
972 1 8 . 1 1 21 21 SER HA H 21 4.350 4.350 4.286 0.064 25585
973 1 8 . 1 1 21 21 SER CA C 21 58.899 58.899 61.233 -2.334 25585
974 1 8 . 1 1 21 21 SER CB C 21 63.363 63.363 63.008 0.355 25585
975 1 8 . 1 1 21 21 SER H H 21 8.274 8.274 8.014 0.260 25585
976 1 8 . 1 1 22 22 ARG N N 22 122.561 122.561 121.817 0.744 25585
977 1 8 . 1 1 22 22 ARG HA H 22 4.289 4.289 4.127 0.162 25585
978 1 8 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.333 -3.387 25585
979 1 8 . 1 1 22 22 ARG CB C 22 30.369 30.369 30.329 0.040 25585
980 1 8 . 1 1 22 22 ARG H H 22 8.149 8.149 7.522 0.627 25585
981 1 8 . 1 1 23 23 ILE N N 23 121.335 121.335 119.588 1.747 25585
982 1 8 . 1 1 23 23 ILE HA H 23 4.001 4.001 4.072 -0.071 25585
983 1 8 . 1 1 23 23 ILE CA C 23 61.671 61.671 60.990 0.681 25585
984 1 8 . 1 1 23 23 ILE CB C 23 38.383 38.383 38.047 0.336 25585
985 1 8 . 1 1 23 23 ILE H H 23 8.002 8.002 7.661 0.341 25585
986 1 8 . 1 1 24 24 GLU N N 24 122.372 122.372 121.517 0.855 25585
987 1 8 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.362 -0.153 25585
988 1 8 . 1 1 24 24 GLU CA C 24 56.115 56.115 55.392 0.723 25585
989 1 8 . 1 1 24 24 GLU CB C 24 29.306 29.306 30.013 -0.707 25585
990 1 8 . 1 1 24 24 GLU H H 24 8.317 8.317 6.866 1.451 25585
991 1 8 . 1 1 25 25 HIS N N 25 118.365 118.365 113.288 5.077 25585
992 1 8 . 1 1 25 25 HIS HA H 25 5.022 5.022 4.907 0.115 25585
993 1 8 . 1 1 25 25 HIS CA C 25 52.772 52.772 54.254 -1.482 25585
994 1 8 . 1 1 25 25 HIS CB C 25 28.551 28.551 28.106 0.445 25585
995 1 8 . 1 1 25 25 HIS H H 25 8.323 8.323 7.436 0.887 25585
996 1 8 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.509 -0.041 25585
997 1 8 . 1 1 26 26 PRO CA C 26 63.834 63.834 64.740 -0.906 25585
998 1 8 . 1 1 26 26 PRO CB C 26 31.936 31.936 32.156 -0.220 25585
999 1 8 . 1 1 27 27 GLY N N 27 108.880 108.880 107.787 1.093 25585
1000 1 8 . 1 1 27 27 GLY CA C 27 45.212 45.212 46.762 -1.550 25585
1001 1 8 . 1 1 27 27 GLY H H 27 8.594 8.594 8.317 0.277 25585
1002 1 8 . 1 1 28 28 ASN N N 28 118.144 118.144 119.925 -1.781 25585
1003 1 8 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.444 0.221 25585
1004 1 8 . 1 1 28 28 ASN CA C 28 52.967 52.967 54.895 -1.928 25585
1005 1 8 . 1 1 28 28 ASN CB C 28 38.579 38.579 38.291 0.288 25585
1006 1 8 . 1 1 28 28 ASN H H 28 8.154 8.154 8.423 -0.269 25585
1007 1 8 . 1 1 29 29 TYR N N 29 119.962 119.962 118.877 1.085 25585
1008 1 8 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.756 -0.236 25585
1009 1 8 . 1 1 29 29 TYR CA C 29 57.544 57.544 56.870 0.673 25585
1010 1 8 . 1 1 29 29 TYR CB C 29 39.011 39.011 37.472 1.539 25585
1011 1 8 . 1 1 29 29 TYR H H 29 8.058 8.058 7.756 0.302 25585
1012 1 8 . 1 1 30 30 ASP N N 30 120.874 120.874 121.610 -0.736 25585
1013 1 8 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.586 0.093 25585
1014 1 8 . 1 1 30 30 ASP CA C 30 52.827 52.827 56.001 -3.174 25585
1015 1 8 . 1 1 30 30 ASP CB C 30 38.567 38.567 41.167 -2.600 25585
1016 1 8 . 1 1 30 30 ASP H H 30 8.226 8.226 8.457 -0.231 25585
1017 1 9 . 1 1 3 3 CYS N N 3 120.614 120.614 123.369 -2.755 25585
1018 1 9 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.547 0.252 25585
1019 1 9 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.819 -6.027 25585
1020 1 9 . 1 1 3 3 CYS CB C 3 42.170 42.170 29.761 12.409 25585
1021 1 9 . 1 1 3 3 CYS H H 3 7.958 7.958 7.554 0.404 25585
1022 1 9 . 1 1 4 4 GLN N N 4 121.450 121.450 120.738 0.712 25585
1023 1 9 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.211 -0.031 25585
1024 1 9 . 1 1 4 4 GLN CA C 4 54.557 54.557 52.983 1.574 25585
1025 1 9 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.515 -1.324 25585
1026 1 9 . 1 1 4 4 GLN H H 4 8.737 8.737 8.192 0.545 25585
1027 1 9 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.168 0.241 25585
1028 1 9 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.457 -0.103 25585
1029 1 9 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.722 -0.012 25585
1030 1 9 . 1 1 6 6 GLY N N 6 111.865 111.865 109.644 2.221 25585
1031 1 9 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.659 -0.596 25585
1032 1 9 . 1 1 6 6 GLY H H 6 8.948 8.948 8.610 0.338 25585
1033 1 9 . 1 1 7 7 TYR N N 7 120.136 120.136 119.582 0.554 25585
1034 1 9 . 1 1 7 7 TYR HA H 7 5.057 5.057 5.062 -0.005 25585
1035 1 9 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.565 -0.172 25585
1036 1 9 . 1 1 7 7 TYR CB C 7 41.345 41.345 42.218 -0.872 25585
1037 1 9 . 1 1 7 7 TYR H H 7 8.300 8.300 7.667 0.633 25585
1038 1 9 . 1 1 8 8 ALA N N 8 121.599 121.599 122.713 -1.114 25585
1039 1 9 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.678 0.008 25585
1040 1 9 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.690 0.252 25585
1041 1 9 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.130 0.027 25585
1042 1 9 . 1 1 8 8 ALA H H 8 9.286 9.286 8.903 0.383 25585
1043 1 9 . 1 1 9 9 TYR N N 9 124.797 124.797 124.256 0.541 25585
1044 1 9 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.237 0.101 25585
1045 1 9 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.475 0.840 25585
1046 1 9 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.264 0.534 25585
1047 1 9 . 1 1 9 9 TYR H H 9 9.112 9.112 8.701 0.411 25585
1048 1 9 . 1 1 10 10 ASN N N 10 128.087 128.087 125.618 2.469 25585
1049 1 9 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.926 0.153 25585
1050 1 9 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.521 -0.349 25585
1051 1 9 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.081 -1.257 25585
1052 1 9 . 1 1 10 10 ASN H H 10 8.210 8.210 8.484 -0.274 25585
1053 1 9 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.122 -0.057 25585
1054 1 9 . 1 1 11 11 PRO CA C 11 63.988 63.988 64.184 -0.196 25585
1055 1 9 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.505 0.538 25585
1056 1 9 . 1 1 12 12 VAL N N 12 119.341 119.341 115.587 3.754 25585
1057 1 9 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.099 -0.341 25585
1058 1 9 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.126 1.977 25585
1059 1 9 . 1 1 12 12 VAL CB C 12 31.723 31.723 31.494 0.229 25585
1060 1 9 . 1 1 12 12 VAL H H 12 7.570 7.570 7.462 0.108 25585
1061 1 9 . 1 1 13 13 LEU N N 13 116.412 116.412 120.112 -3.700 25585
1062 1 9 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.700 -0.411 25585
1063 1 9 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.285 0.535 25585
1064 1 9 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.537 -0.553 25585
1065 1 9 . 1 1 13 13 LEU H H 13 6.902 6.902 7.675 -0.773 25585
1066 1 9 . 1 1 14 14 GLY N N 14 108.651 108.651 107.601 1.050 25585
1067 1 9 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.056 1.187 25585
1068 1 9 . 1 1 14 14 GLY H H 14 8.387 8.387 8.556 -0.169 25585
1069 1 9 . 1 1 15 15 ILE N N 15 109.703 109.703 113.858 -4.155 25585
1070 1 9 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.817 0.012 25585
1071 1 9 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.713 -0.036 25585
1072 1 9 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.340 3.033 25585
1073 1 9 . 1 1 15 15 ILE H H 15 6.727 6.727 7.309 -0.582 25585
1074 1 9 . 1 1 16 16 CYS N N 16 120.648 120.648 119.611 1.037 25585
1075 1 9 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.302 -0.110 25585
1076 1 9 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.625 -2.632 25585
1077 1 9 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.301 15.823 25585
1078 1 9 . 1 1 16 16 CYS H H 16 8.811 8.811 8.703 0.108 25585
1079 1 9 . 1 1 17 17 THR N N 17 116.440 116.440 114.706 1.734 25585
1080 1 9 . 1 1 17 17 THR HA H 17 4.859 4.859 4.934 -0.075 25585
1081 1 9 . 1 1 17 17 THR CB C 17 69.862 69.862 72.013 -2.151 25585
1082 1 9 . 1 1 17 17 THR H H 17 9.357 9.357 8.906 0.451 25585
1083 1 9 . 1 1 18 18 ILE N N 18 124.956 124.956 123.983 0.973 25585
1084 1 9 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.198 0.194 25585
1085 1 9 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.782 0.426 25585
1086 1 9 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.371 0.564 25585
1087 1 9 . 1 1 18 18 ILE H H 18 8.493 8.493 8.498 -0.005 25585
1088 1 9 . 1 1 19 19 THR N N 19 119.997 119.997 122.545 -2.548 25585
1089 1 9 . 1 1 19 19 THR HA H 19 4.331 4.331 4.419 -0.088 25585
1090 1 9 . 1 1 19 19 THR CA C 19 61.222 61.222 60.119 1.103 25585
1091 1 9 . 1 1 19 19 THR CB C 19 69.839 69.839 69.946 -0.107 25585
1092 1 9 . 1 1 19 19 THR H H 19 8.060 8.060 8.339 -0.279 25585
1093 1 9 . 1 1 20 20 LEU N N 20 125.150 125.150 123.129 2.021 25585
1094 1 9 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.232 0.055 25585
1095 1 9 . 1 1 20 20 LEU CA C 20 56.119 56.119 56.571 -0.452 25585
1096 1 9 . 1 1 20 20 LEU CB C 20 42.079 42.079 40.691 1.388 25585
1097 1 9 . 1 1 20 20 LEU H H 20 8.354 8.354 8.701 -0.347 25585
1098 1 9 . 1 1 21 21 SER N N 21 115.796 115.796 115.538 0.258 25585
1099 1 9 . 1 1 21 21 SER HA H 21 4.350 4.350 3.906 0.444 25585
1100 1 9 . 1 1 21 21 SER CA C 21 58.899 58.899 60.909 -2.010 25585
1101 1 9 . 1 1 21 21 SER CB C 21 63.363 63.363 62.644 0.719 25585
1102 1 9 . 1 1 21 21 SER H H 21 8.274 8.274 8.225 0.049 25585
1103 1 9 . 1 1 22 22 ARG N N 22 122.561 122.561 121.965 0.596 25585
1104 1 9 . 1 1 22 22 ARG HA H 22 4.289 4.289 4.257 0.032 25585
1105 1 9 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.378 -3.432 25585
1106 1 9 . 1 1 22 22 ARG CB C 22 30.369 30.369 29.933 0.436 25585
1107 1 9 . 1 1 22 22 ARG H H 22 8.149 8.149 7.497 0.652 25585
1108 1 9 . 1 1 23 23 ILE N N 23 121.335 121.335 119.873 1.462 25585
1109 1 9 . 1 1 23 23 ILE HA H 23 4.001 4.001 3.905 0.096 25585
1110 1 9 . 1 1 23 23 ILE CA C 23 61.671 61.671 63.894 -2.223 25585
1111 1 9 . 1 1 23 23 ILE CB C 23 38.383 38.383 37.763 0.620 25585
1112 1 9 . 1 1 23 23 ILE H H 23 8.002 8.002 7.623 0.379 25585
1113 1 9 . 1 1 24 24 GLU N N 24 122.372 122.372 116.146 6.226 25585
1114 1 9 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.453 -0.244 25585
1115 1 9 . 1 1 24 24 GLU CA C 24 56.115 56.115 56.161 -0.046 25585
1116 1 9 . 1 1 24 24 GLU CB C 24 29.306 29.306 30.117 -0.811 25585
1117 1 9 . 1 1 24 24 GLU H H 24 8.317 8.317 8.552 -0.235 25585
1118 1 9 . 1 1 25 25 HIS N N 25 118.365 118.365 119.527 -1.162 25585
1119 1 9 . 1 1 25 25 HIS HA H 25 5.022 5.022 4.984 0.038 25585
1120 1 9 . 1 1 25 25 HIS CA C 25 52.772 52.772 53.255 -0.483 25585
1121 1 9 . 1 1 25 25 HIS CB C 25 28.551 28.551 29.762 -1.211 25585
1122 1 9 . 1 1 25 25 HIS H H 25 8.323 8.323 8.163 0.160 25585
1123 1 9 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.555 -0.087 25585
1124 1 9 . 1 1 26 26 PRO CA C 26 63.834 63.834 64.665 -0.831 25585
1125 1 9 . 1 1 26 26 PRO CB C 26 31.936 31.936 31.810 0.126 25585
1126 1 9 . 1 1 27 27 GLY N N 27 108.880 108.880 107.044 1.836 25585
1127 1 9 . 1 1 27 27 GLY CA C 27 45.212 45.212 46.868 -1.656 25585
1128 1 9 . 1 1 27 27 GLY H H 27 8.594 8.594 8.769 -0.175 25585
1129 1 9 . 1 1 28 28 ASN N N 28 118.144 118.144 119.655 -1.511 25585
1130 1 9 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.504 0.161 25585
1131 1 9 . 1 1 28 28 ASN CA C 28 52.967 52.967 55.086 -2.119 25585
1132 1 9 . 1 1 28 28 ASN CB C 28 38.579 38.579 37.980 0.599 25585
1133 1 9 . 1 1 28 28 ASN H H 28 8.154 8.154 7.866 0.288 25585
1134 1 9 . 1 1 29 29 TYR N N 29 119.962 119.962 117.452 2.510 25585
1135 1 9 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.480 0.040 25585
1136 1 9 . 1 1 29 29 TYR CA C 29 57.544 57.544 58.990 -1.446 25585
1137 1 9 . 1 1 29 29 TYR CB C 29 39.011 39.011 38.682 0.329 25585
1138 1 9 . 1 1 29 29 TYR H H 29 8.058 8.058 7.729 0.329 25585
1139 1 9 . 1 1 30 30 ASP N N 30 120.874 120.874 117.329 3.545 25585
1140 1 9 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.322 0.357 25585
1141 1 9 . 1 1 30 30 ASP CA C 30 52.827 52.827 55.581 -2.753 25585
1142 1 9 . 1 1 30 30 ASP CB C 30 38.567 38.567 39.227 -0.660 25585
1143 1 9 . 1 1 30 30 ASP H H 30 8.226 8.226 7.858 0.368 25585
1144 1 10 . 1 1 3 3 CYS N N 3 120.614 120.614 124.171 -3.557 25585
1145 1 10 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.550 0.249 25585
1146 1 10 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.248 -5.456 25585
1147 1 10 . 1 1 3 3 CYS CB C 3 42.170 42.170 29.997 12.174 25585
1148 1 10 . 1 1 3 3 CYS H H 3 7.958 7.958 7.645 0.313 25585
1149 1 10 . 1 1 4 4 GLN N N 4 121.450 121.450 121.121 0.329 25585
1150 1 10 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.090 0.090 25585
1151 1 10 . 1 1 4 4 GLN CA C 4 54.557 54.557 53.164 1.393 25585
1152 1 10 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.309 -1.118 25585
1153 1 10 . 1 1 4 4 GLN H H 4 8.737 8.737 8.169 0.568 25585
1154 1 10 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.178 0.231 25585
1155 1 10 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.345 0.009 25585
1156 1 10 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.662 0.048 25585
1157 1 10 . 1 1 6 6 GLY N N 6 111.865 111.865 109.773 2.092 25585
1158 1 10 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.524 -0.461 25585
1159 1 10 . 1 1 6 6 GLY H H 6 8.948 8.948 8.681 0.267 25585
1160 1 10 . 1 1 7 7 TYR N N 7 120.136 120.136 119.661 0.475 25585
1161 1 10 . 1 1 7 7 TYR HA H 7 5.057 5.057 5.084 -0.027 25585
1162 1 10 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.558 -0.165 25585
1163 1 10 . 1 1 7 7 TYR CB C 7 41.345 41.345 42.164 -0.819 25585
1164 1 10 . 1 1 7 7 TYR H H 7 8.300 8.300 7.636 0.664 25585
1165 1 10 . 1 1 8 8 ALA N N 8 121.599 121.599 122.567 -0.968 25585
1166 1 10 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.695 -0.009 25585
1167 1 10 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.717 0.225 25585
1168 1 10 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.175 -0.018 25585
1169 1 10 . 1 1 8 8 ALA H H 8 9.286 9.286 8.961 0.325 25585
1170 1 10 . 1 1 9 9 TYR N N 9 124.797 124.797 124.228 0.569 25585
1171 1 10 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.252 0.086 25585
1172 1 10 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.473 0.842 25585
1173 1 10 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.253 0.545 25585
1174 1 10 . 1 1 9 9 TYR H H 9 9.112 9.112 8.718 0.394 25585
1175 1 10 . 1 1 10 10 ASN N N 10 128.087 128.087 125.751 2.336 25585
1176 1 10 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.934 0.145 25585
1177 1 10 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.508 -0.336 25585
1178 1 10 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.085 -1.261 25585
1179 1 10 . 1 1 10 10 ASN H H 10 8.210 8.210 8.490 -0.280 25585
1180 1 10 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.136 -0.071 25585
1181 1 10 . 1 1 11 11 PRO CA C 11 63.988 63.988 64.166 -0.178 25585
1182 1 10 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.503 0.540 25585
1183 1 10 . 1 1 12 12 VAL N N 12 119.341 119.341 115.560 3.781 25585
1184 1 10 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.111 -0.353 25585
1185 1 10 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.082 2.021 25585
1186 1 10 . 1 1 12 12 VAL CB C 12 31.723 31.723 31.483 0.240 25585
1187 1 10 . 1 1 12 12 VAL H H 12 7.570 7.570 7.466 0.104 25585
1188 1 10 . 1 1 13 13 LEU N N 13 116.412 116.412 120.147 -3.735 25585
1189 1 10 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.704 -0.415 25585
1190 1 10 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.248 0.572 25585
1191 1 10 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.575 -0.591 25585
1192 1 10 . 1 1 13 13 LEU H H 13 6.902 6.902 7.675 -0.773 25585
1193 1 10 . 1 1 14 14 GLY N N 14 108.651 108.651 107.519 1.132 25585
1194 1 10 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.099 1.144 25585
1195 1 10 . 1 1 14 14 GLY H H 14 8.387 8.387 8.579 -0.192 25585
1196 1 10 . 1 1 15 15 ILE N N 15 109.703 109.703 114.113 -4.410 25585
1197 1 10 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.811 0.018 25585
1198 1 10 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.813 -0.136 25585
1199 1 10 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.396 2.977 25585
1200 1 10 . 1 1 15 15 ILE H H 15 6.727 6.727 7.313 -0.586 25585
1201 1 10 . 1 1 16 16 CYS N N 16 120.648 120.648 119.649 0.999 25585
1202 1 10 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.313 -0.121 25585
1203 1 10 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.781 -2.788 25585
1204 1 10 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.418 15.706 25585
1205 1 10 . 1 1 16 16 CYS H H 16 8.811 8.811 8.731 0.080 25585
1206 1 10 . 1 1 17 17 THR N N 17 116.440 116.440 115.545 0.895 25585
1207 1 10 . 1 1 17 17 THR HA H 17 4.859 4.859 4.846 0.013 25585
1208 1 10 . 1 1 17 17 THR CB C 17 69.862 69.862 70.522 -0.660 25585
1209 1 10 . 1 1 17 17 THR H H 17 9.357 9.357 9.148 0.209 25585
1210 1 10 . 1 1 18 18 ILE N N 18 124.956 124.956 123.010 1.946 25585
1211 1 10 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.084 0.308 25585
1212 1 10 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.745 0.463 25585
1213 1 10 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.441 0.494 25585
1214 1 10 . 1 1 18 18 ILE H H 18 8.493 8.493 8.283 0.210 25585
1215 1 10 . 1 1 19 19 THR N N 19 119.997 119.997 122.161 -2.164 25585
1216 1 10 . 1 1 19 19 THR HA H 19 4.331 4.331 4.457 -0.126 25585
1217 1 10 . 1 1 19 19 THR CA C 19 61.222 61.222 59.886 1.336 25585
1218 1 10 . 1 1 19 19 THR CB C 19 69.839 69.839 70.860 -1.021 25585
1219 1 10 . 1 1 19 19 THR H H 19 8.060 8.060 8.050 0.010 25585
1220 1 10 . 1 1 20 20 LEU N N 20 125.150 125.150 126.154 -1.004 25585
1221 1 10 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.094 0.193 25585
1222 1 10 . 1 1 20 20 LEU CA C 20 56.119 56.119 57.665 -1.546 25585
1223 1 10 . 1 1 20 20 LEU CB C 20 42.079 42.079 41.920 0.158 25585
1224 1 10 . 1 1 20 20 LEU H H 20 8.354 8.354 8.777 -0.423 25585
1225 1 10 . 1 1 21 21 SER N N 21 115.796 115.796 115.447 0.349 25585
1226 1 10 . 1 1 21 21 SER HA H 21 4.350 4.350 4.253 0.097 25585
1227 1 10 . 1 1 21 21 SER CA C 21 58.899 58.899 60.975 -2.076 25585
1228 1 10 . 1 1 21 21 SER CB C 21 63.363 63.363 63.008 0.355 25585
1229 1 10 . 1 1 21 21 SER H H 21 8.274 8.274 8.011 0.263 25585
1230 1 10 . 1 1 22 22 ARG N N 22 122.561 122.561 120.315 2.246 25585
1231 1 10 . 1 1 22 22 ARG HA H 22 4.289 4.289 4.605 -0.316 25585
1232 1 10 . 1 1 22 22 ARG CA C 22 54.946 54.946 56.303 -1.357 25585
1233 1 10 . 1 1 22 22 ARG CB C 22 30.369 30.369 30.677 -0.308 25585
1234 1 10 . 1 1 22 22 ARG H H 22 8.149 8.149 7.859 0.290 25585
1235 1 10 . 1 1 23 23 ILE N N 23 121.335 121.335 118.046 3.289 25585
1236 1 10 . 1 1 23 23 ILE HA H 23 4.001 4.001 4.327 -0.326 25585
1237 1 10 . 1 1 23 23 ILE CA C 23 61.671 61.671 61.796 -0.125 25585
1238 1 10 . 1 1 23 23 ILE CB C 23 38.383 38.383 40.441 -2.058 25585
1239 1 10 . 1 1 23 23 ILE H H 23 8.002 8.002 8.300 -0.298 25585
1240 1 10 . 1 1 24 24 GLU N N 24 122.372 122.372 120.367 2.005 25585
1241 1 10 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.171 0.038 25585
1242 1 10 . 1 1 24 24 GLU CA C 24 56.115 56.115 55.315 0.801 25585
1243 1 10 . 1 1 24 24 GLU CB C 24 29.306 29.306 30.674 -1.368 25585
1244 1 10 . 1 1 24 24 GLU H H 24 8.317 8.317 7.243 1.074 25585
1245 1 10 . 1 1 25 25 HIS N N 25 118.365 118.365 120.212 -1.847 25585
1246 1 10 . 1 1 25 25 HIS HA H 25 5.022 5.022 4.754 0.268 25585
1247 1 10 . 1 1 25 25 HIS CA C 25 52.772 52.772 54.455 -1.683 25585
1248 1 10 . 1 1 25 25 HIS CB C 25 28.551 28.551 28.448 0.103 25585
1249 1 10 . 1 1 25 25 HIS H H 25 8.323 8.323 8.350 -0.027 25585
1250 1 10 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.112 0.356 25585
1251 1 10 . 1 1 26 26 PRO CA C 26 63.834 63.834 64.618 -0.784 25585
1252 1 10 . 1 1 26 26 PRO CB C 26 31.936 31.936 31.474 0.462 25585
1253 1 10 . 1 1 27 27 GLY N N 27 108.880 108.880 106.204 2.676 25585
1254 1 10 . 1 1 27 27 GLY CA C 27 45.212 45.212 45.876 -0.664 25585
1255 1 10 . 1 1 27 27 GLY H H 27 8.594 8.594 8.391 0.203 25585
1256 1 10 . 1 1 28 28 ASN N N 28 118.144 118.144 121.404 -3.260 25585
1257 1 10 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.470 0.195 25585
1258 1 10 . 1 1 28 28 ASN CA C 28 52.967 52.967 55.172 -2.205 25585
1259 1 10 . 1 1 28 28 ASN CB C 28 38.579 38.579 38.974 -0.395 25585
1260 1 10 . 1 1 28 28 ASN H H 28 8.154 8.154 7.663 0.491 25585
1261 1 10 . 1 1 29 29 TYR N N 29 119.962 119.962 116.374 3.588 25585
1262 1 10 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.941 -0.421 25585
1263 1 10 . 1 1 29 29 TYR CA C 29 57.544 57.544 55.096 2.447 25585
1264 1 10 . 1 1 29 29 TYR CB C 29 39.011 39.011 37.539 1.472 25585
1265 1 10 . 1 1 29 29 TYR H H 29 8.058 8.058 7.015 1.043 25585
1266 1 10 . 1 1 30 30 ASP N N 30 120.874 120.874 121.075 -0.201 25585
1267 1 10 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.370 0.309 25585
1268 1 10 . 1 1 30 30 ASP CA C 30 52.827 52.827 54.818 -1.991 25585
1269 1 10 . 1 1 30 30 ASP CB C 30 38.567 38.567 40.766 -2.199 25585
1270 1 10 . 1 1 30 30 ASP H H 30 8.226 8.226 7.774 0.452 25585
1271 1 11 . 1 1 3 3 CYS N N 3 120.614 120.614 123.846 -3.232 25585
1272 1 11 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.517 0.282 25585
1273 1 11 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.171 -5.379 25585
1274 1 11 . 1 1 3 3 CYS CB C 3 42.170 42.170 30.261 11.909 25585
1275 1 11 . 1 1 3 3 CYS H H 3 7.958 7.958 7.589 0.369 25585
1276 1 11 . 1 1 4 4 GLN N N 4 121.450 121.450 120.654 0.796 25585
1277 1 11 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.154 0.026 25585
1278 1 11 . 1 1 4 4 GLN CA C 4 54.557 54.557 52.944 1.613 25585
1279 1 11 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.420 -1.229 25585
1280 1 11 . 1 1 4 4 GLN H H 4 8.737 8.737 8.124 0.613 25585
1281 1 11 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.157 0.252 25585
1282 1 11 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.485 -0.131 25585
1283 1 11 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.684 0.026 25585
1284 1 11 . 1 1 6 6 GLY N N 6 111.865 111.865 109.669 2.196 25585
1285 1 11 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.507 -0.444 25585
1286 1 11 . 1 1 6 6 GLY H H 6 8.948 8.948 8.669 0.279 25585
1287 1 11 . 1 1 7 7 TYR N N 7 120.136 120.136 119.643 0.493 25585
1288 1 11 . 1 1 7 7 TYR HA H 7 5.057 5.057 5.141 -0.084 25585
1289 1 11 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.437 -0.044 25585
1290 1 11 . 1 1 7 7 TYR CB C 7 41.345 41.345 42.143 -0.798 25585
1291 1 11 . 1 1 7 7 TYR H H 7 8.300 8.300 7.673 0.627 25585
1292 1 11 . 1 1 8 8 ALA N N 8 121.599 121.599 122.853 -1.254 25585
1293 1 11 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.671 0.015 25585
1294 1 11 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.678 0.264 25585
1295 1 11 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.168 -0.011 25585
1296 1 11 . 1 1 8 8 ALA H H 8 9.286 9.286 8.913 0.373 25585
1297 1 11 . 1 1 9 9 TYR N N 9 124.797 124.797 124.266 0.531 25585
1298 1 11 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.233 0.105 25585
1299 1 11 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.485 0.830 25585
1300 1 11 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.254 0.544 25585
1301 1 11 . 1 1 9 9 TYR H H 9 9.112 9.112 8.697 0.415 25585
1302 1 11 . 1 1 10 10 ASN N N 10 128.087 128.087 125.680 2.407 25585
1303 1 11 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.927 0.152 25585
1304 1 11 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.507 -0.335 25585
1305 1 11 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.030 -1.206 25585
1306 1 11 . 1 1 10 10 ASN H H 10 8.210 8.210 8.362 -0.152 25585
1307 1 11 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.107 -0.042 25585
1308 1 11 . 1 1 11 11 PRO CA C 11 63.988 63.988 64.151 -0.163 25585
1309 1 11 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.487 0.556 25585
1310 1 11 . 1 1 12 12 VAL N N 12 119.341 119.341 115.566 3.775 25585
1311 1 11 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.104 -0.346 25585
1312 1 11 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.084 2.019 25585
1313 1 11 . 1 1 12 12 VAL CB C 12 31.723 31.723 31.476 0.247 25585
1314 1 11 . 1 1 12 12 VAL H H 12 7.570 7.570 7.449 0.121 25585
1315 1 11 . 1 1 13 13 LEU N N 13 116.412 116.412 120.125 -3.713 25585
1316 1 11 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.702 -0.412 25585
1317 1 11 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.246 0.574 25585
1318 1 11 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.573 -0.589 25585
1319 1 11 . 1 1 13 13 LEU H H 13 6.902 6.902 7.685 -0.783 25585
1320 1 11 . 1 1 14 14 GLY N N 14 108.651 108.651 106.712 1.939 25585
1321 1 11 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.201 1.042 25585
1322 1 11 . 1 1 14 14 GLY H H 14 8.387 8.387 8.451 -0.064 25585
1323 1 11 . 1 1 15 15 ILE N N 15 109.703 109.703 113.360 -3.657 25585
1324 1 11 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.775 0.054 25585
1325 1 11 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.707 -0.030 25585
1326 1 11 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.343 3.030 25585
1327 1 11 . 1 1 15 15 ILE H H 15 6.727 6.727 7.280 -0.553 25585
1328 1 11 . 1 1 16 16 CYS N N 16 120.648 120.648 119.534 1.114 25585
1329 1 11 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.237 -0.045 25585
1330 1 11 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.680 -2.687 25585
1331 1 11 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.283 15.841 25585
1332 1 11 . 1 1 16 16 CYS H H 16 8.811 8.811 8.764 0.047 25585
1333 1 11 . 1 1 17 17 THR N N 17 116.440 116.440 115.476 0.964 25585
1334 1 11 . 1 1 17 17 THR HA H 17 4.859 4.859 4.874 -0.015 25585
1335 1 11 . 1 1 17 17 THR CB C 17 69.862 69.862 70.719 -0.857 25585
1336 1 11 . 1 1 17 17 THR H H 17 9.357 9.357 9.114 0.243 25585
1337 1 11 . 1 1 18 18 ILE N N 18 124.956 124.956 124.205 0.751 25585
1338 1 11 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.130 0.262 25585
1339 1 11 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.499 0.709 25585
1340 1 11 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.393 0.542 25585
1341 1 11 . 1 1 18 18 ILE H H 18 8.493 8.493 8.469 0.024 25585
1342 1 11 . 1 1 19 19 THR N N 19 119.997 119.997 123.269 -3.272 25585
1343 1 11 . 1 1 19 19 THR HA H 19 4.331 4.331 4.448 -0.117 25585
1344 1 11 . 1 1 19 19 THR CA C 19 61.222 61.222 60.540 0.682 25585
1345 1 11 . 1 1 19 19 THR CB C 19 69.839 69.839 70.413 -0.574 25585
1346 1 11 . 1 1 19 19 THR H H 19 8.060 8.060 8.318 -0.258 25585
1347 1 11 . 1 1 20 20 LEU N N 20 125.150 125.150 124.055 1.095 25585
1348 1 11 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.103 0.184 25585
1349 1 11 . 1 1 20 20 LEU CA C 20 56.119 56.119 56.913 -0.794 25585
1350 1 11 . 1 1 20 20 LEU CB C 20 42.079 42.079 41.917 0.162 25585
1351 1 11 . 1 1 20 20 LEU H H 20 8.354 8.354 8.718 -0.364 25585
1352 1 11 . 1 1 21 21 SER N N 21 115.796 115.796 115.417 0.379 25585
1353 1 11 . 1 1 21 21 SER HA H 21 4.350 4.350 4.119 0.231 25585
1354 1 11 . 1 1 21 21 SER CA C 21 58.899 58.899 61.292 -2.393 25585
1355 1 11 . 1 1 21 21 SER CB C 21 63.363 63.363 62.873 0.490 25585
1356 1 11 . 1 1 21 21 SER H H 21 8.274 8.274 8.278 -0.004 25585
1357 1 11 . 1 1 22 22 ARG N N 22 122.561 122.561 121.732 0.829 25585
1358 1 11 . 1 1 22 22 ARG HA H 22 4.289 4.289 4.043 0.246 25585
1359 1 11 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.552 -3.606 25585
1360 1 11 . 1 1 22 22 ARG CB C 22 30.369 30.369 29.875 0.494 25585
1361 1 11 . 1 1 22 22 ARG H H 22 8.149 8.149 7.407 0.742 25585
1362 1 11 . 1 1 23 23 ILE N N 23 121.335 121.335 119.927 1.408 25585
1363 1 11 . 1 1 23 23 ILE HA H 23 4.001 4.001 3.736 0.265 25585
1364 1 11 . 1 1 23 23 ILE CA C 23 61.671 61.671 63.993 -2.322 25585
1365 1 11 . 1 1 23 23 ILE CB C 23 38.383 38.383 38.138 0.245 25585
1366 1 11 . 1 1 23 23 ILE H H 23 8.002 8.002 7.886 0.116 25585
1367 1 11 . 1 1 24 24 GLU N N 24 122.372 122.372 114.170 8.202 25585
1368 1 11 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.376 -0.167 25585
1369 1 11 . 1 1 24 24 GLU CA C 24 56.115 56.115 55.684 0.431 25585
1370 1 11 . 1 1 24 24 GLU CB C 24 29.306 29.306 30.438 -1.132 25585
1371 1 11 . 1 1 24 24 GLU H H 24 8.317 8.317 8.479 -0.162 25585
1372 1 11 . 1 1 25 25 HIS N N 25 118.365 118.365 118.961 -0.596 25585
1373 1 11 . 1 1 25 25 HIS HA H 25 5.022 5.022 4.914 0.108 25585
1374 1 11 . 1 1 25 25 HIS CA C 25 52.772 52.772 53.690 -0.918 25585
1375 1 11 . 1 1 25 25 HIS CB C 25 28.551 28.551 29.332 -0.781 25585
1376 1 11 . 1 1 25 25 HIS H H 25 8.323 8.323 7.794 0.529 25585
1377 1 11 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.380 0.088 25585
1378 1 11 . 1 1 26 26 PRO CA C 26 63.834 63.834 64.057 -0.223 25585
1379 1 11 . 1 1 26 26 PRO CB C 26 31.936 31.936 31.784 0.152 25585
1380 1 11 . 1 1 27 27 GLY N N 27 108.880 108.880 105.873 3.007 25585
1381 1 11 . 1 1 27 27 GLY CA C 27 45.212 45.212 45.274 -0.062 25585
1382 1 11 . 1 1 27 27 GLY H H 27 8.594 8.594 8.588 0.006 25585
1383 1 11 . 1 1 28 28 ASN N N 28 118.144 118.144 117.599 0.545 25585
1384 1 11 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.335 0.330 25585
1385 1 11 . 1 1 28 28 ASN CA C 28 52.967 52.967 53.649 -0.682 25585
1386 1 11 . 1 1 28 28 ASN CB C 28 38.579 38.579 37.419 1.160 25585
1387 1 11 . 1 1 28 28 ASN H H 28 8.154 8.154 7.778 0.376 25585
1388 1 11 . 1 1 29 29 TYR N N 29 119.962 119.962 112.147 7.815 25585
1389 1 11 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.163 0.357 25585
1390 1 11 . 1 1 29 29 TYR CA C 29 57.544 57.544 58.456 -0.912 25585
1391 1 11 . 1 1 29 29 TYR CB C 29 39.011 39.011 36.410 2.601 25585
1392 1 11 . 1 1 29 29 TYR H H 29 8.058 8.058 7.896 0.162 25585
1393 1 11 . 1 1 30 30 ASP N N 30 120.874 120.874 117.543 3.331 25585
1394 1 11 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.185 0.494 25585
1395 1 11 . 1 1 30 30 ASP CA C 30 52.827 52.827 55.122 -2.295 25585
1396 1 11 . 1 1 30 30 ASP CB C 30 38.567 38.567 40.034 -1.467 25585
1397 1 11 . 1 1 30 30 ASP H H 30 8.226 8.226 7.997 0.229 25585
1398 1 12 . 1 1 3 3 CYS N N 3 120.614 120.614 123.890 -3.276 25585
1399 1 12 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.559 0.240 25585
1400 1 12 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.201 -5.409 25585
1401 1 12 . 1 1 3 3 CYS CB C 3 42.170 42.170 30.218 11.952 25585
1402 1 12 . 1 1 3 3 CYS H H 3 7.958 7.958 7.615 0.343 25585
1403 1 12 . 1 1 4 4 GLN N N 4 121.450 121.450 120.779 0.671 25585
1404 1 12 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.153 0.027 25585
1405 1 12 . 1 1 4 4 GLN CA C 4 54.557 54.557 53.063 1.494 25585
1406 1 12 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.392 -1.201 25585
1407 1 12 . 1 1 4 4 GLN H H 4 8.737 8.737 8.166 0.571 25585
1408 1 12 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.177 0.232 25585
1409 1 12 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.392 -0.038 25585
1410 1 12 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.658 0.052 25585
1411 1 12 . 1 1 6 6 GLY N N 6 111.865 111.865 109.857 2.008 25585
1412 1 12 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.493 -0.430 25585
1413 1 12 . 1 1 6 6 GLY H H 6 8.948 8.948 8.679 0.269 25585
1414 1 12 . 1 1 7 7 TYR N N 7 120.136 120.136 119.691 0.445 25585
1415 1 12 . 1 1 7 7 TYR HA H 7 5.057 5.057 5.076 -0.019 25585
1416 1 12 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.511 -0.118 25585
1417 1 12 . 1 1 7 7 TYR CB C 7 41.345 41.345 42.090 -0.745 25585
1418 1 12 . 1 1 7 7 TYR H H 7 8.300 8.300 7.658 0.642 25585
1419 1 12 . 1 1 8 8 ALA N N 8 121.599 121.599 122.773 -1.174 25585
1420 1 12 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.695 -0.009 25585
1421 1 12 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.720 0.222 25585
1422 1 12 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.118 0.039 25585
1423 1 12 . 1 1 8 8 ALA H H 8 9.286 9.286 8.906 0.380 25585
1424 1 12 . 1 1 9 9 TYR N N 9 124.797 124.797 124.359 0.438 25585
1425 1 12 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.239 0.099 25585
1426 1 12 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.536 0.778 25585
1427 1 12 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.258 0.540 25585
1428 1 12 . 1 1 9 9 TYR H H 9 9.112 9.112 8.721 0.391 25585
1429 1 12 . 1 1 10 10 ASN N N 10 128.087 128.087 125.675 2.412 25585
1430 1 12 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.932 0.147 25585
1431 1 12 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.514 -0.342 25585
1432 1 12 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.053 -1.228 25585
1433 1 12 . 1 1 10 10 ASN H H 10 8.210 8.210 8.372 -0.162 25585
1434 1 12 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.102 -0.037 25585
1435 1 12 . 1 1 11 11 PRO CA C 11 63.988 63.988 64.153 -0.165 25585
1436 1 12 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.525 0.518 25585
1437 1 12 . 1 1 12 12 VAL N N 12 119.341 119.341 115.034 4.307 25585
1438 1 12 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.046 -0.288 25585
1439 1 12 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.230 1.873 25585
1440 1 12 . 1 1 12 12 VAL CB C 12 31.723 31.723 32.066 -0.343 25585
1441 1 12 . 1 1 12 12 VAL H H 12 7.570 7.570 7.512 0.058 25585
1442 1 12 . 1 1 13 13 LEU N N 13 116.412 116.412 120.340 -3.928 25585
1443 1 12 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.712 -0.423 25585
1444 1 12 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.377 0.443 25585
1445 1 12 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.635 -0.651 25585
1446 1 12 . 1 1 13 13 LEU H H 13 6.902 6.902 7.726 -0.824 25585
1447 1 12 . 1 1 14 14 GLY N N 14 108.651 108.651 107.276 1.375 25585
1448 1 12 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.114 1.129 25585
1449 1 12 . 1 1 14 14 GLY H H 14 8.387 8.387 8.605 -0.218 25585
1450 1 12 . 1 1 15 15 ILE N N 15 109.703 109.703 114.070 -4.367 25585
1451 1 12 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.803 0.026 25585
1452 1 12 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.895 -0.218 25585
1453 1 12 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.431 2.942 25585
1454 1 12 . 1 1 15 15 ILE H H 15 6.727 6.727 7.312 -0.585 25585
1455 1 12 . 1 1 16 16 CYS N N 16 120.648 120.648 120.698 -0.050 25585
1456 1 12 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.281 -0.089 25585
1457 1 12 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.203 -2.210 25585
1458 1 12 . 1 1 16 16 CYS CB C 16 43.124 43.124 26.961 16.163 25585
1459 1 12 . 1 1 16 16 CYS H H 16 8.811 8.811 8.689 0.122 25585
1460 1 12 . 1 1 17 17 THR N N 17 116.440 116.440 114.327 2.113 25585
1461 1 12 . 1 1 17 17 THR HA H 17 4.859 4.859 4.822 0.037 25585
1462 1 12 . 1 1 17 17 THR CB C 17 69.862 69.862 71.365 -1.503 25585
1463 1 12 . 1 1 17 17 THR H H 17 9.357 9.357 8.959 0.398 25585
1464 1 12 . 1 1 18 18 ILE N N 18 124.956 124.956 123.353 1.603 25585
1465 1 12 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.068 0.324 25585
1466 1 12 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.931 0.277 25585
1467 1 12 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.286 0.649 25585
1468 1 12 . 1 1 18 18 ILE H H 18 8.493 8.493 8.346 0.147 25585
1469 1 12 . 1 1 19 19 THR N N 19 119.997 119.997 122.145 -2.148 25585
1470 1 12 . 1 1 19 19 THR HA H 19 4.331 4.331 4.439 -0.108 25585
1471 1 12 . 1 1 19 19 THR CA C 19 61.222 61.222 60.189 1.033 25585
1472 1 12 . 1 1 19 19 THR CB C 19 69.839 69.839 70.885 -1.046 25585
1473 1 12 . 1 1 19 19 THR H H 19 8.060 8.060 8.037 0.023 25585
1474 1 12 . 1 1 20 20 LEU N N 20 125.150 125.150 127.234 -2.084 25585
1475 1 12 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.184 0.103 25585
1476 1 12 . 1 1 20 20 LEU CA C 20 56.119 56.119 57.538 -1.419 25585
1477 1 12 . 1 1 20 20 LEU CB C 20 42.079 42.079 42.095 -0.016 25585
1478 1 12 . 1 1 20 20 LEU H H 20 8.354 8.354 8.678 -0.324 25585
1479 1 12 . 1 1 21 21 SER N N 21 115.796 115.796 114.341 1.455 25585
1480 1 12 . 1 1 21 21 SER HA H 21 4.350 4.350 4.262 0.088 25585
1481 1 12 . 1 1 21 21 SER CA C 21 58.899 58.899 60.747 -1.848 25585
1482 1 12 . 1 1 21 21 SER CB C 21 63.363 63.363 62.966 0.397 25585
1483 1 12 . 1 1 21 21 SER H H 21 8.274 8.274 8.059 0.215 25585
1484 1 12 . 1 1 22 22 ARG N N 22 122.561 122.561 122.145 0.416 25585
1485 1 12 . 1 1 22 22 ARG HA H 22 4.289 4.289 4.057 0.232 25585
1486 1 12 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.189 -3.243 25585
1487 1 12 . 1 1 22 22 ARG CB C 22 30.369 30.369 30.036 0.333 25585
1488 1 12 . 1 1 22 22 ARG H H 22 8.149 8.149 7.560 0.589 25585
1489 1 12 . 1 1 23 23 ILE N N 23 121.335 121.335 119.216 2.119 25585
1490 1 12 . 1 1 23 23 ILE HA H 23 4.001 4.001 3.778 0.223 25585
1491 1 12 . 1 1 23 23 ILE CA C 23 61.671 61.671 63.984 -2.313 25585
1492 1 12 . 1 1 23 23 ILE CB C 23 38.383 38.383 38.200 0.183 25585
1493 1 12 . 1 1 23 23 ILE H H 23 8.002 8.002 7.970 0.032 25585
1494 1 12 . 1 1 24 24 GLU N N 24 122.372 122.372 114.799 7.573 25585
1495 1 12 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.266 -0.057 25585
1496 1 12 . 1 1 24 24 GLU CA C 24 56.115 56.115 56.184 -0.069 25585
1497 1 12 . 1 1 24 24 GLU CB C 24 29.306 29.306 31.276 -1.970 25585
1498 1 12 . 1 1 24 24 GLU H H 24 8.317 8.317 8.624 -0.307 25585
1499 1 12 . 1 1 25 25 HIS N N 25 118.365 118.365 113.852 4.513 25585
1500 1 12 . 1 1 25 25 HIS HA H 25 5.022 5.022 4.841 0.181 25585
1501 1 12 . 1 1 25 25 HIS CA C 25 52.772 52.772 53.574 -0.802 25585
1502 1 12 . 1 1 25 25 HIS CB C 25 28.551 28.551 29.529 -0.978 25585
1503 1 12 . 1 1 25 25 HIS H H 25 8.323 8.323 7.645 0.678 25585
1504 1 12 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.443 0.025 25585
1505 1 12 . 1 1 26 26 PRO CA C 26 63.834 63.834 64.927 -1.093 25585
1506 1 12 . 1 1 26 26 PRO CB C 26 31.936 31.936 32.053 -0.117 25585
1507 1 12 . 1 1 27 27 GLY N N 27 108.880 108.880 105.868 3.012 25585
1508 1 12 . 1 1 27 27 GLY CA C 27 45.212 45.212 44.957 0.255 25585
1509 1 12 . 1 1 27 27 GLY H H 27 8.594 8.594 8.559 0.035 25585
1510 1 12 . 1 1 28 28 ASN N N 28 118.144 118.144 117.085 1.059 25585
1511 1 12 . 1 1 28 28 ASN HA H 28 4.665 4.665 3.287 1.378 25585
1512 1 12 . 1 1 28 28 ASN CA C 28 52.967 52.967 52.746 0.221 25585
1513 1 12 . 1 1 28 28 ASN CB C 28 38.579 38.579 37.482 1.097 25585
1514 1 12 . 1 1 28 28 ASN H H 28 8.154 8.154 8.334 -0.180 25585
1515 1 12 . 1 1 29 29 TYR N N 29 119.962 119.962 118.399 1.563 25585
1516 1 12 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.791 -0.271 25585
1517 1 12 . 1 1 29 29 TYR CA C 29 57.544 57.544 54.840 2.704 25585
1518 1 12 . 1 1 29 29 TYR CB C 29 39.011 39.011 36.433 2.578 25585
1519 1 12 . 1 1 29 29 TYR H H 29 8.058 8.058 7.025 1.033 25585
1520 1 12 . 1 1 30 30 ASP N N 30 120.874 120.874 120.948 -0.074 25585
1521 1 12 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.436 0.243 25585
1522 1 12 . 1 1 30 30 ASP CA C 30 52.827 52.827 53.773 -0.945 25585
1523 1 12 . 1 1 30 30 ASP CB C 30 38.567 38.567 40.355 -1.788 25585
1524 1 12 . 1 1 30 30 ASP H H 30 8.226 8.226 8.439 -0.213 25585
1525 1 13 . 1 1 3 3 CYS N N 3 120.614 120.614 123.623 -3.009 25585
1526 1 13 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.529 0.270 25585
1527 1 13 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.812 -6.020 25585
1528 1 13 . 1 1 3 3 CYS CB C 3 42.170 42.170 29.748 12.422 25585
1529 1 13 . 1 1 3 3 CYS H H 3 7.958 7.958 7.570 0.388 25585
1530 1 13 . 1 1 4 4 GLN N N 4 121.450 121.450 121.005 0.445 25585
1531 1 13 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.135 0.045 25585
1532 1 13 . 1 1 4 4 GLN CA C 4 54.557 54.557 53.046 1.511 25585
1533 1 13 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.411 -1.220 25585
1534 1 13 . 1 1 4 4 GLN H H 4 8.737 8.737 8.178 0.559 25585
1535 1 13 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.255 0.154 25585
1536 1 13 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.254 0.100 25585
1537 1 13 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.490 0.220 25585
1538 1 13 . 1 1 6 6 GLY N N 6 111.865 111.865 110.328 1.537 25585
1539 1 13 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.545 -0.482 25585
1540 1 13 . 1 1 6 6 GLY H H 6 8.948 8.948 8.793 0.155 25585
1541 1 13 . 1 1 7 7 TYR N N 7 120.136 120.136 119.589 0.547 25585
1542 1 13 . 1 1 7 7 TYR HA H 7 5.057 5.057 4.972 0.085 25585
1543 1 13 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.583 -0.190 25585
1544 1 13 . 1 1 7 7 TYR CB C 7 41.345 41.345 42.101 -0.756 25585
1545 1 13 . 1 1 7 7 TYR H H 7 8.300 8.300 7.584 0.716 25585
1546 1 13 . 1 1 8 8 ALA N N 8 121.599 121.599 122.756 -1.157 25585
1547 1 13 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.690 -0.004 25585
1548 1 13 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.607 0.335 25585
1549 1 13 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.092 0.065 25585
1550 1 13 . 1 1 8 8 ALA H H 8 9.286 9.286 8.942 0.344 25585
1551 1 13 . 1 1 9 9 TYR N N 9 124.797 124.797 124.801 -0.004 25585
1552 1 13 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.242 0.096 25585
1553 1 13 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.147 1.168 25585
1554 1 13 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.130 0.668 25585
1555 1 13 . 1 1 9 9 TYR H H 9 9.112 9.112 8.727 0.385 25585
1556 1 13 . 1 1 10 10 ASN N N 10 128.087 128.087 125.988 2.099 25585
1557 1 13 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.889 0.190 25585
1558 1 13 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.487 -0.315 25585
1559 1 13 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.384 -1.560 25585
1560 1 13 . 1 1 10 10 ASN H H 10 8.210 8.210 8.704 -0.494 25585
1561 1 13 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.395 -0.330 25585
1562 1 13 . 1 1 11 11 PRO CA C 11 63.988 63.988 64.203 -0.214 25585
1563 1 13 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.629 0.414 25585
1564 1 13 . 1 1 12 12 VAL N N 12 119.341 119.341 116.134 3.207 25585
1565 1 13 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.095 -0.337 25585
1566 1 13 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.394 1.709 25585
1567 1 13 . 1 1 12 12 VAL CB C 12 31.723 31.723 31.847 -0.124 25585
1568 1 13 . 1 1 12 12 VAL H H 12 7.570 7.570 7.534 0.036 25585
1569 1 13 . 1 1 13 13 LEU N N 13 116.412 116.412 120.127 -3.715 25585
1570 1 13 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.747 -0.458 25585
1571 1 13 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.248 0.572 25585
1572 1 13 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.455 -0.471 25585
1573 1 13 . 1 1 13 13 LEU H H 13 6.902 6.902 7.522 -0.620 25585
1574 1 13 . 1 1 14 14 GLY N N 14 108.651 108.651 107.435 1.216 25585
1575 1 13 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.065 1.178 25585
1576 1 13 . 1 1 14 14 GLY H H 14 8.387 8.387 8.554 -0.167 25585
1577 1 13 . 1 1 15 15 ILE N N 15 109.703 109.703 113.751 -4.048 25585
1578 1 13 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.755 0.074 25585
1579 1 13 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.928 -0.251 25585
1580 1 13 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.242 3.131 25585
1581 1 13 . 1 1 15 15 ILE H H 15 6.727 6.727 7.412 -0.685 25585
1582 1 13 . 1 1 16 16 CYS N N 16 120.648 120.648 120.350 0.298 25585
1583 1 13 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.450 -0.258 25585
1584 1 13 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.644 -2.651 25585
1585 1 13 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.366 15.758 25585
1586 1 13 . 1 1 16 16 CYS H H 16 8.811 8.811 8.686 0.125 25585
1587 1 13 . 1 1 17 17 THR N N 17 116.440 116.440 115.168 1.272 25585
1588 1 13 . 1 1 17 17 THR HA H 17 4.859 4.859 4.852 0.007 25585
1589 1 13 . 1 1 17 17 THR CB C 17 69.862 69.862 71.517 -1.655 25585
1590 1 13 . 1 1 17 17 THR H H 17 9.357 9.357 9.016 0.341 25585
1591 1 13 . 1 1 18 18 ILE N N 18 124.956 124.956 124.007 0.949 25585
1592 1 13 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.078 0.314 25585
1593 1 13 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.964 0.244 25585
1594 1 13 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.549 0.386 25585
1595 1 13 . 1 1 18 18 ILE H H 18 8.493 8.493 8.452 0.041 25585
1596 1 13 . 1 1 19 19 THR N N 19 119.997 119.997 122.506 -2.509 25585
1597 1 13 . 1 1 19 19 THR HA H 19 4.331 4.331 4.427 -0.096 25585
1598 1 13 . 1 1 19 19 THR CA C 19 61.222 61.222 59.907 1.315 25585
1599 1 13 . 1 1 19 19 THR CB C 19 69.839 69.839 70.427 -0.588 25585
1600 1 13 . 1 1 19 19 THR H H 19 8.060 8.060 8.278 -0.218 25585
1601 1 13 . 1 1 20 20 LEU N N 20 125.150 125.150 122.493 2.657 25585
1602 1 13 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.381 -0.094 25585
1603 1 13 . 1 1 20 20 LEU CA C 20 56.119 56.119 55.810 0.309 25585
1604 1 13 . 1 1 20 20 LEU CB C 20 42.079 42.079 40.880 1.199 25585
1605 1 13 . 1 1 20 20 LEU H H 20 8.354 8.354 8.627 -0.273 25585
1606 1 13 . 1 1 21 21 SER N N 21 115.796 115.796 112.077 3.719 25585
1607 1 13 . 1 1 21 21 SER HA H 21 4.350 4.350 4.047 0.303 25585
1608 1 13 . 1 1 21 21 SER CA C 21 58.899 58.899 58.634 0.265 25585
1609 1 13 . 1 1 21 21 SER CB C 21 63.363 63.363 63.001 0.362 25585
1610 1 13 . 1 1 21 21 SER H H 21 8.274 8.274 7.483 0.791 25585
1611 1 13 . 1 1 22 22 ARG N N 22 122.561 122.561 120.409 2.152 25585
1612 1 13 . 1 1 22 22 ARG HA H 22 4.289 4.289 4.541 -0.252 25585
1613 1 13 . 1 1 22 22 ARG CA C 22 54.946 54.946 57.233 -2.287 25585
1614 1 13 . 1 1 22 22 ARG CB C 22 30.369 30.369 32.022 -1.653 25585
1615 1 13 . 1 1 22 22 ARG H H 22 8.149 8.149 7.686 0.463 25585
1616 1 13 . 1 1 23 23 ILE N N 23 121.335 121.335 121.692 -0.357 25585
1617 1 13 . 1 1 23 23 ILE HA H 23 4.001 4.001 3.769 0.232 25585
1618 1 13 . 1 1 23 23 ILE CA C 23 61.671 61.671 65.052 -3.381 25585
1619 1 13 . 1 1 23 23 ILE CB C 23 38.383 38.383 38.298 0.085 25585
1620 1 13 . 1 1 23 23 ILE H H 23 8.002 8.002 7.637 0.365 25585
1621 1 13 . 1 1 24 24 GLU N N 24 122.372 122.372 118.201 4.171 25585
1622 1 13 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.164 0.045 25585
1623 1 13 . 1 1 24 24 GLU CA C 24 56.115 56.115 55.469 0.646 25585
1624 1 13 . 1 1 24 24 GLU CB C 24 29.306 29.306 29.063 0.243 25585
1625 1 13 . 1 1 24 24 GLU H H 24 8.317 8.317 8.121 0.196 25585
1626 1 13 . 1 1 25 25 HIS N N 25 118.365 118.365 114.717 3.648 25585
1627 1 13 . 1 1 25 25 HIS HA H 25 5.022 5.022 4.994 0.028 25585
1628 1 13 . 1 1 25 25 HIS CA C 25 52.772 52.772 54.045 -1.273 25585
1629 1 13 . 1 1 25 25 HIS CB C 25 28.551 28.551 27.740 0.811 25585
1630 1 13 . 1 1 25 25 HIS H H 25 8.323 8.323 7.514 0.809 25585
1631 1 13 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.329 0.139 25585
1632 1 13 . 1 1 26 26 PRO CA C 26 63.834 63.834 64.950 -1.116 25585
1633 1 13 . 1 1 26 26 PRO CB C 26 31.936 31.936 32.160 -0.224 25585
1634 1 13 . 1 1 27 27 GLY N N 27 108.880 108.880 103.615 5.265 25585
1635 1 13 . 1 1 27 27 GLY CA C 27 45.212 45.212 45.165 0.047 25585
1636 1 13 . 1 1 27 27 GLY H H 27 8.594 8.594 8.627 -0.033 25585
1637 1 13 . 1 1 28 28 ASN N N 28 118.144 118.144 117.139 1.005 25585
1638 1 13 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.239 0.426 25585
1639 1 13 . 1 1 28 28 ASN CA C 28 52.967 52.967 53.352 -0.385 25585
1640 1 13 . 1 1 28 28 ASN CB C 28 38.579 38.579 37.465 1.114 25585
1641 1 13 . 1 1 28 28 ASN H H 28 8.154 8.154 7.952 0.202 25585
1642 1 13 . 1 1 29 29 TYR N N 29 119.962 119.962 115.301 4.661 25585
1643 1 13 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.868 -0.348 25585
1644 1 13 . 1 1 29 29 TYR CA C 29 57.544 57.544 54.364 3.180 25585
1645 1 13 . 1 1 29 29 TYR CB C 29 39.011 39.011 36.314 2.697 25585
1646 1 13 . 1 1 29 29 TYR H H 29 8.058 8.058 7.240 0.818 25585
1647 1 13 . 1 1 30 30 ASP N N 30 120.874 120.874 122.241 -1.367 25585
1648 1 13 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.269 0.410 25585
1649 1 13 . 1 1 30 30 ASP CA C 30 52.827 52.827 55.016 -2.189 25585
1650 1 13 . 1 1 30 30 ASP CB C 30 38.567 38.567 41.148 -2.581 25585
1651 1 13 . 1 1 30 30 ASP H H 30 8.226 8.226 8.360 -0.134 25585
1652 1 14 . 1 1 3 3 CYS N N 3 120.614 120.614 124.066 -3.452 25585
1653 1 14 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.556 0.243 25585
1654 1 14 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.255 -5.463 25585
1655 1 14 . 1 1 3 3 CYS CB C 3 42.170 42.170 30.012 12.158 25585
1656 1 14 . 1 1 3 3 CYS H H 3 7.958 7.958 7.619 0.339 25585
1657 1 14 . 1 1 4 4 GLN N N 4 121.450 121.450 120.920 0.530 25585
1658 1 14 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.124 0.056 25585
1659 1 14 . 1 1 4 4 GLN CA C 4 54.557 54.557 53.039 1.518 25585
1660 1 14 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.397 -1.206 25585
1661 1 14 . 1 1 4 4 GLN H H 4 8.737 8.737 8.172 0.565 25585
1662 1 14 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.173 0.236 25585
1663 1 14 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.405 -0.051 25585
1664 1 14 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.659 0.051 25585
1665 1 14 . 1 1 6 6 GLY N N 6 111.865 111.865 109.792 2.073 25585
1666 1 14 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.490 -0.428 25585
1667 1 14 . 1 1 6 6 GLY H H 6 8.948 8.948 8.676 0.272 25585
1668 1 14 . 1 1 7 7 TYR N N 7 120.136 120.136 119.632 0.504 25585
1669 1 14 . 1 1 7 7 TYR HA H 7 5.057 5.057 5.124 -0.067 25585
1670 1 14 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.479 -0.086 25585
1671 1 14 . 1 1 7 7 TYR CB C 7 41.345 41.345 42.177 -0.832 25585
1672 1 14 . 1 1 7 7 TYR H H 7 8.300 8.300 7.646 0.654 25585
1673 1 14 . 1 1 8 8 ALA N N 8 121.599 121.599 122.638 -1.039 25585
1674 1 14 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.683 0.003 25585
1675 1 14 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.705 0.237 25585
1676 1 14 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.165 -0.008 25585
1677 1 14 . 1 1 8 8 ALA H H 8 9.286 9.286 8.906 0.380 25585
1678 1 14 . 1 1 9 9 TYR N N 9 124.797 124.797 124.155 0.642 25585
1679 1 14 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.244 0.094 25585
1680 1 14 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.500 0.815 25585
1681 1 14 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.268 0.530 25585
1682 1 14 . 1 1 9 9 TYR H H 9 9.112 9.112 8.704 0.408 25585
1683 1 14 . 1 1 10 10 ASN N N 10 128.087 128.087 125.665 2.422 25585
1684 1 14 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.931 0.148 25585
1685 1 14 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.505 -0.333 25585
1686 1 14 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.028 -1.204 25585
1687 1 14 . 1 1 10 10 ASN H H 10 8.210 8.210 8.417 -0.207 25585
1688 1 14 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.110 -0.045 25585
1689 1 14 . 1 1 11 11 PRO CA C 11 63.988 63.988 64.311 -0.323 25585
1690 1 14 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.520 0.523 25585
1691 1 14 . 1 1 12 12 VAL N N 12 119.341 119.341 115.408 3.933 25585
1692 1 14 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.068 -0.310 25585
1693 1 14 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.526 1.577 25585
1694 1 14 . 1 1 12 12 VAL CB C 12 31.723 31.723 31.912 -0.189 25585
1695 1 14 . 1 1 12 12 VAL H H 12 7.570 7.570 7.483 0.087 25585
1696 1 14 . 1 1 13 13 LEU N N 13 116.412 116.412 120.060 -3.648 25585
1697 1 14 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.739 -0.450 25585
1698 1 14 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.197 0.623 25585
1699 1 14 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.472 -0.488 25585
1700 1 14 . 1 1 13 13 LEU H H 13 6.902 6.902 7.709 -0.807 25585
1701 1 14 . 1 1 14 14 GLY N N 14 108.651 108.651 107.124 1.527 25585
1702 1 14 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.154 1.089 25585
1703 1 14 . 1 1 14 14 GLY H H 14 8.387 8.387 8.576 -0.189 25585
1704 1 14 . 1 1 15 15 ILE N N 15 109.703 109.703 113.966 -4.263 25585
1705 1 14 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.792 0.037 25585
1706 1 14 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.911 -0.234 25585
1707 1 14 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.392 2.981 25585
1708 1 14 . 1 1 15 15 ILE H H 15 6.727 6.727 7.305 -0.578 25585
1709 1 14 . 1 1 16 16 CYS N N 16 120.648 120.648 119.826 0.822 25585
1710 1 14 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.284 -0.092 25585
1711 1 14 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.495 -2.502 25585
1712 1 14 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.449 15.675 25585
1713 1 14 . 1 1 16 16 CYS H H 16 8.811 8.811 8.719 0.092 25585
1714 1 14 . 1 1 17 17 THR N N 17 116.440 116.440 115.552 0.888 25585
1715 1 14 . 1 1 17 17 THR HA H 17 4.859 4.859 4.832 0.027 25585
1716 1 14 . 1 1 17 17 THR CB C 17 69.862 69.862 71.064 -1.202 25585
1717 1 14 . 1 1 17 17 THR H H 17 9.357 9.357 9.230 0.127 25585
1718 1 14 . 1 1 18 18 ILE N N 18 124.956 124.956 123.244 1.712 25585
1719 1 14 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.048 0.344 25585
1720 1 14 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.739 0.470 25585
1721 1 14 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.197 0.738 25585
1722 1 14 . 1 1 18 18 ILE H H 18 8.493 8.493 8.337 0.156 25585
1723 1 14 . 1 1 19 19 THR N N 19 119.997 119.997 122.378 -2.381 25585
1724 1 14 . 1 1 19 19 THR HA H 19 4.331 4.331 4.408 -0.077 25585
1725 1 14 . 1 1 19 19 THR CA C 19 61.222 61.222 60.027 1.195 25585
1726 1 14 . 1 1 19 19 THR CB C 19 69.839 69.839 70.449 -0.610 25585
1727 1 14 . 1 1 19 19 THR H H 19 8.060 8.060 8.221 -0.161 25585
1728 1 14 . 1 1 20 20 LEU N N 20 125.150 125.150 126.309 -1.159 25585
1729 1 14 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.175 0.112 25585
1730 1 14 . 1 1 20 20 LEU CA C 20 56.119 56.119 56.959 -0.840 25585
1731 1 14 . 1 1 20 20 LEU CB C 20 42.079 42.079 41.269 0.810 25585
1732 1 14 . 1 1 20 20 LEU H H 20 8.354 8.354 8.763 -0.409 25585
1733 1 14 . 1 1 21 21 SER N N 21 115.796 115.796 113.614 2.182 25585
1734 1 14 . 1 1 21 21 SER HA H 21 4.350 4.350 3.867 0.483 25585
1735 1 14 . 1 1 21 21 SER CA C 21 58.899 58.899 61.119 -2.220 25585
1736 1 14 . 1 1 21 21 SER CB C 21 63.363 63.363 63.051 0.312 25585
1737 1 14 . 1 1 21 21 SER H H 21 8.274 8.274 7.934 0.340 25585
1738 1 14 . 1 1 22 22 ARG N N 22 122.561 122.561 119.857 2.704 25585
1739 1 14 . 1 1 22 22 ARG HA H 22 4.289 4.289 4.034 0.255 25585
1740 1 14 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.108 -3.162 25585
1741 1 14 . 1 1 22 22 ARG CB C 22 30.369 30.369 30.254 0.115 25585
1742 1 14 . 1 1 22 22 ARG H H 22 8.149 8.149 7.569 0.580 25585
1743 1 14 . 1 1 23 23 ILE N N 23 121.335 121.335 118.419 2.916 25585
1744 1 14 . 1 1 23 23 ILE HA H 23 4.001 4.001 3.793 0.208 25585
1745 1 14 . 1 1 23 23 ILE CA C 23 61.671 61.671 63.767 -2.096 25585
1746 1 14 . 1 1 23 23 ILE CB C 23 38.383 38.383 37.355 1.028 25585
1747 1 14 . 1 1 23 23 ILE H H 23 8.002 8.002 7.719 0.283 25585
1748 1 14 . 1 1 24 24 GLU N N 24 122.372 122.372 114.424 7.948 25585
1749 1 14 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.193 0.016 25585
1750 1 14 . 1 1 24 24 GLU CA C 24 56.115 56.115 54.583 1.532 25585
1751 1 14 . 1 1 24 24 GLU CB C 24 29.306 29.306 31.489 -2.183 25585
1752 1 14 . 1 1 24 24 GLU H H 24 8.317 8.317 8.212 0.105 25585
1753 1 14 . 1 1 25 25 HIS N N 25 118.365 118.365 115.555 2.810 25585
1754 1 14 . 1 1 25 25 HIS HA H 25 5.022 5.022 4.515 0.507 25585
1755 1 14 . 1 1 25 25 HIS CA C 25 52.772 52.772 56.110 -3.338 25585
1756 1 14 . 1 1 25 25 HIS CB C 25 28.551 28.551 28.014 0.537 25585
1757 1 14 . 1 1 25 25 HIS H H 25 8.323 8.323 8.279 0.044 25585
1758 1 14 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.413 0.055 25585
1759 1 14 . 1 1 26 26 PRO CA C 26 63.834 63.834 66.062 -2.228 25585
1760 1 14 . 1 1 26 26 PRO CB C 26 31.936 31.936 31.730 0.206 25585
1761 1 14 . 1 1 27 27 GLY N N 27 108.880 108.880 103.810 5.070 25585
1762 1 14 . 1 1 27 27 GLY CA C 27 45.212 45.212 46.851 -1.639 25585
1763 1 14 . 1 1 27 27 GLY H H 27 8.594 8.594 8.730 -0.136 25585
1764 1 14 . 1 1 28 28 ASN N N 28 118.144 118.144 117.965 0.179 25585
1765 1 14 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.656 0.009 25585
1766 1 14 . 1 1 28 28 ASN CA C 28 52.967 52.967 54.319 -1.352 25585
1767 1 14 . 1 1 28 28 ASN CB C 28 38.579 38.579 38.952 -0.373 25585
1768 1 14 . 1 1 28 28 ASN H H 28 8.154 8.154 8.105 0.049 25585
1769 1 14 . 1 1 29 29 TYR N N 29 119.962 119.962 119.397 0.565 25585
1770 1 14 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.523 -0.003 25585
1771 1 14 . 1 1 29 29 TYR CA C 29 57.544 57.544 60.203 -2.659 25585
1772 1 14 . 1 1 29 29 TYR CB C 29 39.011 39.011 37.861 1.150 25585
1773 1 14 . 1 1 29 29 TYR H H 29 8.058 8.058 7.723 0.335 25585
1774 1 14 . 1 1 30 30 ASP N N 30 120.874 120.874 118.373 2.501 25585
1775 1 14 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.502 0.177 25585
1776 1 14 . 1 1 30 30 ASP CA C 30 52.827 52.827 53.915 -1.088 25585
1777 1 14 . 1 1 30 30 ASP CB C 30 38.567 38.567 39.687 -1.120 25585
1778 1 14 . 1 1 30 30 ASP H H 30 8.226 8.226 8.013 0.213 25585
1779 1 15 . 1 1 3 3 CYS N N 3 120.614 120.614 123.983 -3.369 25585
1780 1 15 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.544 0.255 25585
1781 1 15 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.215 -5.423 25585
1782 1 15 . 1 1 3 3 CYS CB C 3 42.170 42.170 30.173 11.997 25585
1783 1 15 . 1 1 3 3 CYS H H 3 7.958 7.958 7.620 0.338 25585
1784 1 15 . 1 1 4 4 GLN N N 4 121.450 121.450 120.681 0.769 25585
1785 1 15 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.129 0.051 25585
1786 1 15 . 1 1 4 4 GLN CA C 4 54.557 54.557 53.048 1.509 25585
1787 1 15 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.400 -1.209 25585
1788 1 15 . 1 1 4 4 GLN H H 4 8.737 8.737 8.146 0.591 25585
1789 1 15 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.215 0.194 25585
1790 1 15 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.201 0.153 25585
1791 1 15 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.775 -0.065 25585
1792 1 15 . 1 1 6 6 GLY N N 6 111.865 111.865 110.849 1.016 25585
1793 1 15 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.991 -0.928 25585
1794 1 15 . 1 1 6 6 GLY H H 6 8.948 8.948 8.689 0.259 25585
1795 1 15 . 1 1 7 7 TYR N N 7 120.136 120.136 119.663 0.473 25585
1796 1 15 . 1 1 7 7 TYR HA H 7 5.057 5.057 5.114 -0.057 25585
1797 1 15 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.420 -0.027 25585
1798 1 15 . 1 1 7 7 TYR CB C 7 41.345 41.345 42.148 -0.803 25585
1799 1 15 . 1 1 7 7 TYR H H 7 8.300 8.300 7.621 0.679 25585
1800 1 15 . 1 1 8 8 ALA N N 8 121.599 121.599 121.303 0.296 25585
1801 1 15 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.653 0.033 25585
1802 1 15 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.941 0.001 25585
1803 1 15 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.021 0.136 25585
1804 1 15 . 1 1 8 8 ALA H H 8 9.286 9.286 8.889 0.397 25585
1805 1 15 . 1 1 9 9 TYR N N 9 124.797 124.797 122.660 2.137 25585
1806 1 15 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.306 0.032 25585
1807 1 15 . 1 1 9 9 TYR CA C 9 59.315 59.315 57.794 1.521 25585
1808 1 15 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.539 0.259 25585
1809 1 15 . 1 1 9 9 TYR H H 9 9.112 9.112 8.625 0.487 25585
1810 1 15 . 1 1 10 10 ASN N N 10 128.087 128.087 125.567 2.520 25585
1811 1 15 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.940 0.139 25585
1812 1 15 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.522 -0.350 25585
1813 1 15 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.029 -1.205 25585
1814 1 15 . 1 1 10 10 ASN H H 10 8.210 8.210 8.471 -0.261 25585
1815 1 15 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.081 -0.016 25585
1816 1 15 . 1 1 11 11 PRO CA C 11 63.988 63.988 63.972 0.016 25585
1817 1 15 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.492 0.551 25585
1818 1 15 . 1 1 12 12 VAL N N 12 119.341 119.341 115.534 3.807 25585
1819 1 15 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.084 -0.326 25585
1820 1 15 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.336 1.767 25585
1821 1 15 . 1 1 12 12 VAL CB C 12 31.723 31.723 31.651 0.072 25585
1822 1 15 . 1 1 12 12 VAL H H 12 7.570 7.570 7.461 0.109 25585
1823 1 15 . 1 1 13 13 LEU N N 13 116.412 116.412 120.254 -3.842 25585
1824 1 15 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.676 -0.387 25585
1825 1 15 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.319 0.501 25585
1826 1 15 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.680 -0.696 25585
1827 1 15 . 1 1 13 13 LEU H H 13 6.902 6.902 7.706 -0.804 25585
1828 1 15 . 1 1 14 14 GLY N N 14 108.651 108.651 107.360 1.291 25585
1829 1 15 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.119 1.124 25585
1830 1 15 . 1 1 14 14 GLY H H 14 8.387 8.387 8.582 -0.195 25585
1831 1 15 . 1 1 15 15 ILE N N 15 109.703 109.703 114.233 -4.530 25585
1832 1 15 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.811 0.018 25585
1833 1 15 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.877 -0.201 25585
1834 1 15 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.433 2.940 25585
1835 1 15 . 1 1 15 15 ILE H H 15 6.727 6.727 7.303 -0.576 25585
1836 1 15 . 1 1 16 16 CYS N N 16 120.648 120.648 119.801 0.847 25585
1837 1 15 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.299 -0.107 25585
1838 1 15 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.438 -2.445 25585
1839 1 15 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.530 15.594 25585
1840 1 15 . 1 1 16 16 CYS H H 16 8.811 8.811 8.698 0.113 25585
1841 1 15 . 1 1 17 17 THR N N 17 116.440 116.440 115.559 0.881 25585
1842 1 15 . 1 1 17 17 THR HA H 17 4.859 4.859 4.841 0.018 25585
1843 1 15 . 1 1 17 17 THR CB C 17 69.862 69.862 71.116 -1.254 25585
1844 1 15 . 1 1 17 17 THR H H 17 9.357 9.357 9.197 0.161 25585
1845 1 15 . 1 1 18 18 ILE N N 18 124.956 124.956 123.717 1.239 25585
1846 1 15 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.099 0.293 25585
1847 1 15 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.682 0.526 25585
1848 1 15 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.517 0.418 25585
1849 1 15 . 1 1 18 18 ILE H H 18 8.493 8.493 8.416 0.077 25585
1850 1 15 . 1 1 19 19 THR N N 19 119.997 119.997 123.126 -3.129 25585
1851 1 15 . 1 1 19 19 THR HA H 19 4.331 4.331 4.472 -0.141 25585
1852 1 15 . 1 1 19 19 THR CA C 19 61.222 61.222 59.977 1.245 25585
1853 1 15 . 1 1 19 19 THR CB C 19 69.839 69.839 70.303 -0.464 25585
1854 1 15 . 1 1 19 19 THR H H 19 8.060 8.060 8.259 -0.199 25585
1855 1 15 . 1 1 20 20 LEU N N 20 125.150 125.150 124.233 0.917 25585
1856 1 15 . 1 1 20 20 LEU HA H 20 4.287 4.287 3.998 0.289 25585
1857 1 15 . 1 1 20 20 LEU CA C 20 56.119 56.119 57.258 -1.139 25585
1858 1 15 . 1 1 20 20 LEU CB C 20 42.079 42.079 41.811 0.268 25585
1859 1 15 . 1 1 20 20 LEU H H 20 8.354 8.354 8.635 -0.281 25585
1860 1 15 . 1 1 21 21 SER N N 21 115.796 115.796 115.342 0.454 25585
1861 1 15 . 1 1 21 21 SER HA H 21 4.350 4.350 4.354 -0.004 25585
1862 1 15 . 1 1 21 21 SER CA C 21 58.899 58.899 61.132 -2.233 25585
1863 1 15 . 1 1 21 21 SER CB C 21 63.363 63.363 62.832 0.531 25585
1864 1 15 . 1 1 21 21 SER H H 21 8.274 8.274 8.089 0.185 25585
1865 1 15 . 1 1 22 22 ARG N N 22 122.561 122.561 121.160 1.401 25585
1866 1 15 . 1 1 22 22 ARG HA H 22 4.289 4.289 4.194 0.095 25585
1867 1 15 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.299 -3.353 25585
1868 1 15 . 1 1 22 22 ARG CB C 22 30.369 30.369 30.329 0.040 25585
1869 1 15 . 1 1 22 22 ARG H H 22 8.149 8.149 7.463 0.686 25585
1870 1 15 . 1 1 23 23 ILE N N 23 121.335 121.335 117.920 3.415 25585
1871 1 15 . 1 1 23 23 ILE HA H 23 4.001 4.001 4.208 -0.207 25585
1872 1 15 . 1 1 23 23 ILE CA C 23 61.671 61.671 60.860 0.811 25585
1873 1 15 . 1 1 23 23 ILE CB C 23 38.383 38.383 38.285 0.098 25585
1874 1 15 . 1 1 23 23 ILE H H 23 8.002 8.002 7.511 0.490 25585
1875 1 15 . 1 1 24 24 GLU N N 24 122.372 122.372 121.720 0.652 25585
1876 1 15 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.255 -0.046 25585
1877 1 15 . 1 1 24 24 GLU CA C 24 56.115 56.115 55.842 0.273 25585
1878 1 15 . 1 1 24 24 GLU CB C 24 29.306 29.306 30.068 -0.762 25585
1879 1 15 . 1 1 24 24 GLU H H 24 8.317 8.317 7.419 0.898 25585
1880 1 15 . 1 1 25 25 HIS N N 25 118.365 118.365 115.426 2.939 25585
1881 1 15 . 1 1 25 25 HIS HA H 25 5.022 5.022 4.829 0.193 25585
1882 1 15 . 1 1 25 25 HIS CA C 25 52.772 52.772 52.872 -0.100 25585
1883 1 15 . 1 1 25 25 HIS CB C 25 28.551 28.551 27.816 0.735 25585
1884 1 15 . 1 1 25 25 HIS H H 25 8.323 8.323 7.561 0.762 25585
1885 1 15 . 1 1 26 26 PRO HA H 26 4.468 4.468 3.791 0.677 25585
1886 1 15 . 1 1 26 26 PRO CA C 26 63.834 63.834 64.049 -0.215 25585
1887 1 15 . 1 1 26 26 PRO CB C 26 31.936 31.936 31.812 0.124 25585
1888 1 15 . 1 1 27 27 GLY N N 27 108.880 108.880 106.956 1.924 25585
1889 1 15 . 1 1 27 27 GLY CA C 27 45.212 45.212 45.953 -0.741 25585
1890 1 15 . 1 1 27 27 GLY H H 27 8.594 8.594 8.220 0.374 25585
1891 1 15 . 1 1 28 28 ASN N N 28 118.144 118.144 119.320 -1.176 25585
1892 1 15 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.527 0.138 25585
1893 1 15 . 1 1 28 28 ASN CA C 28 52.967 52.967 54.862 -1.895 25585
1894 1 15 . 1 1 28 28 ASN CB C 28 38.579 38.579 38.863 -0.284 25585
1895 1 15 . 1 1 28 28 ASN H H 28 8.154 8.154 7.602 0.552 25585
1896 1 15 . 1 1 29 29 TYR N N 29 119.962 119.962 116.572 3.390 25585
1897 1 15 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.795 -0.275 25585
1898 1 15 . 1 1 29 29 TYR CA C 29 57.544 57.544 57.087 0.456 25585
1899 1 15 . 1 1 29 29 TYR CB C 29 39.011 39.011 38.930 0.081 25585
1900 1 15 . 1 1 29 29 TYR H H 29 8.058 8.058 6.781 1.277 25585
1901 1 15 . 1 1 30 30 ASP N N 30 120.874 120.874 120.483 0.391 25585
1902 1 15 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.796 -0.117 25585
1903 1 15 . 1 1 30 30 ASP CA C 30 52.827 52.827 52.886 -0.059 25585
1904 1 15 . 1 1 30 30 ASP CB C 30 38.567 38.567 40.812 -2.245 25585
1905 1 15 . 1 1 30 30 ASP H H 30 8.226 8.226 8.664 -0.438 25585
1906 1 16 . 1 1 3 3 CYS N N 3 120.614 120.614 123.499 -2.885 25585
1907 1 16 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.537 0.262 25585
1908 1 16 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.825 -6.033 25585
1909 1 16 . 1 1 3 3 CYS CB C 3 42.170 42.170 29.772 12.398 25585
1910 1 16 . 1 1 3 3 CYS H H 3 7.958 7.958 7.573 0.385 25585
1911 1 16 . 1 1 4 4 GLN N N 4 121.450 121.450 120.776 0.674 25585
1912 1 16 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.157 0.023 25585
1913 1 16 . 1 1 4 4 GLN CA C 4 54.557 54.557 53.004 1.553 25585
1914 1 16 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.459 -1.268 25585
1915 1 16 . 1 1 4 4 GLN H H 4 8.737 8.737 8.177 0.560 25585
1916 1 16 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.298 0.111 25585
1917 1 16 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.398 -0.044 25585
1918 1 16 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.551 0.159 25585
1919 1 16 . 1 1 6 6 GLY N N 6 111.865 111.865 110.720 1.145 25585
1920 1 16 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.501 -0.438 25585
1921 1 16 . 1 1 6 6 GLY H H 6 8.948 8.948 8.810 0.138 25585
1922 1 16 . 1 1 7 7 TYR N N 7 120.136 120.136 119.678 0.458 25585
1923 1 16 . 1 1 7 7 TYR HA H 7 5.057 5.057 5.108 -0.051 25585
1924 1 16 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.502 -0.109 25585
1925 1 16 . 1 1 7 7 TYR CB C 7 41.345 41.345 42.163 -0.818 25585
1926 1 16 . 1 1 7 7 TYR H H 7 8.300 8.300 7.652 0.648 25585
1927 1 16 . 1 1 8 8 ALA N N 8 121.599 121.599 122.906 -1.307 25585
1928 1 16 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.694 -0.008 25585
1929 1 16 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.634 0.308 25585
1930 1 16 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.137 0.020 25585
1931 1 16 . 1 1 8 8 ALA H H 8 9.286 9.286 8.964 0.322 25585
1932 1 16 . 1 1 9 9 TYR N N 9 124.797 124.797 124.665 0.132 25585
1933 1 16 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.229 0.109 25585
1934 1 16 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.323 0.992 25585
1935 1 16 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.137 0.661 25585
1936 1 16 . 1 1 9 9 TYR H H 9 9.112 9.112 8.724 0.388 25585
1937 1 16 . 1 1 10 10 ASN N N 10 128.087 128.087 125.866 2.221 25585
1938 1 16 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.886 0.193 25585
1939 1 16 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.489 -0.317 25585
1940 1 16 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.377 -1.553 25585
1941 1 16 . 1 1 10 10 ASN H H 10 8.210 8.210 8.646 -0.436 25585
1942 1 16 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.389 -0.324 25585
1943 1 16 . 1 1 11 11 PRO CA C 11 63.988 63.988 64.222 -0.235 25585
1944 1 16 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.645 0.397 25585
1945 1 16 . 1 1 12 12 VAL N N 12 119.341 119.341 116.134 3.207 25585
1946 1 16 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.090 -0.332 25585
1947 1 16 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.418 1.685 25585
1948 1 16 . 1 1 12 12 VAL CB C 12 31.723 31.723 31.799 -0.076 25585
1949 1 16 . 1 1 12 12 VAL H H 12 7.570 7.570 7.533 0.037 25585
1950 1 16 . 1 1 13 13 LEU N N 13 116.412 116.412 120.068 -3.656 25585
1951 1 16 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.746 -0.457 25585
1952 1 16 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.222 0.598 25585
1953 1 16 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.468 -0.484 25585
1954 1 16 . 1 1 13 13 LEU H H 13 6.902 6.902 7.525 -0.623 25585
1955 1 16 . 1 1 14 14 GLY N N 14 108.651 108.651 106.571 2.080 25585
1956 1 16 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.203 1.040 25585
1957 1 16 . 1 1 14 14 GLY H H 14 8.387 8.387 8.436 -0.049 25585
1958 1 16 . 1 1 15 15 ILE N N 15 109.703 109.703 113.039 -3.336 25585
1959 1 16 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.750 0.079 25585
1960 1 16 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.818 -0.141 25585
1961 1 16 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.135 3.238 25585
1962 1 16 . 1 1 15 15 ILE H H 15 6.727 6.727 7.377 -0.650 25585
1963 1 16 . 1 1 16 16 CYS N N 16 120.648 120.648 120.132 0.516 25585
1964 1 16 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.360 -0.168 25585
1965 1 16 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.481 -2.488 25585
1966 1 16 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.227 15.897 25585
1967 1 16 . 1 1 16 16 CYS H H 16 8.811 8.811 8.650 0.161 25585
1968 1 16 . 1 1 17 17 THR N N 17 116.440 116.440 115.088 1.352 25585
1969 1 16 . 1 1 17 17 THR HA H 17 4.859 4.859 4.890 -0.031 25585
1970 1 16 . 1 1 17 17 THR CB C 17 69.862 69.862 71.785 -1.923 25585
1971 1 16 . 1 1 17 17 THR H H 17 9.357 9.357 8.926 0.431 25585
1972 1 16 . 1 1 18 18 ILE N N 18 124.956 124.956 123.970 0.986 25585
1973 1 16 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.145 0.247 25585
1974 1 16 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.603 0.605 25585
1975 1 16 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.352 0.583 25585
1976 1 16 . 1 1 18 18 ILE H H 18 8.493 8.493 8.455 0.038 25585
1977 1 16 . 1 1 19 19 THR N N 19 119.997 119.997 123.234 -3.237 25585
1978 1 16 . 1 1 19 19 THR HA H 19 4.331 4.331 4.396 -0.065 25585
1979 1 16 . 1 1 19 19 THR CA C 19 61.222 61.222 60.552 0.670 25585
1980 1 16 . 1 1 19 19 THR CB C 19 69.839 69.839 70.354 -0.515 25585
1981 1 16 . 1 1 19 19 THR H H 19 8.060 8.060 8.471 -0.411 25585
1982 1 16 . 1 1 20 20 LEU N N 20 125.150 125.150 124.742 0.408 25585
1983 1 16 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.168 0.119 25585
1984 1 16 . 1 1 20 20 LEU CA C 20 56.119 56.119 56.718 -0.599 25585
1985 1 16 . 1 1 20 20 LEU CB C 20 42.079 42.079 40.873 1.206 25585
1986 1 16 . 1 1 20 20 LEU H H 20 8.354 8.354 8.662 -0.308 25585
1987 1 16 . 1 1 21 21 SER N N 21 115.796 115.796 114.110 1.686 25585
1988 1 16 . 1 1 21 21 SER HA H 21 4.350 4.350 3.660 0.690 25585
1989 1 16 . 1 1 21 21 SER CA C 21 58.899 58.899 60.456 -1.557 25585
1990 1 16 . 1 1 21 21 SER CB C 21 63.363 63.363 62.799 0.564 25585
1991 1 16 . 1 1 21 21 SER H H 21 8.274 8.274 8.039 0.235 25585
1992 1 16 . 1 1 22 22 ARG N N 22 122.561 122.561 121.366 1.195 25585
1993 1 16 . 1 1 22 22 ARG HA H 22 4.289 4.289 4.167 0.122 25585
1994 1 16 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.194 -3.248 25585
1995 1 16 . 1 1 22 22 ARG CB C 22 30.369 30.369 30.187 0.182 25585
1996 1 16 . 1 1 22 22 ARG H H 22 8.149 8.149 7.496 0.653 25585
1997 1 16 . 1 1 23 23 ILE N N 23 121.335 121.335 118.971 2.364 25585
1998 1 16 . 1 1 23 23 ILE HA H 23 4.001 4.001 3.993 0.008 25585
1999 1 16 . 1 1 23 23 ILE CA C 23 61.671 61.671 63.871 -2.200 25585
2000 1 16 . 1 1 23 23 ILE CB C 23 38.383 38.383 38.565 -0.182 25585
2001 1 16 . 1 1 23 23 ILE H H 23 8.002 8.002 7.660 0.342 25585
2002 1 16 . 1 1 24 24 GLU N N 24 122.372 122.372 118.977 3.395 25585
2003 1 16 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.627 -0.418 25585
2004 1 16 . 1 1 24 24 GLU CA C 24 56.115 56.115 55.602 0.513 25585
2005 1 16 . 1 1 24 24 GLU CB C 24 29.306 29.306 30.240 -0.934 25585
2006 1 16 . 1 1 24 24 GLU H H 24 8.317 8.317 8.454 -0.137 25585
2007 1 16 . 1 1 25 25 HIS N N 25 118.365 118.365 122.078 -3.713 25585
2008 1 16 . 1 1 25 25 HIS HA H 25 5.022 5.022 4.714 0.308 25585
2009 1 16 . 1 1 25 25 HIS CA C 25 52.772 52.772 53.645 -0.873 25585
2010 1 16 . 1 1 25 25 HIS CB C 25 28.551 28.551 31.497 -2.946 25585
2011 1 16 . 1 1 25 25 HIS H H 25 8.323 8.323 8.124 0.199 25585
2012 1 16 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.290 0.178 25585
2013 1 16 . 1 1 26 26 PRO CA C 26 63.834 63.834 64.429 -0.595 25585
2014 1 16 . 1 1 26 26 PRO CB C 26 31.936 31.936 31.943 -0.007 25585
2015 1 16 . 1 1 27 27 GLY N N 27 108.880 108.880 104.572 4.308 25585
2016 1 16 . 1 1 27 27 GLY CA C 27 45.212 45.212 45.431 -0.219 25585
2017 1 16 . 1 1 27 27 GLY H H 27 8.594 8.594 8.392 0.202 25585
2018 1 16 . 1 1 28 28 ASN N N 28 118.144 118.144 118.857 -0.713 25585
2019 1 16 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.702 -0.037 25585
2020 1 16 . 1 1 28 28 ASN CA C 28 52.967 52.967 54.442 -1.475 25585
2021 1 16 . 1 1 28 28 ASN CB C 28 38.579 38.579 39.647 -1.068 25585
2022 1 16 . 1 1 28 28 ASN H H 28 8.154 8.154 7.607 0.547 25585
2023 1 16 . 1 1 29 29 TYR N N 29 119.962 119.962 113.486 6.476 25585
2024 1 16 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.677 -0.157 25585
2025 1 16 . 1 1 29 29 TYR CA C 29 57.544 57.544 58.232 -0.688 25585
2026 1 16 . 1 1 29 29 TYR CB C 29 39.011 39.011 40.049 -1.038 25585
2027 1 16 . 1 1 29 29 TYR H H 29 8.058 8.058 7.335 0.723 25585
2028 1 16 . 1 1 30 30 ASP N N 30 120.874 120.874 121.727 -0.853 25585
2029 1 16 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.080 0.599 25585
2030 1 16 . 1 1 30 30 ASP CA C 30 52.827 52.827 54.879 -2.052 25585
2031 1 16 . 1 1 30 30 ASP CB C 30 38.567 38.567 39.476 -0.909 25585
2032 1 16 . 1 1 30 30 ASP H H 30 8.226 8.226 6.965 1.261 25585
2033 1 17 . 1 1 3 3 CYS N N 3 120.614 120.614 123.987 -3.373 25585
2034 1 17 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.556 0.243 25585
2035 1 17 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.218 -5.426 25585
2036 1 17 . 1 1 3 3 CYS CB C 3 42.170 42.170 30.095 12.075 25585
2037 1 17 . 1 1 3 3 CYS H H 3 7.958 7.958 7.609 0.349 25585
2038 1 17 . 1 1 4 4 GLN N N 4 121.450 121.450 120.822 0.628 25585
2039 1 17 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.127 0.053 25585
2040 1 17 . 1 1 4 4 GLN CA C 4 54.557 54.557 53.049 1.508 25585
2041 1 17 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.389 -1.198 25585
2042 1 17 . 1 1 4 4 GLN H H 4 8.737 8.737 8.164 0.573 25585
2043 1 17 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.148 0.261 25585
2044 1 17 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.367 -0.013 25585
2045 1 17 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.648 0.062 25585
2046 1 17 . 1 1 6 6 GLY N N 6 111.865 111.865 109.682 2.183 25585
2047 1 17 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.502 -0.439 25585
2048 1 17 . 1 1 6 6 GLY H H 6 8.948 8.948 8.633 0.315 25585
2049 1 17 . 1 1 7 7 TYR N N 7 120.136 120.136 119.675 0.461 25585
2050 1 17 . 1 1 7 7 TYR HA H 7 5.057 5.057 5.104 -0.047 25585
2051 1 17 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.519 -0.126 25585
2052 1 17 . 1 1 7 7 TYR CB C 7 41.345 41.345 42.167 -0.822 25585
2053 1 17 . 1 1 7 7 TYR H H 7 8.300 8.300 7.616 0.684 25585
2054 1 17 . 1 1 8 8 ALA N N 8 121.599 121.599 122.586 -0.987 25585
2055 1 17 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.702 -0.016 25585
2056 1 17 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.750 0.192 25585
2057 1 17 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.213 -0.056 25585
2058 1 17 . 1 1 8 8 ALA H H 8 9.286 9.286 8.980 0.306 25585
2059 1 17 . 1 1 9 9 TYR N N 9 124.797 124.797 124.297 0.500 25585
2060 1 17 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.258 0.080 25585
2061 1 17 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.430 0.885 25585
2062 1 17 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.245 0.553 25585
2063 1 17 . 1 1 9 9 TYR H H 9 9.112 9.112 8.728 0.384 25585
2064 1 17 . 1 1 10 10 ASN N N 10 128.087 128.087 125.755 2.332 25585
2065 1 17 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.938 0.141 25585
2066 1 17 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.529 -0.357 25585
2067 1 17 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.117 -1.293 25585
2068 1 17 . 1 1 10 10 ASN H H 10 8.210 8.210 8.534 -0.324 25585
2069 1 17 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.109 -0.044 25585
2070 1 17 . 1 1 11 11 PRO CA C 11 63.988 63.988 63.982 0.006 25585
2071 1 17 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.506 0.537 25585
2072 1 17 . 1 1 12 12 VAL N N 12 119.341 119.341 115.519 3.822 25585
2073 1 17 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.085 -0.327 25585
2074 1 17 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.336 1.767 25585
2075 1 17 . 1 1 12 12 VAL CB C 12 31.723 31.723 31.690 0.033 25585
2076 1 17 . 1 1 12 12 VAL H H 12 7.570 7.570 7.471 0.099 25585
2077 1 17 . 1 1 13 13 LEU N N 13 116.412 116.412 120.360 -3.948 25585
2078 1 17 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.672 -0.383 25585
2079 1 17 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.379 0.441 25585
2080 1 17 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.648 -0.664 25585
2081 1 17 . 1 1 13 13 LEU H H 13 6.902 6.902 7.686 -0.784 25585
2082 1 17 . 1 1 14 14 GLY N N 14 108.651 108.651 106.643 2.008 25585
2083 1 17 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.202 1.041 25585
2084 1 17 . 1 1 14 14 GLY H H 14 8.387 8.387 8.464 -0.077 25585
2085 1 17 . 1 1 15 15 ILE N N 15 109.703 109.703 113.232 -3.529 25585
2086 1 17 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.783 0.046 25585
2087 1 17 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.755 -0.078 25585
2088 1 17 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.266 3.107 25585
2089 1 17 . 1 1 15 15 ILE H H 15 6.727 6.727 7.310 -0.583 25585
2090 1 17 . 1 1 16 16 CYS N N 16 120.648 120.648 119.472 1.176 25585
2091 1 17 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.305 -0.113 25585
2092 1 17 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.636 -2.643 25585
2093 1 17 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.498 15.626 25585
2094 1 17 . 1 1 16 16 CYS H H 16 8.811 8.811 8.762 0.049 25585
2095 1 17 . 1 1 17 17 THR N N 17 116.440 116.440 115.223 1.217 25585
2096 1 17 . 1 1 17 17 THR HA H 17 4.859 4.859 4.890 -0.031 25585
2097 1 17 . 1 1 17 17 THR CB C 17 69.862 69.862 70.763 -0.901 25585
2098 1 17 . 1 1 17 17 THR H H 17 9.357 9.357 9.115 0.242 25585
2099 1 17 . 1 1 18 18 ILE N N 18 124.956 124.956 123.161 1.795 25585
2100 1 17 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.074 0.318 25585
2101 1 17 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.697 0.511 25585
2102 1 17 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.391 0.544 25585
2103 1 17 . 1 1 18 18 ILE H H 18 8.493 8.493 8.272 0.221 25585
2104 1 17 . 1 1 19 19 THR N N 19 119.997 119.997 121.729 -1.732 25585
2105 1 17 . 1 1 19 19 THR HA H 19 4.331 4.331 4.501 -0.170 25585
2106 1 17 . 1 1 19 19 THR CA C 19 61.222 61.222 60.487 0.735 25585
2107 1 17 . 1 1 19 19 THR CB C 19 69.839 69.839 70.764 -0.925 25585
2108 1 17 . 1 1 19 19 THR H H 19 8.060 8.060 8.217 -0.157 25585
2109 1 17 . 1 1 20 20 LEU N N 20 125.150 125.150 124.759 0.391 25585
2110 1 17 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.097 0.190 25585
2111 1 17 . 1 1 20 20 LEU CA C 20 56.119 56.119 57.277 -1.158 25585
2112 1 17 . 1 1 20 20 LEU CB C 20 42.079 42.079 41.442 0.637 25585
2113 1 17 . 1 1 20 20 LEU H H 20 8.354 8.354 9.066 -0.712 25585
2114 1 17 . 1 1 21 21 SER N N 21 115.796 115.796 115.033 0.763 25585
2115 1 17 . 1 1 21 21 SER HA H 21 4.350 4.350 4.320 0.030 25585
2116 1 17 . 1 1 21 21 SER CA C 21 58.899 58.899 61.241 -2.342 25585
2117 1 17 . 1 1 21 21 SER CB C 21 63.363 63.363 63.107 0.256 25585
2118 1 17 . 1 1 21 21 SER H H 21 8.274 8.274 8.405 -0.131 25585
2119 1 17 . 1 1 22 22 ARG N N 22 122.561 122.561 120.940 1.621 25585
2120 1 17 . 1 1 22 22 ARG HA H 22 4.289 4.289 4.063 0.226 25585
2121 1 17 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.393 -3.447 25585
2122 1 17 . 1 1 22 22 ARG CB C 22 30.369 30.369 30.068 0.301 25585
2123 1 17 . 1 1 22 22 ARG H H 22 8.149 8.149 7.588 0.561 25585
2124 1 17 . 1 1 23 23 ILE N N 23 121.335 121.335 118.232 3.103 25585
2125 1 17 . 1 1 23 23 ILE HA H 23 4.001 4.001 4.092 -0.091 25585
2126 1 17 . 1 1 23 23 ILE CA C 23 61.671 61.671 62.534 -0.863 25585
2127 1 17 . 1 1 23 23 ILE CB C 23 38.383 38.383 39.264 -0.881 25585
2128 1 17 . 1 1 23 23 ILE H H 23 8.002 8.002 7.659 0.343 25585
2129 1 17 . 1 1 24 24 GLU N N 24 122.372 122.372 117.260 5.112 25585
2130 1 17 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.466 -0.257 25585
2131 1 17 . 1 1 24 24 GLU CA C 24 56.115 56.115 56.228 -0.113 25585
2132 1 17 . 1 1 24 24 GLU CB C 24 29.306 29.306 29.632 -0.326 25585
2133 1 17 . 1 1 24 24 GLU H H 24 8.317 8.317 8.620 -0.303 25585
2134 1 17 . 1 1 25 25 HIS N N 25 118.365 118.365 119.536 -1.171 25585
2135 1 17 . 1 1 25 25 HIS HA H 25 5.022 5.022 4.896 0.126 25585
2136 1 17 . 1 1 25 25 HIS CA C 25 52.772 52.772 53.839 -1.067 25585
2137 1 17 . 1 1 25 25 HIS CB C 25 28.551 28.551 29.803 -1.252 25585
2138 1 17 . 1 1 25 25 HIS H H 25 8.323 8.323 8.353 -0.030 25585
2139 1 17 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.496 -0.028 25585
2140 1 17 . 1 1 26 26 PRO CA C 26 63.834 63.834 64.478 -0.644 25585
2141 1 17 . 1 1 26 26 PRO CB C 26 31.936 31.936 32.139 -0.203 25585
2142 1 17 . 1 1 27 27 GLY N N 27 108.880 108.880 105.343 3.537 25585
2143 1 17 . 1 1 27 27 GLY CA C 27 45.212 45.212 46.608 -1.396 25585
2144 1 17 . 1 1 27 27 GLY H H 27 8.594 8.594 8.722 -0.128 25585
2145 1 17 . 1 1 28 28 ASN N N 28 118.144 118.144 119.002 -0.858 25585
2146 1 17 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.476 0.189 25585
2147 1 17 . 1 1 28 28 ASN CA C 28 52.967 52.967 54.969 -2.002 25585
2148 1 17 . 1 1 28 28 ASN CB C 28 38.579 38.579 38.630 -0.051 25585
2149 1 17 . 1 1 28 28 ASN H H 28 8.154 8.154 7.957 0.197 25585
2150 1 17 . 1 1 29 29 TYR N N 29 119.962 119.962 116.680 3.282 25585
2151 1 17 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.666 -0.146 25585
2152 1 17 . 1 1 29 29 TYR CA C 29 57.544 57.544 57.596 -0.052 25585
2153 1 17 . 1 1 29 29 TYR CB C 29 39.011 39.011 39.013 -0.002 25585
2154 1 17 . 1 1 29 29 TYR H H 29 8.058 8.058 7.723 0.335 25585
2155 1 17 . 1 1 30 30 ASP N N 30 120.874 120.874 117.146 3.728 25585
2156 1 17 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.325 0.354 25585
2157 1 17 . 1 1 30 30 ASP CA C 30 52.827 52.827 55.812 -2.985 25585
2158 1 17 . 1 1 30 30 ASP CB C 30 38.567 38.567 38.949 -0.382 25585
2159 1 17 . 1 1 30 30 ASP H H 30 8.226 8.226 8.173 0.053 25585
2160 1 18 . 1 1 3 3 CYS N N 3 120.614 120.614 123.381 -2.767 25585
2161 1 18 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.530 0.269 25585
2162 1 18 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.810 -6.018 25585
2163 1 18 . 1 1 3 3 CYS CB C 3 42.170 42.170 29.884 12.286 25585
2164 1 18 . 1 1 3 3 CYS H H 3 7.958 7.958 7.582 0.376 25585
2165 1 18 . 1 1 4 4 GLN N N 4 121.450 121.450 120.640 0.810 25585
2166 1 18 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.205 -0.025 25585
2167 1 18 . 1 1 4 4 GLN CA C 4 54.557 54.557 52.913 1.644 25585
2168 1 18 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.471 -1.280 25585
2169 1 18 . 1 1 4 4 GLN H H 4 8.737 8.737 8.168 0.569 25585
2170 1 18 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.221 0.188 25585
2171 1 18 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.078 0.276 25585
2172 1 18 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.748 -0.039 25585
2173 1 18 . 1 1 6 6 GLY N N 6 111.865 111.865 110.232 1.633 25585
2174 1 18 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.764 -0.701 25585
2175 1 18 . 1 1 6 6 GLY H H 6 8.948 8.948 8.715 0.233 25585
2176 1 18 . 1 1 7 7 TYR N N 7 120.136 120.136 119.530 0.606 25585
2177 1 18 . 1 1 7 7 TYR HA H 7 5.057 5.057 5.037 0.020 25585
2178 1 18 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.519 -0.126 25585
2179 1 18 . 1 1 7 7 TYR CB C 7 41.345 41.345 42.180 -0.835 25585
2180 1 18 . 1 1 7 7 TYR H H 7 8.300 8.300 7.626 0.674 25585
2181 1 18 . 1 1 8 8 ALA N N 8 121.599 121.599 122.853 -1.254 25585
2182 1 18 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.712 -0.026 25585
2183 1 18 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.630 0.312 25585
2184 1 18 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.120 0.037 25585
2185 1 18 . 1 1 8 8 ALA H H 8 9.286 9.286 8.991 0.295 25585
2186 1 18 . 1 1 9 9 TYR N N 9 124.797 124.797 124.801 -0.004 25585
2187 1 18 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.246 0.092 25585
2188 1 18 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.223 1.092 25585
2189 1 18 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.152 0.646 25585
2190 1 18 . 1 1 9 9 TYR H H 9 9.112 9.112 8.744 0.368 25585
2191 1 18 . 1 1 10 10 ASN N N 10 128.087 128.087 125.913 2.174 25585
2192 1 18 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.897 0.182 25585
2193 1 18 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.519 -0.347 25585
2194 1 18 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.394 -1.570 25585
2195 1 18 . 1 1 10 10 ASN H H 10 8.210 8.210 8.704 -0.494 25585
2196 1 18 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.396 -0.331 25585
2197 1 18 . 1 1 11 11 PRO CA C 11 63.988 63.988 64.224 -0.236 25585
2198 1 18 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.636 0.407 25585
2199 1 18 . 1 1 12 12 VAL N N 12 119.341 119.341 116.136 3.205 25585
2200 1 18 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.100 -0.342 25585
2201 1 18 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.376 1.727 25585
2202 1 18 . 1 1 12 12 VAL CB C 12 31.723 31.723 31.777 -0.054 25585
2203 1 18 . 1 1 12 12 VAL H H 12 7.570 7.570 7.535 0.035 25585
2204 1 18 . 1 1 13 13 LEU N N 13 116.412 116.412 120.061 -3.649 25585
2205 1 18 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.752 -0.463 25585
2206 1 18 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.229 0.591 25585
2207 1 18 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.489 -0.505 25585
2208 1 18 . 1 1 13 13 LEU H H 13 6.902 6.902 7.529 -0.627 25585
2209 1 18 . 1 1 14 14 GLY N N 14 108.651 108.651 106.572 2.079 25585
2210 1 18 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.207 1.036 25585
2211 1 18 . 1 1 14 14 GLY H H 14 8.387 8.387 8.451 -0.064 25585
2212 1 18 . 1 1 15 15 ILE N N 15 109.703 109.703 113.011 -3.308 25585
2213 1 18 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.749 0.080 25585
2214 1 18 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.871 -0.195 25585
2215 1 18 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.119 3.254 25585
2216 1 18 . 1 1 15 15 ILE H H 15 6.727 6.727 7.399 -0.672 25585
2217 1 18 . 1 1 16 16 CYS N N 16 120.648 120.648 119.711 0.937 25585
2218 1 18 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.316 -0.124 25585
2219 1 18 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.640 -2.647 25585
2220 1 18 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.250 15.874 25585
2221 1 18 . 1 1 16 16 CYS H H 16 8.811 8.811 8.717 0.094 25585
2222 1 18 . 1 1 17 17 THR N N 17 116.440 116.440 114.841 1.599 25585
2223 1 18 . 1 1 17 17 THR HA H 17 4.859 4.859 4.938 -0.079 25585
2224 1 18 . 1 1 17 17 THR CB C 17 69.862 69.862 71.975 -2.113 25585
2225 1 18 . 1 1 17 17 THR H H 17 9.357 9.357 8.913 0.444 25585
2226 1 18 . 1 1 18 18 ILE N N 18 124.956 124.956 123.437 1.519 25585
2227 1 18 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.137 0.255 25585
2228 1 18 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.894 0.314 25585
2229 1 18 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.470 0.465 25585
2230 1 18 . 1 1 18 18 ILE H H 18 8.493 8.493 8.394 0.099 25585
2231 1 18 . 1 1 19 19 THR N N 19 119.997 119.997 122.522 -2.525 25585
2232 1 18 . 1 1 19 19 THR HA H 19 4.331 4.331 4.475 -0.144 25585
2233 1 18 . 1 1 19 19 THR CA C 19 61.222 61.222 59.834 1.389 25585
2234 1 18 . 1 1 19 19 THR CB C 19 69.839 69.839 70.498 -0.659 25585
2235 1 18 . 1 1 19 19 THR H H 19 8.060 8.060 8.257 -0.197 25585
2236 1 18 . 1 1 20 20 LEU N N 20 125.150 125.150 123.623 1.527 25585
2237 1 18 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.086 0.201 25585
2238 1 18 . 1 1 20 20 LEU CA C 20 56.119 56.119 57.160 -1.042 25585
2239 1 18 . 1 1 20 20 LEU CB C 20 42.079 42.079 41.349 0.730 25585
2240 1 18 . 1 1 20 20 LEU H H 20 8.354 8.354 8.736 -0.382 25585
2241 1 18 . 1 1 21 21 SER N N 21 115.796 115.796 115.412 0.384 25585
2242 1 18 . 1 1 21 21 SER HA H 21 4.350 4.350 4.297 0.053 25585
2243 1 18 . 1 1 21 21 SER CA C 21 58.899 58.899 62.339 -3.440 25585
2244 1 18 . 1 1 21 21 SER CB C 21 63.363 63.363 63.063 0.300 25585
2245 1 18 . 1 1 21 21 SER H H 21 8.274 8.274 8.067 0.207 25585
2246 1 18 . 1 1 22 22 ARG N N 22 122.561 122.561 120.279 2.282 25585
2247 1 18 . 1 1 22 22 ARG HA H 22 4.289 4.289 4.108 0.181 25585
2248 1 18 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.301 -3.355 25585
2249 1 18 . 1 1 22 22 ARG CB C 22 30.369 30.369 30.150 0.219 25585
2250 1 18 . 1 1 22 22 ARG H H 22 8.149 8.149 7.546 0.603 25585
2251 1 18 . 1 1 23 23 ILE N N 23 121.335 121.335 118.529 2.806 25585
2252 1 18 . 1 1 23 23 ILE HA H 23 4.001 4.001 3.788 0.213 25585
2253 1 18 . 1 1 23 23 ILE CA C 23 61.671 61.671 63.589 -1.918 25585
2254 1 18 . 1 1 23 23 ILE CB C 23 38.383 38.383 37.725 0.658 25585
2255 1 18 . 1 1 23 23 ILE H H 23 8.002 8.002 7.306 0.696 25585
2256 1 18 . 1 1 24 24 GLU N N 24 122.372 122.372 114.062 8.310 25585
2257 1 18 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.332 -0.123 25585
2258 1 18 . 1 1 24 24 GLU CA C 24 56.115 56.115 54.462 1.653 25585
2259 1 18 . 1 1 24 24 GLU CB C 24 29.306 29.306 32.795 -3.489 25585
2260 1 18 . 1 1 24 24 GLU H H 24 8.317 8.317 7.735 0.582 25585
2261 1 18 . 1 1 25 25 HIS N N 25 118.365 118.365 114.402 3.963 25585
2262 1 18 . 1 1 25 25 HIS HA H 25 5.022 5.022 4.308 0.714 25585
2263 1 18 . 1 1 25 25 HIS CA C 25 52.772 52.772 55.712 -2.940 25585
2264 1 18 . 1 1 25 25 HIS CB C 25 28.551 28.551 27.636 0.915 25585
2265 1 18 . 1 1 25 25 HIS H H 25 8.323 8.323 8.404 -0.081 25585
2266 1 18 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.527 -0.059 25585
2267 1 18 . 1 1 26 26 PRO CA C 26 63.834 63.834 64.368 -0.534 25585
2268 1 18 . 1 1 26 26 PRO CB C 26 31.936 31.936 31.435 0.501 25585
2269 1 18 . 1 1 27 27 GLY N N 27 108.880 108.880 105.149 3.731 25585
2270 1 18 . 1 1 27 27 GLY CA C 27 45.212 45.212 45.114 0.098 25585
2271 1 18 . 1 1 27 27 GLY H H 27 8.594 8.594 8.028 0.566 25585
2272 1 18 . 1 1 28 28 ASN N N 28 118.144 118.144 116.861 1.283 25585
2273 1 18 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.342 0.323 25585
2274 1 18 . 1 1 28 28 ASN CA C 28 52.967 52.967 53.943 -0.976 25585
2275 1 18 . 1 1 28 28 ASN CB C 28 38.579 38.579 37.411 1.168 25585
2276 1 18 . 1 1 28 28 ASN H H 28 8.154 8.154 7.894 0.260 25585
2277 1 18 . 1 1 29 29 TYR N N 29 119.962 119.962 112.949 7.013 25585
2278 1 18 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.149 0.371 25585
2279 1 18 . 1 1 29 29 TYR CA C 29 57.544 57.544 59.677 -2.133 25585
2280 1 18 . 1 1 29 29 TYR CB C 29 39.011 39.011 35.772 3.239 25585
2281 1 18 . 1 1 29 29 TYR H H 29 8.058 8.058 7.839 0.219 25585
2282 1 18 . 1 1 30 30 ASP N N 30 120.874 120.874 113.459 7.415 25585
2283 1 18 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.233 0.446 25585
2284 1 18 . 1 1 30 30 ASP CA C 30 52.827 52.827 55.894 -3.067 25585
2285 1 18 . 1 1 30 30 ASP CB C 30 38.567 38.567 39.463 -0.896 25585
2286 1 18 . 1 1 30 30 ASP H H 30 8.226 8.226 8.180 0.046 25585
2287 1 19 . 1 1 3 3 CYS N N 3 120.614 120.614 123.897 -3.283 25585
2288 1 19 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.554 0.245 25585
2289 1 19 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.245 -5.453 25585
2290 1 19 . 1 1 3 3 CYS CB C 3 42.170 42.170 29.989 12.181 25585
2291 1 19 . 1 1 3 3 CYS H H 3 7.958 7.958 7.589 0.369 25585
2292 1 19 . 1 1 4 4 GLN N N 4 121.450 121.450 120.713 0.737 25585
2293 1 19 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.134 0.046 25585
2294 1 19 . 1 1 4 4 GLN CA C 4 54.557 54.557 52.954 1.603 25585
2295 1 19 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.485 -1.294 25585
2296 1 19 . 1 1 4 4 GLN H H 4 8.737 8.737 8.153 0.584 25585
2297 1 19 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.161 0.248 25585
2298 1 19 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.421 -0.067 25585
2299 1 19 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.665 0.045 25585
2300 1 19 . 1 1 6 6 GLY N N 6 111.865 111.865 109.634 2.231 25585
2301 1 19 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.435 -0.372 25585
2302 1 19 . 1 1 6 6 GLY H H 6 8.948 8.948 8.616 0.332 25585
2303 1 19 . 1 1 7 7 TYR N N 7 120.136 120.136 119.563 0.573 25585
2304 1 19 . 1 1 7 7 TYR HA H 7 5.057 5.057 5.089 -0.032 25585
2305 1 19 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.445 -0.052 25585
2306 1 19 . 1 1 7 7 TYR CB C 7 41.345 41.345 42.155 -0.810 25585
2307 1 19 . 1 1 7 7 TYR H H 7 8.300 8.300 7.591 0.709 25585
2308 1 19 . 1 1 8 8 ALA N N 8 121.599 121.599 122.775 -1.176 25585
2309 1 19 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.667 0.019 25585
2310 1 19 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.679 0.263 25585
2311 1 19 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.149 0.008 25585
2312 1 19 . 1 1 8 8 ALA H H 8 9.286 9.286 8.875 0.411 25585
2313 1 19 . 1 1 9 9 TYR N N 9 124.797 124.797 124.223 0.574 25585
2314 1 19 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.239 0.099 25585
2315 1 19 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.478 0.837 25585
2316 1 19 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.293 0.505 25585
2317 1 19 . 1 1 9 9 TYR H H 9 9.112 9.112 8.704 0.408 25585
2318 1 19 . 1 1 10 10 ASN N N 10 128.087 128.087 125.577 2.510 25585
2319 1 19 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.931 0.148 25585
2320 1 19 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.527 -0.355 25585
2321 1 19 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.039 -1.216 25585
2322 1 19 . 1 1 10 10 ASN H H 10 8.210 8.210 8.350 -0.140 25585
2323 1 19 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.112 -0.047 25585
2324 1 19 . 1 1 11 11 PRO CA C 11 63.988 63.988 64.280 -0.292 25585
2325 1 19 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.542 0.501 25585
2326 1 19 . 1 1 12 12 VAL N N 12 119.341 119.341 115.152 4.189 25585
2327 1 19 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.049 -0.291 25585
2328 1 19 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.518 1.585 25585
2329 1 19 . 1 1 12 12 VAL CB C 12 31.723 31.723 32.091 -0.368 25585
2330 1 19 . 1 1 12 12 VAL H H 12 7.570 7.570 7.511 0.059 25585
2331 1 19 . 1 1 13 13 LEU N N 13 116.412 116.412 120.232 -3.820 25585
2332 1 19 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.745 -0.456 25585
2333 1 19 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.234 0.586 25585
2334 1 19 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.483 -0.499 25585
2335 1 19 . 1 1 13 13 LEU H H 13 6.902 6.902 7.714 -0.812 25585
2336 1 19 . 1 1 14 14 GLY N N 14 108.651 108.651 107.226 1.425 25585
2337 1 19 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.138 1.105 25585
2338 1 19 . 1 1 14 14 GLY H H 14 8.387 8.387 8.573 -0.186 25585
2339 1 19 . 1 1 15 15 ILE N N 15 109.703 109.703 113.959 -4.256 25585
2340 1 19 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.789 0.040 25585
2341 1 19 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.888 -0.211 25585
2342 1 19 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.416 2.957 25585
2343 1 19 . 1 1 15 15 ILE H H 15 6.727 6.727 7.303 -0.576 25585
2344 1 19 . 1 1 16 16 CYS N N 16 120.648 120.648 119.636 1.012 25585
2345 1 19 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.293 -0.101 25585
2346 1 19 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.746 -2.753 25585
2347 1 19 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.428 15.696 25585
2348 1 19 . 1 1 16 16 CYS H H 16 8.811 8.811 8.723 0.088 25585
2349 1 19 . 1 1 17 17 THR N N 17 116.440 116.440 115.441 0.999 25585
2350 1 19 . 1 1 17 17 THR HA H 17 4.859 4.859 4.827 0.032 25585
2351 1 19 . 1 1 17 17 THR CB C 17 69.862 69.862 70.507 -0.645 25585
2352 1 19 . 1 1 17 17 THR H H 17 9.357 9.357 9.132 0.225 25585
2353 1 19 . 1 1 18 18 ILE N N 18 124.956 124.956 123.289 1.667 25585
2354 1 19 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.059 0.333 25585
2355 1 19 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.693 0.515 25585
2356 1 19 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.471 0.464 25585
2357 1 19 . 1 1 18 18 ILE H H 18 8.493 8.493 8.290 0.203 25585
2358 1 19 . 1 1 19 19 THR N N 19 119.997 119.997 122.349 -2.352 25585
2359 1 19 . 1 1 19 19 THR HA H 19 4.331 4.331 4.371 -0.040 25585
2360 1 19 . 1 1 19 19 THR CA C 19 61.222 61.222 60.551 0.671 25585
2361 1 19 . 1 1 19 19 THR CB C 19 69.839 69.839 70.552 -0.713 25585
2362 1 19 . 1 1 19 19 THR H H 19 8.060 8.060 8.239 -0.179 25585
2363 1 19 . 1 1 20 20 LEU N N 20 125.150 125.150 125.422 -0.272 25585
2364 1 19 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.195 0.092 25585
2365 1 19 . 1 1 20 20 LEU CA C 20 56.119 56.119 57.414 -1.295 25585
2366 1 19 . 1 1 20 20 LEU CB C 20 42.079 42.079 41.798 0.280 25585
2367 1 19 . 1 1 20 20 LEU H H 20 8.354 8.354 8.597 -0.243 25585
2368 1 19 . 1 1 21 21 SER N N 21 115.796 115.796 115.233 0.563 25585
2369 1 19 . 1 1 21 21 SER HA H 21 4.350 4.350 4.348 0.002 25585
2370 1 19 . 1 1 21 21 SER CA C 21 58.899 58.899 61.295 -2.396 25585
2371 1 19 . 1 1 21 21 SER CB C 21 63.363 63.363 63.002 0.361 25585
2372 1 19 . 1 1 21 21 SER H H 21 8.274 8.274 7.967 0.307 25585
2373 1 19 . 1 1 22 22 ARG N N 22 122.561 122.561 120.909 1.652 25585
2374 1 19 . 1 1 22 22 ARG HA H 22 4.289 4.289 4.050 0.239 25585
2375 1 19 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.520 -3.574 25585
2376 1 19 . 1 1 22 22 ARG CB C 22 30.369 30.369 29.887 0.482 25585
2377 1 19 . 1 1 22 22 ARG H H 22 8.149 8.149 7.549 0.600 25585
2378 1 19 . 1 1 23 23 ILE N N 23 121.335 121.335 119.089 2.246 25585
2379 1 19 . 1 1 23 23 ILE HA H 23 4.001 4.001 3.839 0.162 25585
2380 1 19 . 1 1 23 23 ILE CA C 23 61.671 61.671 63.730 -2.059 25585
2381 1 19 . 1 1 23 23 ILE CB C 23 38.383 38.383 37.624 0.759 25585
2382 1 19 . 1 1 23 23 ILE H H 23 8.002 8.002 7.742 0.260 25585
2383 1 19 . 1 1 24 24 GLU N N 24 122.372 122.372 113.747 8.625 25585
2384 1 19 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.412 -0.203 25585
2385 1 19 . 1 1 24 24 GLU CA C 24 56.115 56.115 55.597 0.518 25585
2386 1 19 . 1 1 24 24 GLU CB C 24 29.306 29.306 30.938 -1.632 25585
2387 1 19 . 1 1 24 24 GLU H H 24 8.317 8.317 8.550 -0.233 25585
2388 1 19 . 1 1 25 25 HIS N N 25 118.365 118.365 118.944 -0.579 25585
2389 1 19 . 1 1 25 25 HIS HA H 25 5.022 5.022 5.005 0.017 25585
2390 1 19 . 1 1 25 25 HIS CA C 25 52.772 52.772 54.156 -1.384 25585
2391 1 19 . 1 1 25 25 HIS CB C 25 28.551 28.551 29.740 -1.189 25585
2392 1 19 . 1 1 25 25 HIS H H 25 8.323 8.323 7.759 0.564 25585
2393 1 19 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.743 -0.275 25585
2394 1 19 . 1 1 26 26 PRO CA C 26 63.834 63.834 64.178 -0.344 25585
2395 1 19 . 1 1 26 26 PRO CB C 26 31.936 31.936 32.127 -0.191 25585
2396 1 19 . 1 1 27 27 GLY N N 27 108.880 108.880 107.633 1.247 25585
2397 1 19 . 1 1 27 27 GLY CA C 27 45.212 45.212 46.862 -1.650 25585
2398 1 19 . 1 1 27 27 GLY H H 27 8.594 8.594 8.822 -0.228 25585
2399 1 19 . 1 1 28 28 ASN N N 28 118.144 118.144 120.008 -1.864 25585
2400 1 19 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.424 0.241 25585
2401 1 19 . 1 1 28 28 ASN CA C 28 52.967 52.967 54.818 -1.851 25585
2402 1 19 . 1 1 28 28 ASN CB C 28 38.579 38.579 38.470 0.109 25585
2403 1 19 . 1 1 28 28 ASN H H 28 8.154 8.154 7.968 0.186 25585
2404 1 19 . 1 1 29 29 TYR N N 29 119.962 119.962 117.788 2.174 25585
2405 1 19 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.740 -0.220 25585
2406 1 19 . 1 1 29 29 TYR CA C 29 57.544 57.544 57.122 0.422 25585
2407 1 19 . 1 1 29 29 TYR CB C 29 39.011 39.011 38.001 1.010 25585
2408 1 19 . 1 1 29 29 TYR H H 29 8.058 8.058 7.593 0.465 25585
2409 1 19 . 1 1 30 30 ASP N N 30 120.874 120.874 118.497 2.377 25585
2410 1 19 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.605 0.074 25585
2411 1 19 . 1 1 30 30 ASP CA C 30 52.827 52.827 53.456 -0.629 25585
2412 1 19 . 1 1 30 30 ASP CB C 30 38.567 38.567 40.086 -1.519 25585
2413 1 19 . 1 1 30 30 ASP H H 30 8.226 8.226 7.780 0.446 25585
2414 1 20 . 1 1 3 3 CYS N N 3 120.614 120.614 123.773 -3.159 25585
2415 1 20 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.483 0.316 25585
2416 1 20 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.724 -5.931 25585
2417 1 20 . 1 1 3 3 CYS CB C 3 42.170 42.170 29.903 12.267 25585
2418 1 20 . 1 1 3 3 CYS H H 3 7.958 7.958 7.603 0.355 25585
2419 1 20 . 1 1 4 4 GLN N N 4 121.450 121.450 121.590 -0.140 25585
2420 1 20 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.086 0.094 25585
2421 1 20 . 1 1 4 4 GLN CA C 4 54.557 54.557 53.294 1.263 25585
2422 1 20 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.206 -1.015 25585
2423 1 20 . 1 1 4 4 GLN H H 4 8.737 8.737 8.164 0.573 25585
2424 1 20 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.197 0.212 25585
2425 1 20 . 1 1 5 5 PRO CA C 5 64.354 64.354 63.986 0.368 25585
2426 1 20 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.947 -0.237 25585
2427 1 20 . 1 1 6 6 GLY N N 6 111.865 111.865 110.306 1.559 25585
2428 1 20 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.431 -0.368 25585
2429 1 20 . 1 1 6 6 GLY H H 6 8.948 8.948 8.611 0.337 25585
2430 1 20 . 1 1 7 7 TYR N N 7 120.136 120.136 120.009 0.127 25585
2431 1 20 . 1 1 7 7 TYR HA H 7 5.057 5.057 4.884 0.173 25585
2432 1 20 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.615 -0.222 25585
2433 1 20 . 1 1 7 7 TYR CB C 7 41.345 41.345 41.695 -0.350 25585
2434 1 20 . 1 1 7 7 TYR H H 7 8.300 8.300 7.525 0.775 25585
2435 1 20 . 1 1 8 8 ALA N N 8 121.599 121.599 122.666 -1.067 25585
2436 1 20 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.680 0.006 25585
2437 1 20 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.530 0.412 25585
2438 1 20 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.006 0.150 25585
2439 1 20 . 1 1 8 8 ALA H H 8 9.286 9.286 8.978 0.308 25585
2440 1 20 . 1 1 9 9 TYR N N 9 124.797 124.797 124.954 -0.157 25585
2441 1 20 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.235 0.103 25585
2442 1 20 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.154 1.161 25585
2443 1 20 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.187 0.611 25585
2444 1 20 . 1 1 9 9 TYR H H 9 9.112 9.112 8.732 0.380 25585
2445 1 20 . 1 1 10 10 ASN N N 10 128.087 128.087 125.862 2.225 25585
2446 1 20 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.873 0.206 25585
2447 1 20 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.489 -0.317 25585
2448 1 20 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.364 -1.540 25585
2449 1 20 . 1 1 10 10 ASN H H 10 8.210 8.210 8.404 -0.194 25585
2450 1 20 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.344 -0.279 25585
2451 1 20 . 1 1 11 11 PRO CA C 11 63.988 63.988 63.885 0.103 25585
2452 1 20 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.667 0.376 25585
2453 1 20 . 1 1 12 12 VAL N N 12 119.341 119.341 116.211 3.130 25585
2454 1 20 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.096 -0.338 25585
2455 1 20 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.315 1.788 25585
2456 1 20 . 1 1 12 12 VAL CB C 12 31.723 31.723 31.648 0.074 25585
2457 1 20 . 1 1 12 12 VAL H H 12 7.570 7.570 7.499 0.071 25585
2458 1 20 . 1 1 13 13 LEU N N 13 116.412 116.412 120.356 -3.944 25585
2459 1 20 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.670 -0.381 25585
2460 1 20 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.337 0.483 25585
2461 1 20 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.677 -0.693 25585
2462 1 20 . 1 1 13 13 LEU H H 13 6.902 6.902 7.498 -0.596 25585
2463 1 20 . 1 1 14 14 GLY N N 14 108.651 108.651 106.662 1.989 25585
2464 1 20 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.187 1.056 25585
2465 1 20 . 1 1 14 14 GLY H H 14 8.387 8.387 8.403 -0.016 25585
2466 1 20 . 1 1 15 15 ILE N N 15 109.703 109.703 112.730 -3.027 25585
2467 1 20 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.734 0.095 25585
2468 1 20 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.807 -0.130 25585
2469 1 20 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.241 3.132 25585
2470 1 20 . 1 1 15 15 ILE H H 15 6.727 6.727 7.373 -0.646 25585
2471 1 20 . 1 1 16 16 CYS N N 16 120.648 120.648 119.916 0.732 25585
2472 1 20 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.252 -0.060 25585
2473 1 20 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.557 -2.564 25585
2474 1 20 . 1 1 16 16 CYS CB C 16 43.124 43.124 26.970 16.154 25585
2475 1 20 . 1 1 16 16 CYS H H 16 8.811 8.811 8.664 0.147 25585
2476 1 20 . 1 1 17 17 THR N N 17 116.440 116.440 114.805 1.635 25585
2477 1 20 . 1 1 17 17 THR HA H 17 4.859 4.859 4.910 -0.051 25585
2478 1 20 . 1 1 17 17 THR CB C 17 69.862 69.862 71.921 -2.059 25585
2479 1 20 . 1 1 17 17 THR H H 17 9.357 9.357 8.936 0.421 25585
2480 1 20 . 1 1 18 18 ILE N N 18 124.956 124.956 123.678 1.278 25585
2481 1 20 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.023 0.369 25585
2482 1 20 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.546 0.662 25585
2483 1 20 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.184 0.751 25585
2484 1 20 . 1 1 18 18 ILE H H 18 8.493 8.493 8.407 0.086 25585
2485 1 20 . 1 1 19 19 THR N N 19 119.997 119.997 122.368 -2.371 25585
2486 1 20 . 1 1 19 19 THR HA H 19 4.331 4.331 4.344 -0.013 25585
2487 1 20 . 1 1 19 19 THR CA C 19 61.222 61.222 60.321 0.901 25585
2488 1 20 . 1 1 19 19 THR CB C 19 69.839 69.839 70.373 -0.534 25585
2489 1 20 . 1 1 19 19 THR H H 19 8.060 8.060 7.757 0.303 25585
2490 1 20 . 1 1 20 20 LEU N N 20 125.150 125.150 126.224 -1.074 25585
2491 1 20 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.002 0.285 25585
2492 1 20 . 1 1 20 20 LEU CA C 20 56.119 56.119 57.566 -1.447 25585
2493 1 20 . 1 1 20 20 LEU CB C 20 42.079 42.079 41.741 0.338 25585
2494 1 20 . 1 1 20 20 LEU H H 20 8.354 8.354 8.704 -0.350 25585
2495 1 20 . 1 1 21 21 SER N N 21 115.796 115.796 114.510 1.286 25585
2496 1 20 . 1 1 21 21 SER HA H 21 4.350 4.350 3.646 0.704 25585
2497 1 20 . 1 1 21 21 SER CA C 21 58.899 58.899 61.110 -2.211 25585
2498 1 20 . 1 1 21 21 SER CB C 21 63.363 63.363 62.344 1.018 25585
2499 1 20 . 1 1 21 21 SER H H 21 8.274 8.274 7.619 0.655 25585
2500 1 20 . 1 1 22 22 ARG N N 22 122.561 122.561 119.883 2.678 25585
2501 1 20 . 1 1 22 22 ARG HA H 22 4.289 4.289 3.379 0.910 25585
2502 1 20 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.064 -3.118 25585
2503 1 20 . 1 1 22 22 ARG CB C 22 30.369 30.369 29.870 0.499 25585
2504 1 20 . 1 1 22 22 ARG H H 22 8.149 8.149 7.101 1.048 25585
2505 1 20 . 1 1 23 23 ILE N N 23 121.335 121.335 118.147 3.188 25585
2506 1 20 . 1 1 23 23 ILE HA H 23 4.001 4.001 3.794 0.207 25585
2507 1 20 . 1 1 23 23 ILE CA C 23 61.671 61.671 63.760 -2.089 25585
2508 1 20 . 1 1 23 23 ILE CB C 23 38.383 38.383 37.789 0.594 25585
2509 1 20 . 1 1 23 23 ILE H H 23 8.002 8.002 7.426 0.576 25585
2510 1 20 . 1 1 24 24 GLU N N 24 122.372 122.372 113.512 8.860 25585
2511 1 20 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.426 -0.217 25585
2512 1 20 . 1 1 24 24 GLU CA C 24 56.115 56.115 55.051 1.064 25585
2513 1 20 . 1 1 24 24 GLU CB C 24 29.306 29.306 32.242 -2.936 25585
2514 1 20 . 1 1 24 24 GLU H H 24 8.317 8.317 8.264 0.053 25585
2515 1 20 . 1 1 25 25 HIS N N 25 118.365 118.365 115.272 3.093 25585
2516 1 20 . 1 1 25 25 HIS HA H 25 5.022 5.022 4.453 0.569 25585
2517 1 20 . 1 1 25 25 HIS CA C 25 52.772 52.772 55.903 -3.131 25585
2518 1 20 . 1 1 25 25 HIS CB C 25 28.551 28.551 27.634 0.917 25585
2519 1 20 . 1 1 25 25 HIS H H 25 8.323 8.323 8.282 0.041 25585
2520 1 20 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.481 -0.013 25585
2521 1 20 . 1 1 26 26 PRO CA C 26 63.834 63.834 65.671 -1.837 25585
2522 1 20 . 1 1 26 26 PRO CB C 26 31.936 31.936 31.649 0.287 25585
2523 1 20 . 1 1 27 27 GLY N N 27 108.880 108.880 107.236 1.644 25585
2524 1 20 . 1 1 27 27 GLY CA C 27 45.212 45.212 46.751 -1.539 25585
2525 1 20 . 1 1 27 27 GLY H H 27 8.594 8.594 8.488 0.106 25585
2526 1 20 . 1 1 28 28 ASN N N 28 118.144 118.144 118.799 -0.655 25585
2527 1 20 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.492 0.173 25585
2528 1 20 . 1 1 28 28 ASN CA C 28 52.967 52.967 55.279 -2.312 25585
2529 1 20 . 1 1 28 28 ASN CB C 28 38.579 38.579 37.911 0.668 25585
2530 1 20 . 1 1 28 28 ASN H H 28 8.154 8.154 8.407 -0.253 25585
2531 1 20 . 1 1 29 29 TYR N N 29 119.962 119.962 116.185 3.777 25585
2532 1 20 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.633 -0.113 25585
2533 1 20 . 1 1 29 29 TYR CA C 29 57.544 57.544 57.474 0.070 25585
2534 1 20 . 1 1 29 29 TYR CB C 29 39.011 39.011 38.755 0.256 25585
2535 1 20 . 1 1 29 29 TYR H H 29 8.058 8.058 7.766 0.292 25585
2536 1 20 . 1 1 30 30 ASP N N 30 120.874 120.874 118.523 2.351 25585
2537 1 20 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.308 0.371 25585
2538 1 20 . 1 1 30 30 ASP CA C 30 52.827 52.827 55.461 -2.634 25585
2539 1 20 . 1 1 30 30 ASP CB C 30 38.567 38.567 39.384 -0.817 25585
2540 1 20 . 1 1 30 30 ASP H H 30 8.226 8.226 7.611 0.615 25585
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 25 2.891 -0.435 2.917 25585
2 1 1 "Average Difference" HA 30 0.350 -0.129 0.330 25585
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25585
4 1 1 "Average Difference" CA 27 1.815 0.583 1.751 25585
5 1 1 "Average Difference" CB 25 4.085 -0.968 4.050 25585
6 1 1 "Average Difference" HN 25 0.411 -0.125 0.400 25585
7 1 2 "Average Difference" N 25 2.324 -0.277 2.355 25585
8 1 2 "Average Difference" HA 30 0.223 -0.053 0.220 25585
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25585
10 1 2 "Average Difference" CA 27 1.855 0.689 1.755 25585
11 1 2 "Average Difference" CB 25 4.211 -0.991 4.178 25585
12 1 2 "Average Difference" HN 25 0.413 -0.103 0.408 25585
13 1 3 "Average Difference" N 25 3.008 -0.983 2.901 25585
14 1 3 "Average Difference" HA 30 0.232 -0.084 0.220 25585
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25585
16 1 3 "Average Difference" CA 27 1.778 0.649 1.687 25585
17 1 3 "Average Difference" CB 25 4.150 -1.092 4.087 25585
18 1 3 "Average Difference" HN 25 0.410 -0.133 0.396 25585
19 1 4 "Average Difference" N 25 2.472 -0.447 2.482 25585
20 1 4 "Average Difference" HA 30 0.210 -0.057 0.205 25585
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25585
22 1 4 "Average Difference" CA 27 1.695 0.510 1.647 25585
23 1 4 "Average Difference" CB 25 4.124 -1.086 4.061 25585
24 1 4 "Average Difference" HN 25 0.395 -0.146 0.374 25585
25 1 5 "Average Difference" N 25 3.243 -1.104 3.112 25585
26 1 5 "Average Difference" HA 30 0.226 -0.094 0.209 25585
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25585
28 1 5 "Average Difference" CA 27 1.714 0.591 1.640 25585
29 1 5 "Average Difference" CB 25 4.180 -1.151 4.101 25585
30 1 5 "Average Difference" HN 25 0.400 -0.162 0.373 25585
31 1 6 "Average Difference" N 25 2.609 -0.833 2.524 25585
32 1 6 "Average Difference" HA 30 0.217 -0.049 0.215 25585
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25585
34 1 6 "Average Difference" CA 27 1.905 0.783 1.769 25585
35 1 6 "Average Difference" CB 25 4.134 -1.041 4.084 25585
36 1 6 "Average Difference" HN 25 0.355 -0.084 0.351 25585
37 1 7 "Average Difference" N 25 3.044 -1.025 2.925 25585
38 1 7 "Average Difference" HA 30 0.238 -0.083 0.227 25585
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25585
40 1 7 "Average Difference" CA 27 1.824 0.630 1.744 25585
41 1 7 "Average Difference" CB 25 4.201 -1.129 4.130 25585
42 1 7 "Average Difference" HN 25 0.393 -0.128 0.379 25585
43 1 8 "Average Difference" N 25 2.093 -0.282 2.117 25585
44 1 8 "Average Difference" HA 30 0.199 -0.020 0.201 25585
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25585
46 1 8 "Average Difference" CA 27 1.794 0.561 1.737 25585
47 1 8 "Average Difference" CB 25 4.122 -1.020 4.076 25585
48 1 8 "Average Difference" HN 25 0.507 -0.176 0.485 25585
49 1 9 "Average Difference" N 25 2.449 -0.662 2.406 25585
50 1 9 "Average Difference" HA 30 0.195 -0.040 0.194 25585
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25585
52 1 9 "Average Difference" CA 27 1.855 0.728 1.738 25585
53 1 9 "Average Difference" CB 25 4.145 -1.137 4.069 25585
54 1 9 "Average Difference" HN 25 0.388 -0.111 0.380 25585
55 1 10 "Average Difference" N 25 2.353 -0.302 2.382 25585
56 1 10 "Average Difference" HA 30 0.242 -0.042 0.242 25585
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25585
58 1 10 "Average Difference" CA 27 1.681 0.396 1.664 25585
59 1 10 "Average Difference" CB 25 4.117 -0.938 4.091 25585
60 1 10 "Average Difference" HN 25 0.469 -0.175 0.444 25585
61 1 11 "Average Difference" N 25 3.070 -1.034 2.950 25585
62 1 11 "Average Difference" HA 30 0.233 -0.100 0.214 25585
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25585
64 1 11 "Average Difference" CA 27 1.708 0.565 1.642 25585
65 1 11 "Average Difference" CB 25 4.102 -1.174 4.011 25585
66 1 11 "Average Difference" HN 25 0.380 -0.117 0.369 25585
67 1 12 "Average Difference" N 25 2.763 -0.799 2.700 25585
68 1 12 "Average Difference" HA 30 0.318 -0.099 0.308 25585
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25585
70 1 12 "Average Difference" CA 27 1.667 0.379 1.654 25585
71 1 12 "Average Difference" CB 25 4.182 -1.034 4.136 25585
72 1 12 "Average Difference" HN 25 0.434 -0.125 0.425 25585
73 1 13 "Average Difference" N 25 2.662 -0.907 2.554 25585
74 1 13 "Average Difference" HA 30 0.249 -0.045 0.249 25585
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25585
76 1 13 "Average Difference" CA 27 1.817 0.303 1.825 25585
77 1 13 "Average Difference" CB 25 4.201 -1.150 4.124 25585
78 1 13 "Average Difference" HN 25 0.449 -0.164 0.427 25585
79 1 14 "Average Difference" N 25 2.890 -1.039 2.752 25585
80 1 14 "Average Difference" HA 30 0.231 -0.092 0.216 25585
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25585
82 1 14 "Average Difference" CA 27 1.891 0.777 1.757 25585
83 1 14 "Average Difference" CB 25 4.093 -1.096 4.025 25585
84 1 14 "Average Difference" HN 25 0.362 -0.102 0.355 25585
85 1 15 "Average Difference" N 25 2.271 -0.589 2.239 25585
86 1 15 "Average Difference" HA 30 0.229 -0.047 0.228 25585
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25585
88 1 15 "Average Difference" CA 27 1.612 0.341 1.606 25585
89 1 15 "Average Difference" CB 25 4.044 -0.994 4.000 25585
90 1 15 "Average Difference" HN 25 0.531 -0.227 0.490 25585
91 1 16 "Average Difference" N 25 2.582 -0.516 2.582 25585
92 1 16 "Average Difference" HA 30 0.271 -0.060 0.269 25585
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25585
94 1 16 "Average Difference" CA 27 1.700 0.568 1.633 25585
95 1 16 "Average Difference" CB 25 4.201 -0.863 4.196 25585
96 1 16 "Average Difference" HN 25 0.480 -0.186 0.451 25585
97 1 17 "Average Difference" N 25 2.511 -0.882 2.399 25585
98 1 17 "Average Difference" HA 30 0.208 -0.051 0.205 25585
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25585
100 1 17 "Average Difference" CA 27 1.732 0.669 1.627 25585
101 1 17 "Average Difference" CB 25 4.048 -0.991 4.006 25585
102 1 17 "Average Difference" HN 25 0.384 -0.059 0.387 25585
103 1 18 "Average Difference" N 25 3.398 -1.591 3.065 25585
104 1 18 "Average Difference" HA 30 0.263 -0.083 0.254 25585
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25585
106 1 18 "Average Difference" CA 27 2.008 0.724 1.909 25585
107 1 18 "Average Difference" CB 25 4.249 -1.170 4.169 25585
108 1 18 "Average Difference" HN 25 0.418 -0.154 0.397 25585
109 1 19 "Average Difference" N 25 2.724 -0.688 2.690 25585
110 1 19 "Average Difference" HA 30 0.202 -0.036 0.202 25585
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25585
112 1 19 "Average Difference" CA 27 1.714 0.616 1.630 25585
113 1 19 "Average Difference" CB 25 4.088 -1.011 4.043 25585
114 1 19 "Average Difference" HN 25 0.403 -0.145 0.384 25585
115 1 20 "Average Difference" N 25 2.819 -0.958 2.705 25585
116 1 20 "Average Difference" HA 30 0.321 -0.141 0.293 25585
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25585
118 1 20 "Average Difference" CA 27 1.935 0.760 1.814 25585
119 1 20 "Average Difference" CB 25 4.212 -1.117 4.145 25585
120 1 20 "Average Difference" HN 25 0.449 -0.204 0.409 25585
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 25585
_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 3 3 CYS N N 3 120.614 120.614 123.788 -3.174 25585
2 1 . 1 1 3 3 CYS HA H 3 4.799 4.799 4.540 0.259 25585
3 1 . 1 1 3 3 CYS CA C 3 51.792 51.792 57.456 -5.664 25585
4 1 . 1 1 3 3 CYS CB C 3 42.170 42.170 29.979 12.191 25585
5 1 . 1 1 3 3 CYS H H 3 7.958 7.958 7.601 0.357 25585
6 1 . 1 1 4 4 GLN N N 4 121.450 121.450 120.874 0.576 25585
7 1 . 1 1 4 4 GLN HA H 4 4.180 4.180 4.141 0.039 25585
8 1 . 1 1 4 4 GLN CA C 4 54.557 54.557 53.055 1.502 25585
9 1 . 1 1 4 4 GLN CB C 4 27.191 27.191 28.402 -1.211 25585
10 1 . 1 1 4 4 GLN H H 4 8.737 8.737 8.166 0.571 25585
11 1 . 1 1 5 5 PRO HA H 5 4.409 4.409 4.219 0.190 25585
12 1 . 1 1 5 5 PRO CA C 5 64.354 64.354 64.297 0.057 25585
13 1 . 1 1 5 5 PRO CB C 5 31.710 31.710 31.716 -0.006 25585
14 1 . 1 1 6 6 GLY N N 6 111.865 111.865 110.149 1.716 25585
15 1 . 1 1 6 6 GLY CA C 6 45.063 45.063 45.601 -0.538 25585
16 1 . 1 1 6 6 GLY H H 6 8.948 8.948 8.660 0.288 25585
17 1 . 1 1 7 7 TYR N N 7 120.136 120.136 119.662 0.474 25585
18 1 . 1 1 7 7 TYR HA H 7 5.057 5.057 5.061 -0.004 25585
19 1 . 1 1 7 7 TYR CA C 7 56.393 56.393 56.509 -0.116 25585
20 1 . 1 1 7 7 TYR CB C 7 41.345 41.345 42.104 -0.759 25585
21 1 . 1 1 7 7 TYR H H 7 8.300 8.300 7.620 0.680 25585
22 1 . 1 1 8 8 ALA N N 8 121.599 121.599 122.689 -1.090 25585
23 1 . 1 1 8 8 ALA HA H 8 4.686 4.686 4.690 -0.004 25585
24 1 . 1 1 8 8 ALA CA C 8 50.942 50.942 50.676 0.266 25585
25 1 . 1 1 8 8 ALA CB C 8 22.157 22.157 22.129 0.028 25585
26 1 . 1 1 8 8 ALA H H 8 9.286 9.286 8.940 0.346 25585
27 1 . 1 1 9 9 TYR N N 9 124.797 124.797 124.399 0.398 25585
28 1 . 1 1 9 9 TYR HA H 9 4.338 4.338 4.242 0.096 25585
29 1 . 1 1 9 9 TYR CA C 9 59.315 59.315 58.349 0.966 25585
30 1 . 1 1 9 9 TYR CB C 9 38.798 38.798 38.225 0.573 25585
31 1 . 1 1 9 9 TYR H H 9 9.112 9.112 8.715 0.397 25585
32 1 . 1 1 10 10 ASN N N 10 128.087 128.087 125.769 2.318 25585
33 1 . 1 1 10 10 ASN HA H 10 5.079 5.079 4.914 0.165 25585
34 1 . 1 1 10 10 ASN CA C 10 49.172 49.172 49.510 -0.338 25585
35 1 . 1 1 10 10 ASN CB C 10 38.824 38.824 40.189 -1.365 25585
36 1 . 1 1 10 10 ASN H H 10 8.210 8.210 8.518 -0.308 25585
37 1 . 1 1 11 11 PRO HA H 11 4.065 4.065 4.216 -0.151 25585
38 1 . 1 1 11 11 PRO CA C 11 63.988 63.988 64.134 -0.146 25585
39 1 . 1 1 11 11 PRO CB C 11 32.043 32.043 31.569 0.474 25585
40 1 . 1 1 12 12 VAL N N 12 119.341 119.341 115.649 3.692 25585
41 1 . 1 1 12 12 VAL HA H 12 3.758 3.758 4.080 -0.322 25585
42 1 . 1 1 12 12 VAL CA C 12 65.103 65.103 63.315 1.788 25585
43 1 . 1 1 12 12 VAL CB C 12 31.723 31.723 31.808 -0.085 25585
44 1 . 1 1 12 12 VAL H H 12 7.570 7.570 7.504 0.066 25585
45 1 . 1 1 13 13 LEU N N 13 116.412 116.412 120.201 -3.789 25585
46 1 . 1 1 13 13 LEU HA H 13 4.289 4.289 4.716 -0.427 25585
47 1 . 1 1 13 13 LEU CA C 13 55.820 55.820 55.286 0.534 25585
48 1 . 1 1 13 13 LEU CB C 13 43.984 43.984 44.574 -0.590 25585
49 1 . 1 1 13 13 LEU H H 13 6.902 6.902 7.631 -0.729 25585
50 1 . 1 1 14 14 GLY N N 14 108.651 108.651 106.998 1.653 25585
51 1 . 1 1 14 14 GLY CA C 14 46.243 46.243 45.151 1.092 25585
52 1 . 1 1 14 14 GLY H H 14 8.387 8.387 8.509 -0.122 25585
53 1 . 1 1 15 15 ILE N N 15 109.703 109.703 113.514 -3.811 25585
54 1 . 1 1 15 15 ILE HA H 15 4.829 4.829 4.776 0.053 25585
55 1 . 1 1 15 15 ILE CA C 15 58.677 58.677 58.828 -0.151 25585
56 1 . 1 1 15 15 ILE CB C 15 43.373 43.373 40.292 3.081 25585
57 1 . 1 1 15 15 ILE H H 15 6.727 6.727 7.339 -0.612 25585
58 1 . 1 1 16 16 CYS N N 16 120.648 120.648 119.951 0.697 25585
59 1 . 1 1 16 16 CYS HA H 16 5.192 5.192 5.316 -0.124 25585
60 1 . 1 1 16 16 CYS CA C 16 55.993 55.993 58.585 -2.592 25585
61 1 . 1 1 16 16 CYS CB C 16 43.124 43.124 27.289 15.835 25585
62 1 . 1 1 16 16 CYS H H 16 8.811 8.811 8.702 0.109 25585
63 1 . 1 1 17 17 THR N N 17 116.440 116.440 115.125 1.315 25585
64 1 . 1 1 17 17 THR HA H 17 4.859 4.859 4.863 -0.004 25585
65 1 . 1 1 17 17 THR CB C 17 69.862 69.862 71.363 -1.501 25585
66 1 . 1 1 17 17 THR H H 17 9.357 9.357 9.037 0.320 25585
67 1 . 1 1 18 18 ILE N N 18 124.956 124.956 123.564 1.392 25585
68 1 . 1 1 18 18 ILE HA H 18 3.392 3.392 3.102 0.290 25585
69 1 . 1 1 18 18 ILE CA C 18 62.208 62.208 61.705 0.503 25585
70 1 . 1 1 18 18 ILE CB C 18 38.935 38.935 38.360 0.575 25585
71 1 . 1 1 18 18 ILE H H 18 8.493 8.493 8.376 0.117 25585
72 1 . 1 1 19 19 THR N N 19 119.997 119.997 122.410 -2.413 25585
73 1 . 1 1 19 19 THR HA H 19 4.331 4.331 4.430 -0.099 25585
74 1 . 1 1 19 19 THR CA C 19 61.222 61.222 60.172 1.050 25585
75 1 . 1 1 19 19 THR CB C 19 69.839 69.839 70.485 -0.646 25585
76 1 . 1 1 19 19 THR H H 19 8.060 8.060 8.152 -0.092 25585
77 1 . 1 1 20 20 LEU N N 20 125.150 125.150 125.392 -0.242 25585
78 1 . 1 1 20 20 LEU HA H 20 4.287 4.287 4.132 0.155 25585
79 1 . 1 1 20 20 LEU CA C 20 56.119 56.119 57.156 -1.037 25585
80 1 . 1 1 20 20 LEU CB C 20 42.079 42.079 41.604 0.474 25585
81 1 . 1 1 20 20 LEU H H 20 8.354 8.354 8.718 -0.364 25585
82 1 . 1 1 21 21 SER N N 21 115.796 115.796 114.576 1.220 25585
83 1 . 1 1 21 21 SER HA H 21 4.350 4.350 4.099 0.251 25585
84 1 . 1 1 21 21 SER CA C 21 58.899 58.899 60.953 -2.054 25585
85 1 . 1 1 21 21 SER CB C 21 63.363 63.363 62.887 0.476 25585
86 1 . 1 1 21 21 SER H H 21 8.274 8.274 8.029 0.245 25585
87 1 . 1 1 22 22 ARG N N 22 122.561 122.561 121.079 1.482 25585
88 1 . 1 1 22 22 ARG HA H 22 4.289 4.289 4.089 0.200 25585
89 1 . 1 1 22 22 ARG CA C 22 54.946 54.946 58.204 -3.258 25585
90 1 . 1 1 22 22 ARG CB C 22 30.369 30.369 30.162 0.207 25585
91 1 . 1 1 22 22 ARG H H 22 8.149 8.149 7.525 0.624 25585
92 1 . 1 1 23 23 ILE N N 23 121.335 121.335 119.153 2.182 25585
93 1 . 1 1 23 23 ILE HA H 23 4.001 4.001 3.895 0.106 25585
94 1 . 1 1 23 23 ILE CA C 23 61.671 61.671 63.406 -1.735 25585
95 1 . 1 1 23 23 ILE CB C 23 38.383 38.383 38.149 0.234 25585
96 1 . 1 1 23 23 ILE H H 23 8.002 8.002 7.712 0.290 25585
97 1 . 1 1 24 24 GLU N N 24 122.372 122.372 116.398 5.974 25585
98 1 . 1 1 24 24 GLU HA H 24 4.209 4.209 4.368 -0.159 25585
99 1 . 1 1 24 24 GLU CA C 24 56.115 56.115 55.586 0.529 25585
100 1 . 1 1 24 24 GLU CB C 24 29.306 29.306 30.599 -1.293 25585
101 1 . 1 1 24 24 GLU H H 24 8.317 8.317 8.223 0.094 25585
102 1 . 1 1 25 25 HIS N N 25 118.365 118.365 117.929 0.436 25585
103 1 . 1 1 25 25 HIS HA H 25 5.022 5.022 4.815 0.207 25585
104 1 . 1 1 25 25 HIS CA C 25 52.772 52.772 54.247 -1.475 25585
105 1 . 1 1 25 25 HIS CB C 25 28.551 28.551 29.083 -0.532 25585
106 1 . 1 1 25 25 HIS H H 25 8.323 8.323 7.998 0.325 25585
107 1 . 1 1 26 26 PRO HA H 26 4.468 4.468 4.353 0.115 25585
108 1 . 1 1 26 26 PRO CA C 26 63.834 63.834 64.624 -0.790 25585
109 1 . 1 1 26 26 PRO CB C 26 31.936 31.936 31.861 0.075 25585
110 1 . 1 1 27 27 GLY N N 27 108.880 108.880 105.829 3.051 25585
111 1 . 1 1 27 27 GLY CA C 27 45.212 45.212 46.011 -0.799 25585
112 1 . 1 1 27 27 GLY H H 27 8.594 8.594 8.536 0.058 25585
113 1 . 1 1 28 28 ASN N N 28 118.144 118.144 118.970 -0.826 25585
114 1 . 1 1 28 28 ASN HA H 28 4.665 4.665 4.381 0.284 25585
115 1 . 1 1 28 28 ASN CA C 28 52.967 52.967 54.487 -1.520 25585
116 1 . 1 1 28 28 ASN CB C 28 38.579 38.579 38.213 0.366 25585
117 1 . 1 1 28 28 ASN H H 28 8.154 8.154 7.949 0.205 25585
118 1 . 1 1 29 29 TYR N N 29 119.962 119.962 115.654 4.308 25585
119 1 . 1 1 29 29 TYR HA H 29 4.520 4.520 4.585 -0.065 25585
120 1 . 1 1 29 29 TYR CA C 29 57.544 57.544 57.451 0.093 25585
121 1 . 1 1 29 29 TYR CB C 29 39.011 39.011 37.619 1.392 25585
122 1 . 1 1 29 29 TYR H H 29 8.058 8.058 7.598 0.460 25585
123 1 . 1 1 30 30 ASP N N 30 120.874 120.874 119.219 1.655 25585
124 1 . 1 1 30 30 ASP HA H 30 4.679 4.679 4.372 0.307 25585
125 1 . 1 1 30 30 ASP CA C 30 52.827 52.827 54.956 -2.129 25585
126 1 . 1 1 30 30 ASP CB C 30 38.567 38.567 40.117 -1.550 25585
127 1 . 1 1 30 30 ASP H H 30 8.226 8.226 8.018 0.208 25585
stop_
save_