data_25913
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25913
_Entry.PDB_ID 2N9O
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 25913
_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 0 0 SER HA H 0 4.525 4.525 4.850 -0.325 25913
2 1 1 . 1 1 0 0 SER C C 0 174.776 174.776 174.260 0.516 25913
3 1 1 . 1 1 0 0 SER CA C 0 58.364 58.364 58.736 -0.372 25913
4 1 1 . 1 1 0 0 SER CB C 0 64.049 64.049 64.258 -0.209 25913
5 1 1 . 1 1 1 1 MET N N 1 123.174 123.174 120.596 2.578 25913
6 1 1 . 1 1 1 1 MET HA H 1 4.486 4.486 4.451 0.035 25913
7 1 1 . 1 1 1 1 MET C C 1 176.177 176.177 176.274 -0.097 25913
8 1 1 . 1 1 1 1 MET CA C 1 55.804 55.804 56.379 -0.575 25913
9 1 1 . 1 1 1 1 MET CB C 1 32.941 32.941 33.135 -0.194 25913
10 1 1 . 1 1 1 1 MET H H 1 8.592 8.592 7.586 1.006 25913
11 1 1 . 1 1 2 2 ALA N N 2 125.785 125.785 125.427 0.358 25913
12 1 1 . 1 1 2 2 ALA HA H 2 4.293 4.293 3.998 0.295 25913
13 1 1 . 1 1 2 2 ALA C C 2 177.812 177.812 177.969 -0.157 25913
14 1 1 . 1 1 2 2 ALA CA C 2 52.809 52.809 52.357 0.452 25913
15 1 1 . 1 1 2 2 ALA CB C 2 19.224 19.224 17.465 1.759 25913
16 1 1 . 1 1 2 2 ALA H H 2 8.337 8.337 8.950 -0.613 25913
17 1 1 . 1 1 3 3 GLU N N 3 120.731 120.731 117.468 3.263 25913
18 1 1 . 1 1 3 3 GLU HA H 3 4.256 4.256 3.857 0.399 25913
19 1 1 . 1 1 3 3 GLU C C 3 176.186 176.186 175.901 0.285 25913
20 1 1 . 1 1 3 3 GLU CA C 3 56.377 56.377 58.918 -2.541 25913
21 1 1 . 1 1 3 3 GLU CB C 3 30.549 30.549 29.327 1.222 25913
22 1 1 . 1 1 3 3 GLU H H 3 8.274 8.274 8.451 -0.177 25913
23 1 1 . 1 1 4 4 ALA N N 4 125.716 125.716 119.613 6.103 25913
24 1 1 . 1 1 4 4 ALA HA H 4 4.345 4.345 3.969 0.376 25913
25 1 1 . 1 1 4 4 ALA C C 4 177.530 177.530 177.748 -0.218 25913
26 1 1 . 1 1 4 4 ALA CA C 4 52.413 52.413 52.652 -0.239 25913
27 1 1 . 1 1 4 4 ALA CB C 4 19.466 19.466 17.975 1.491 25913
28 1 1 . 1 1 4 4 ALA H H 4 8.271 8.271 7.998 0.273 25913
29 1 1 . 1 1 5 5 SER N N 5 117.161 117.161 115.096 2.065 25913
30 1 1 . 1 1 5 5 SER HA H 5 4.724 4.724 4.421 0.303 25913
31 1 1 . 1 1 5 5 SER C C 5 172.661 172.661 174.705 -2.044 25913
32 1 1 . 1 1 5 5 SER CA C 5 56.354 56.354 61.653 -5.299 25913
33 1 1 . 1 1 5 5 SER CB C 5 63.442 63.442 61.929 1.513 25913
34 1 1 . 1 1 5 5 SER H H 5 8.259 8.259 8.555 -0.296 25913
35 1 1 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.764 -0.350 25913
36 1 1 . 1 1 6 6 PRO C C 6 176.523 176.523 175.752 0.771 25913
37 1 1 . 1 1 6 6 PRO CA C 6 63.385 63.385 62.296 1.089 25913
38 1 1 . 1 1 6 6 PRO CB C 6 32.187 32.187 29.491 2.696 25913
39 1 1 . 1 1 7 7 HIS N N 7 120.170 120.170 120.113 0.057 25913
40 1 1 . 1 1 7 7 HIS HA H 7 4.980 4.980 5.132 -0.152 25913
41 1 1 . 1 1 7 7 HIS C C 7 172.577 172.577 174.264 -1.687 25913
42 1 1 . 1 1 7 7 HIS CA C 7 53.492 53.492 53.940 -0.448 25913
43 1 1 . 1 1 7 7 HIS CB C 7 29.133 29.133 29.296 -0.163 25913
44 1 1 . 1 1 7 7 HIS H H 7 8.489 8.489 8.358 0.131 25913
45 1 1 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.359 0.187 25913
46 1 1 . 1 1 8 8 PRO C C 8 177.382 177.382 175.953 1.429 25913
47 1 1 . 1 1 8 8 PRO CA C 8 63.443 63.443 62.924 0.519 25913
48 1 1 . 1 1 8 8 PRO CB C 8 32.377 32.377 32.455 -0.078 25913
49 1 1 . 1 1 9 9 GLY N N 9 110.263 110.263 106.500 3.763 25913
50 1 1 . 1 1 9 9 GLY C C 9 172.859 172.859 173.351 -0.492 25913
51 1 1 . 1 1 9 9 GLY CA C 9 45.211 45.211 45.823 -0.612 25913
52 1 1 . 1 1 9 9 GLY H H 9 8.635 8.635 8.768 -0.133 25913
53 1 1 . 1 1 10 10 ARG N N 10 121.025 121.025 123.257 -2.232 25913
54 1 1 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.495 0.287 25913
55 1 1 . 1 1 10 10 ARG C C 10 175.125 175.125 174.802 0.323 25913
56 1 1 . 1 1 10 10 ARG CA C 10 55.356 55.356 56.474 -1.118 25913
57 1 1 . 1 1 10 10 ARG CB C 10 32.982 32.982 28.792 4.190 25913
58 1 1 . 1 1 10 10 ARG H H 10 8.229 8.229 7.915 0.314 25913
59 1 1 . 1 1 11 11 TYR N N 11 121.353 121.353 123.913 -2.560 25913
60 1 1 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.758 -0.430 25913
61 1 1 . 1 1 11 11 TYR C C 11 174.229 174.229 174.930 -0.701 25913
62 1 1 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.032 1.017 25913
63 1 1 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.095 -0.044 25913
64 1 1 . 1 1 11 11 TYR H H 11 8.692 8.692 9.279 -0.587 25913
65 1 1 . 1 1 12 12 PHE N N 12 122.456 122.456 122.280 0.176 25913
66 1 1 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.327 -0.443 25913
67 1 1 . 1 1 12 12 PHE C C 12 174.224 174.224 174.843 -0.619 25913
68 1 1 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.419 0.600 25913
69 1 1 . 1 1 12 12 PHE CB C 12 44.078 44.078 41.979 2.099 25913
70 1 1 . 1 1 12 12 PHE H H 12 9.415 9.415 9.070 0.345 25913
71 1 1 . 1 1 13 13 CYS N N 13 128.438 128.438 128.508 -0.070 25913
72 1 1 . 1 1 13 13 CYS HA H 13 4.653 4.653 5.034 -0.381 25913
73 1 1 . 1 1 13 13 CYS C C 13 176.686 176.686 175.422 1.264 25913
74 1 1 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.538 0.790 25913
75 1 1 . 1 1 13 13 CYS CB C 13 31.220 31.220 28.037 3.183 25913
76 1 1 . 1 1 13 13 CYS H H 13 7.942 7.942 8.842 -0.900 25913
77 1 1 . 1 1 14 14 HIS N N 14 126.467 126.467 125.948 0.519 25913
78 1 1 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.529 -0.206 25913
79 1 1 . 1 1 14 14 HIS C C 14 175.452 175.452 176.348 -0.896 25913
80 1 1 . 1 1 14 14 HIS CA C 14 58.736 58.736 58.510 0.226 25913
81 1 1 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.610 -1.419 25913
82 1 1 . 1 1 14 14 HIS H H 14 8.971 8.971 9.480 -0.509 25913
83 1 1 . 1 1 15 15 CYS N N 15 123.882 123.882 118.778 5.104 25913
84 1 1 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.284 0.158 25913
85 1 1 . 1 1 15 15 CYS C C 15 176.939 176.939 176.187 0.752 25913
86 1 1 . 1 1 15 15 CYS CA C 15 61.704 61.704 61.040 0.664 25913
87 1 1 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.165 0.176 25913
88 1 1 . 1 1 15 15 CYS H H 15 9.195 9.195 8.268 0.927 25913
89 1 1 . 1 1 16 16 CYS N N 16 124.898 124.898 120.637 4.261 25913
90 1 1 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.462 -0.464 25913
91 1 1 . 1 1 16 16 CYS C C 16 175.557 175.557 174.730 0.827 25913
92 1 1 . 1 1 16 16 CYS CB C 16 30.961 30.961 27.265 3.696 25913
93 1 1 . 1 1 16 16 CYS H H 16 9.794 9.794 7.960 1.834 25913
94 1 1 . 1 1 17 17 SER N N 17 114.055 114.055 113.331 0.724 25913
95 1 1 . 1 1 17 17 SER HA H 17 3.755 3.755 4.093 -0.338 25913
96 1 1 . 1 1 17 17 SER C C 17 173.790 173.790 173.311 0.479 25913
97 1 1 . 1 1 17 17 SER CA C 17 58.868 58.868 59.339 -0.471 25913
98 1 1 . 1 1 17 17 SER CB C 17 61.703 61.703 60.583 1.120 25913
99 1 1 . 1 1 17 17 SER H H 17 7.950 7.950 8.039 -0.089 25913
100 1 1 . 1 1 18 18 VAL N N 18 111.916 111.916 112.840 -0.924 25913
101 1 1 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.296 0.162 25913
102 1 1 . 1 1 18 18 VAL C C 18 173.765 173.765 173.509 0.256 25913
103 1 1 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.324 -0.292 25913
104 1 1 . 1 1 18 18 VAL CB C 18 36.667 36.667 35.362 1.305 25913
105 1 1 . 1 1 18 18 VAL H H 18 6.438 6.438 7.045 -0.607 25913
106 1 1 . 1 1 19 19 GLU N N 19 123.431 123.431 122.508 0.923 25913
107 1 1 . 1 1 19 19 GLU HA H 19 5.023 5.023 5.070 -0.047 25913
108 1 1 . 1 1 19 19 GLU C C 19 176.506 176.506 175.963 0.543 25913
109 1 1 . 1 1 19 19 GLU CA C 19 56.818 56.818 56.258 0.560 25913
110 1 1 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.710 -0.545 25913
111 1 1 . 1 1 19 19 GLU H H 19 8.346 8.346 8.320 0.026 25913
112 1 1 . 1 1 20 20 ILE N N 20 117.751 117.751 121.732 -3.981 25913
113 1 1 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.629 0.112 25913
114 1 1 . 1 1 20 20 ILE C C 20 175.511 175.511 173.909 1.602 25913
115 1 1 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.526 -0.581 25913
116 1 1 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.899 2.768 25913
117 1 1 . 1 1 20 20 ILE H H 20 8.537 8.537 9.033 -0.496 25913
118 1 1 . 1 1 21 21 VAL N N 21 124.220 124.220 122.166 2.054 25913
119 1 1 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.051 -0.465 25913
120 1 1 . 1 1 21 21 VAL C C 21 174.640 174.640 174.174 0.466 25913
121 1 1 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.865 1.853 25913
122 1 1 . 1 1 21 21 VAL CB C 21 32.503 32.503 33.019 -0.516 25913
123 1 1 . 1 1 21 21 VAL H H 21 8.203 8.203 8.304 -0.101 25913
124 1 1 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.605 -0.546 25913
125 1 1 . 1 1 22 22 PRO C C 22 175.352 175.352 176.129 -0.777 25913
126 1 1 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.457 0.204 25913
127 1 1 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.459 -0.445 25913
128 1 1 . 1 1 23 23 ARG N N 23 121.370 121.370 122.842 -1.472 25913
129 1 1 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.195 0.060 25913
130 1 1 . 1 1 23 23 ARG C C 23 175.759 175.759 176.682 -0.923 25913
131 1 1 . 1 1 23 23 ARG CA C 23 56.052 56.052 56.120 -0.068 25913
132 1 1 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.186 1.700 25913
133 1 1 . 1 1 23 23 ARG H H 23 8.635 8.635 8.067 0.568 25913
134 1 1 . 1 1 24 24 LEU N N 24 127.914 127.914 127.365 0.549 25913
135 1 1 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.703 0.470 25913
136 1 1 . 1 1 24 24 LEU C C 24 175.774 175.774 175.917 -0.143 25913
137 1 1 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.445 -5.507 25913
138 1 1 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.233 2.187 25913
139 1 1 . 1 1 24 24 LEU H H 24 8.521 8.521 8.604 -0.083 25913
140 1 1 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.194 0.146 25913
141 1 1 . 1 1 25 25 PRO C C 25 176.386 176.386 176.946 -0.560 25913
142 1 1 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.434 -0.767 25913
143 1 1 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.750 2.926 25913
144 1 1 . 1 1 26 26 ASP N N 26 122.078 122.078 115.630 6.448 25913
145 1 1 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.672 -0.285 25913
146 1 1 . 1 1 26 26 ASP C C 26 175.321 175.321 176.145 -0.824 25913
147 1 1 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.353 2.002 25913
148 1 1 . 1 1 26 26 ASP CB C 26 41.066 41.066 43.321 -2.255 25913
149 1 1 . 1 1 26 26 ASP H H 26 8.752 8.752 7.763 0.989 25913
150 1 1 . 1 1 27 27 TYR N N 27 117.607 117.607 117.652 -0.045 25913
151 1 1 . 1 1 27 27 TYR HA H 27 3.449 3.449 4.005 -0.556 25913
152 1 1 . 1 1 27 27 TYR C C 27 173.074 173.074 174.303 -1.229 25913
153 1 1 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.460 0.977 25913
154 1 1 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.843 -0.783 25913
155 1 1 . 1 1 27 27 TYR H H 27 8.666 8.666 8.253 0.413 25913
156 1 1 . 1 1 28 28 ILE N N 28 111.804 111.804 112.544 -0.740 25913
157 1 1 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.495 0.280 25913
158 1 1 . 1 1 28 28 ILE C C 28 175.083 175.083 174.339 0.744 25913
159 1 1 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.043 -0.474 25913
160 1 1 . 1 1 28 28 ILE CB C 28 42.107 42.107 41.472 0.635 25913
161 1 1 . 1 1 28 28 ILE H H 28 6.761 6.761 7.304 -0.543 25913
162 1 1 . 1 1 29 29 CYS N N 29 126.875 126.875 118.639 8.236 25913
163 1 1 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.776 -0.368 25913
164 1 1 . 1 1 29 29 CYS C C 29 175.932 175.932 175.102 0.830 25913
165 1 1 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.672 0.730 25913
166 1 1 . 1 1 29 29 CYS CB C 29 32.214 32.214 28.080 4.134 25913
167 1 1 . 1 1 29 29 CYS H H 29 8.783 8.783 8.699 0.084 25913
168 1 1 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.442 -0.060 25913
169 1 1 . 1 1 30 30 PRO C C 30 176.824 176.824 177.336 -0.512 25913
170 1 1 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.454 -0.414 25913
171 1 1 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.903 0.441 25913
172 1 1 . 1 1 31 31 ARG N N 31 124.131 124.131 117.389 6.742 25913
173 1 1 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.459 -0.158 25913
174 1 1 . 1 1 31 31 ARG C C 31 177.721 177.721 177.186 0.535 25913
175 1 1 . 1 1 31 31 ARG CA C 31 58.190 58.190 57.721 0.469 25913
176 1 1 . 1 1 31 31 ARG CB C 31 31.682 31.682 31.011 0.671 25913
177 1 1 . 1 1 31 31 ARG H H 31 9.604 9.604 7.685 1.919 25913
178 1 1 . 1 1 32 32 CYS N N 32 119.758 119.758 114.155 5.603 25913
179 1 1 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.849 -0.010 25913
180 1 1 . 1 1 32 32 CYS C C 32 176.450 176.450 174.430 2.020 25913
181 1 1 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.626 1.084 25913
182 1 1 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.364 3.866 25913
183 1 1 . 1 1 32 32 CYS H H 32 8.549 8.549 7.770 0.779 25913
184 1 1 . 1 1 33 33 GLU N N 33 118.109 118.109 119.835 -1.726 25913
185 1 1 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.080 -0.002 25913
186 1 1 . 1 1 33 33 GLU C C 33 174.739 174.739 176.042 -1.303 25913
187 1 1 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.447 1.071 25913
188 1 1 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.346 -0.654 25913
189 1 1 . 1 1 33 33 GLU H H 33 7.868 7.868 8.133 -0.265 25913
190 1 1 . 1 1 34 34 SER N N 34 117.224 117.224 114.961 2.263 25913
191 1 1 . 1 1 34 34 SER HA H 34 4.437 4.437 4.521 -0.084 25913
192 1 1 . 1 1 34 34 SER C C 34 175.392 175.392 175.600 -0.208 25913
193 1 1 . 1 1 34 34 SER CA C 34 59.277 59.277 59.546 -0.269 25913
194 1 1 . 1 1 34 34 SER CB C 34 65.429 65.429 64.374 1.055 25913
195 1 1 . 1 1 34 34 SER H H 34 8.786 8.786 8.018 0.768 25913
196 1 1 . 1 1 35 35 GLY N N 35 111.095 111.095 107.555 3.540 25913
197 1 1 . 1 1 35 35 GLY C C 35 175.730 175.730 174.363 1.367 25913
198 1 1 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.686 0.555 25913
199 1 1 . 1 1 35 35 GLY H H 35 8.511 8.511 8.537 -0.026 25913
200 1 1 . 1 1 36 36 PHE N N 36 126.409 126.409 125.145 1.264 25913
201 1 1 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.387 0.764 25913
202 1 1 . 1 1 36 36 PHE C C 36 174.098 174.098 174.706 -0.608 25913
203 1 1 . 1 1 36 36 PHE CA C 36 55.269 55.269 59.038 -3.769 25913
204 1 1 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.521 -1.494 25913
205 1 1 . 1 1 36 36 PHE H H 36 8.850 8.850 7.680 1.170 25913
206 1 1 . 1 1 37 37 ILE N N 37 117.377 117.377 115.720 1.657 25913
207 1 1 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.349 0.007 25913
208 1 1 . 1 1 37 37 ILE C C 37 175.508 175.508 174.806 0.702 25913
209 1 1 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.651 0.036 25913
210 1 1 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.596 -1.448 25913
211 1 1 . 1 1 37 37 ILE H H 37 7.972 7.972 7.827 0.145 25913
212 1 1 . 1 1 38 38 GLU N N 38 124.869 124.869 122.841 2.028 25913
213 1 1 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.571 0.314 25913
214 1 1 . 1 1 38 38 GLU C C 38 174.300 174.300 175.282 -0.982 25913
215 1 1 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.900 -0.244 25913
216 1 1 . 1 1 38 38 GLU CB C 38 34.589 34.589 32.273 2.316 25913
217 1 1 . 1 1 38 38 GLU H H 38 9.131 9.131 8.760 0.371 25913
218 1 1 . 1 1 39 39 GLU N N 39 127.840 127.840 127.119 0.721 25913
219 1 1 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.199 0.649 25913
220 1 1 . 1 1 39 39 GLU C C 39 175.507 175.507 175.518 -0.011 25913
221 1 1 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.643 0.862 25913
222 1 1 . 1 1 39 39 GLU CB C 39 30.249 30.249 28.846 1.403 25913
223 1 1 . 1 1 39 39 GLU H H 39 8.844 8.844 8.653 0.191 25913
224 1 2 . 1 1 0 0 SER HA H 0 4.525 4.525 4.599 -0.074 25913
225 1 2 . 1 1 0 0 SER C C 0 174.776 174.776 174.278 0.498 25913
226 1 2 . 1 1 0 0 SER CA C 0 58.364 58.364 58.285 0.079 25913
227 1 2 . 1 1 0 0 SER CB C 0 64.049 64.049 63.804 0.245 25913
228 1 2 . 1 1 1 1 MET N N 1 123.174 123.174 119.457 3.717 25913
229 1 2 . 1 1 1 1 MET HA H 1 4.486 4.486 4.139 0.347 25913
230 1 2 . 1 1 1 1 MET C C 1 176.177 176.177 175.344 0.833 25913
231 1 2 . 1 1 1 1 MET CA C 1 55.804 55.804 56.158 -0.354 25913
232 1 2 . 1 1 1 1 MET CB C 1 32.941 32.941 30.981 1.960 25913
233 1 2 . 1 1 1 1 MET H H 1 8.592 8.592 8.728 -0.136 25913
234 1 2 . 1 1 2 2 ALA N N 2 125.785 125.785 120.779 5.006 25913
235 1 2 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.471 -0.178 25913
236 1 2 . 1 1 2 2 ALA C C 2 177.812 177.812 177.812 0.000 25913
237 1 2 . 1 1 2 2 ALA CA C 2 52.809 52.809 53.887 -1.078 25913
238 1 2 . 1 1 2 2 ALA CB C 2 19.224 19.224 19.597 -0.373 25913
239 1 2 . 1 1 2 2 ALA H H 2 8.337 8.337 7.987 0.350 25913
240 1 2 . 1 1 3 3 GLU N N 3 120.731 120.731 118.511 2.220 25913
241 1 2 . 1 1 3 3 GLU HA H 3 4.256 4.256 4.323 -0.067 25913
242 1 2 . 1 1 3 3 GLU C C 3 176.186 176.186 176.680 -0.494 25913
243 1 2 . 1 1 3 3 GLU CA C 3 56.377 56.377 56.369 0.008 25913
244 1 2 . 1 1 3 3 GLU CB C 3 30.549 30.549 28.834 1.715 25913
245 1 2 . 1 1 3 3 GLU H H 3 8.274 8.274 8.607 -0.333 25913
246 1 2 . 1 1 4 4 ALA N N 4 125.716 125.716 124.242 1.474 25913
247 1 2 . 1 1 4 4 ALA HA H 4 4.345 4.345 4.326 0.019 25913
248 1 2 . 1 1 4 4 ALA C C 4 177.530 177.530 176.849 0.681 25913
249 1 2 . 1 1 4 4 ALA CA C 4 52.413 52.413 52.697 -0.284 25913
250 1 2 . 1 1 4 4 ALA CB C 4 19.466 19.466 18.205 1.261 25913
251 1 2 . 1 1 4 4 ALA H H 4 8.271 8.271 7.821 0.450 25913
252 1 2 . 1 1 5 5 SER N N 5 117.161 117.161 116.798 0.363 25913
253 1 2 . 1 1 5 5 SER HA H 5 4.724 4.724 4.314 0.410 25913
254 1 2 . 1 1 5 5 SER C C 5 172.661 172.661 172.018 0.643 25913
255 1 2 . 1 1 5 5 SER CA C 5 56.354 56.354 57.919 -1.565 25913
256 1 2 . 1 1 5 5 SER CB C 5 63.442 63.442 62.072 1.370 25913
257 1 2 . 1 1 5 5 SER H H 5 8.259 8.259 8.565 -0.306 25913
258 1 2 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.257 0.157 25913
259 1 2 . 1 1 6 6 PRO C C 6 176.523 176.523 176.338 0.185 25913
260 1 2 . 1 1 6 6 PRO CA C 6 63.385 63.385 63.502 -0.117 25913
261 1 2 . 1 1 6 6 PRO CB C 6 32.187 32.187 32.165 0.022 25913
262 1 2 . 1 1 7 7 HIS N N 7 120.170 120.170 123.064 -2.894 25913
263 1 2 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.961 0.019 25913
264 1 2 . 1 1 7 7 HIS C C 7 172.577 172.577 173.578 -1.001 25913
265 1 2 . 1 1 7 7 HIS CA C 7 53.492 53.492 53.574 -0.082 25913
266 1 2 . 1 1 7 7 HIS CB C 7 29.133 29.133 30.498 -1.365 25913
267 1 2 . 1 1 7 7 HIS H H 7 8.489 8.489 8.088 0.401 25913
268 1 2 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.731 -0.185 25913
269 1 2 . 1 1 8 8 PRO C C 8 177.382 177.382 176.305 1.077 25913
270 1 2 . 1 1 8 8 PRO CA C 8 63.443 63.443 62.971 0.472 25913
271 1 2 . 1 1 8 8 PRO CB C 8 32.377 32.377 32.893 -0.516 25913
272 1 2 . 1 1 9 9 GLY N N 9 110.263 110.263 108.250 2.013 25913
273 1 2 . 1 1 9 9 GLY C C 9 172.859 172.859 173.388 -0.529 25913
274 1 2 . 1 1 9 9 GLY CA C 9 45.211 45.211 46.376 -1.165 25913
275 1 2 . 1 1 9 9 GLY H H 9 8.635 8.635 9.000 -0.365 25913
276 1 2 . 1 1 10 10 ARG N N 10 121.025 121.025 122.795 -1.770 25913
277 1 2 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.835 -0.053 25913
278 1 2 . 1 1 10 10 ARG C C 10 175.125 175.125 174.726 0.399 25913
279 1 2 . 1 1 10 10 ARG CA C 10 55.356 55.356 55.814 -0.458 25913
280 1 2 . 1 1 10 10 ARG CB C 10 32.982 32.982 29.500 3.482 25913
281 1 2 . 1 1 10 10 ARG H H 10 8.229 8.229 7.977 0.252 25913
282 1 2 . 1 1 11 11 TYR N N 11 121.353 121.353 123.868 -2.515 25913
283 1 2 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.647 -0.319 25913
284 1 2 . 1 1 11 11 TYR C C 11 174.229 174.229 174.656 -0.427 25913
285 1 2 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.084 0.965 25913
286 1 2 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.404 -0.353 25913
287 1 2 . 1 1 11 11 TYR H H 11 8.692 8.692 9.381 -0.689 25913
288 1 2 . 1 1 12 12 PHE N N 12 122.456 122.456 122.541 -0.085 25913
289 1 2 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.336 -0.452 25913
290 1 2 . 1 1 12 12 PHE C C 12 174.224 174.224 174.935 -0.711 25913
291 1 2 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.353 0.666 25913
292 1 2 . 1 1 12 12 PHE CB C 12 44.078 44.078 41.797 2.281 25913
293 1 2 . 1 1 12 12 PHE H H 12 9.415 9.415 9.140 0.275 25913
294 1 2 . 1 1 13 13 CYS N N 13 128.438 128.438 128.575 -0.137 25913
295 1 2 . 1 1 13 13 CYS HA H 13 4.653 4.653 4.976 -0.323 25913
296 1 2 . 1 1 13 13 CYS C C 13 176.686 176.686 175.218 1.468 25913
297 1 2 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.754 0.574 25913
298 1 2 . 1 1 13 13 CYS CB C 13 31.220 31.220 28.062 3.158 25913
299 1 2 . 1 1 13 13 CYS H H 13 7.942 7.942 9.002 -1.060 25913
300 1 2 . 1 1 14 14 HIS N N 14 126.467 126.467 126.126 0.341 25913
301 1 2 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.676 -0.353 25913
302 1 2 . 1 1 14 14 HIS C C 14 175.452 175.452 176.003 -0.551 25913
303 1 2 . 1 1 14 14 HIS CA C 14 58.736 58.736 57.657 1.079 25913
304 1 2 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.676 -1.485 25913
305 1 2 . 1 1 14 14 HIS H H 14 8.971 8.971 9.513 -0.542 25913
306 1 2 . 1 1 15 15 CYS N N 15 123.882 123.882 117.635 6.247 25913
307 1 2 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.409 0.033 25913
308 1 2 . 1 1 15 15 CYS C C 15 176.939 176.939 175.717 1.222 25913
309 1 2 . 1 1 15 15 CYS CA C 15 61.704 61.704 61.433 0.271 25913
310 1 2 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.525 -0.184 25913
311 1 2 . 1 1 15 15 CYS H H 15 9.195 9.195 8.238 0.957 25913
312 1 2 . 1 1 16 16 CYS N N 16 124.898 124.898 119.482 5.416 25913
313 1 2 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.580 -0.582 25913
314 1 2 . 1 1 16 16 CYS C C 16 175.557 175.557 174.550 1.007 25913
315 1 2 . 1 1 16 16 CYS CB C 16 30.961 30.961 27.820 3.141 25913
316 1 2 . 1 1 16 16 CYS H H 16 9.794 9.794 7.952 1.842 25913
317 1 2 . 1 1 17 17 SER N N 17 114.055 114.055 114.137 -0.082 25913
318 1 2 . 1 1 17 17 SER HA H 17 3.755 3.755 4.128 -0.373 25913
319 1 2 . 1 1 17 17 SER C C 17 173.790 173.790 173.279 0.511 25913
320 1 2 . 1 1 17 17 SER CA C 17 58.868 58.868 59.449 -0.581 25913
321 1 2 . 1 1 17 17 SER CB C 17 61.703 61.703 60.581 1.122 25913
322 1 2 . 1 1 17 17 SER H H 17 7.950 7.950 8.124 -0.174 25913
323 1 2 . 1 1 18 18 VAL N N 18 111.916 111.916 112.672 -0.756 25913
324 1 2 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.263 0.195 25913
325 1 2 . 1 1 18 18 VAL C C 18 173.765 173.765 173.405 0.360 25913
326 1 2 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.421 -0.389 25913
327 1 2 . 1 1 18 18 VAL CB C 18 36.667 36.667 35.508 1.159 25913
328 1 2 . 1 1 18 18 VAL H H 18 6.438 6.438 7.083 -0.645 25913
329 1 2 . 1 1 19 19 GLU N N 19 123.431 123.431 122.078 1.353 25913
330 1 2 . 1 1 19 19 GLU HA H 19 5.023 5.023 5.149 -0.126 25913
331 1 2 . 1 1 19 19 GLU C C 19 176.506 176.506 175.797 0.709 25913
332 1 2 . 1 1 19 19 GLU CA C 19 56.818 56.818 56.025 0.793 25913
333 1 2 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.577 -0.412 25913
334 1 2 . 1 1 19 19 GLU H H 19 8.346 8.346 8.329 0.017 25913
335 1 2 . 1 1 20 20 ILE N N 20 117.751 117.751 120.620 -2.869 25913
336 1 2 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.716 0.025 25913
337 1 2 . 1 1 20 20 ILE C C 20 175.511 175.511 174.029 1.482 25913
338 1 2 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.361 -0.416 25913
339 1 2 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.517 3.150 25913
340 1 2 . 1 1 20 20 ILE H H 20 8.537 8.537 8.895 -0.358 25913
341 1 2 . 1 1 21 21 VAL N N 21 124.220 124.220 122.231 1.989 25913
342 1 2 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.188 -0.602 25913
343 1 2 . 1 1 21 21 VAL C C 21 174.640 174.640 174.137 0.503 25913
344 1 2 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.820 1.898 25913
345 1 2 . 1 1 21 21 VAL CB C 21 32.503 32.503 32.675 -0.172 25913
346 1 2 . 1 1 21 21 VAL H H 21 8.203 8.203 8.376 -0.173 25913
347 1 2 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.649 -0.590 25913
348 1 2 . 1 1 22 22 PRO C C 22 175.352 175.352 176.118 -0.766 25913
349 1 2 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.693 -0.032 25913
350 1 2 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.331 -0.317 25913
351 1 2 . 1 1 23 23 ARG N N 23 121.370 121.370 122.467 -1.097 25913
352 1 2 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.224 0.031 25913
353 1 2 . 1 1 23 23 ARG C C 23 175.759 175.759 176.691 -0.932 25913
354 1 2 . 1 1 23 23 ARG CA C 23 56.052 56.052 56.030 0.022 25913
355 1 2 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.226 1.660 25913
356 1 2 . 1 1 23 23 ARG H H 23 8.635 8.635 8.101 0.534 25913
357 1 2 . 1 1 24 24 LEU N N 24 127.914 127.914 127.183 0.731 25913
358 1 2 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.786 0.387 25913
359 1 2 . 1 1 24 24 LEU C C 24 175.774 175.774 176.001 -0.227 25913
360 1 2 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.573 -5.635 25913
361 1 2 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.161 2.259 25913
362 1 2 . 1 1 24 24 LEU H H 24 8.521 8.521 8.692 -0.171 25913
363 1 2 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.159 0.181 25913
364 1 2 . 1 1 25 25 PRO C C 25 176.386 176.386 177.078 -0.692 25913
365 1 2 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.524 -0.857 25913
366 1 2 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.737 2.939 25913
367 1 2 . 1 1 26 26 ASP N N 26 122.078 122.078 114.403 7.675 25913
368 1 2 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.662 -0.275 25913
369 1 2 . 1 1 26 26 ASP C C 26 175.321 175.321 175.939 -0.618 25913
370 1 2 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.426 1.929 25913
371 1 2 . 1 1 26 26 ASP CB C 26 41.066 41.066 42.983 -1.917 25913
372 1 2 . 1 1 26 26 ASP H H 26 8.752 8.752 7.712 1.040 25913
373 1 2 . 1 1 27 27 TYR N N 27 117.607 117.607 118.002 -0.395 25913
374 1 2 . 1 1 27 27 TYR HA H 27 3.449 3.449 3.954 -0.505 25913
375 1 2 . 1 1 27 27 TYR C C 27 173.074 173.074 174.375 -1.301 25913
376 1 2 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.316 1.121 25913
377 1 2 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.621 -0.561 25913
378 1 2 . 1 1 27 27 TYR H H 27 8.666 8.666 8.086 0.580 25913
379 1 2 . 1 1 28 28 ILE N N 28 111.804 111.804 112.502 -0.698 25913
380 1 2 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.518 0.257 25913
381 1 2 . 1 1 28 28 ILE C C 28 175.083 175.083 174.742 0.341 25913
382 1 2 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.656 -1.087 25913
383 1 2 . 1 1 28 28 ILE CB C 28 42.107 42.107 40.970 1.137 25913
384 1 2 . 1 1 28 28 ILE H H 28 6.761 6.761 7.252 -0.491 25913
385 1 2 . 1 1 29 29 CYS N N 29 126.875 126.875 118.827 8.048 25913
386 1 2 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.755 -0.347 25913
387 1 2 . 1 1 29 29 CYS C C 29 175.932 175.932 175.004 0.928 25913
388 1 2 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.887 0.515 25913
389 1 2 . 1 1 29 29 CYS CB C 29 32.214 32.214 27.994 4.220 25913
390 1 2 . 1 1 29 29 CYS H H 29 8.783 8.783 8.715 0.068 25913
391 1 2 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.486 -0.104 25913
392 1 2 . 1 1 30 30 PRO C C 30 176.824 176.824 177.310 -0.486 25913
393 1 2 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.320 -0.280 25913
394 1 2 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.873 0.471 25913
395 1 2 . 1 1 31 31 ARG N N 31 124.131 124.131 117.587 6.544 25913
396 1 2 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.462 -0.161 25913
397 1 2 . 1 1 31 31 ARG C C 31 177.721 177.721 177.132 0.589 25913
398 1 2 . 1 1 31 31 ARG CA C 31 58.190 58.190 57.804 0.386 25913
399 1 2 . 1 1 31 31 ARG CB C 31 31.682 31.682 31.121 0.561 25913
400 1 2 . 1 1 31 31 ARG H H 31 9.604 9.604 7.676 1.928 25913
401 1 2 . 1 1 32 32 CYS N N 32 119.758 119.758 114.060 5.698 25913
402 1 2 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.838 0.001 25913
403 1 2 . 1 1 32 32 CYS C C 32 176.450 176.450 174.470 1.980 25913
404 1 2 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.628 1.082 25913
405 1 2 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.395 3.835 25913
406 1 2 . 1 1 32 32 CYS H H 32 8.549 8.549 7.764 0.785 25913
407 1 2 . 1 1 33 33 GLU N N 33 118.109 118.109 120.023 -1.914 25913
408 1 2 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.047 0.031 25913
409 1 2 . 1 1 33 33 GLU C C 33 174.739 174.739 176.045 -1.306 25913
410 1 2 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.516 1.002 25913
411 1 2 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.064 -0.372 25913
412 1 2 . 1 1 33 33 GLU H H 33 7.868 7.868 8.167 -0.299 25913
413 1 2 . 1 1 34 34 SER N N 34 117.224 117.224 114.820 2.404 25913
414 1 2 . 1 1 34 34 SER HA H 34 4.437 4.437 4.500 -0.063 25913
415 1 2 . 1 1 34 34 SER C C 34 175.392 175.392 175.474 -0.082 25913
416 1 2 . 1 1 34 34 SER CA C 34 59.277 59.277 59.517 -0.240 25913
417 1 2 . 1 1 34 34 SER CB C 34 65.429 65.429 64.393 1.036 25913
418 1 2 . 1 1 34 34 SER H H 34 8.786 8.786 8.063 0.723 25913
419 1 2 . 1 1 35 35 GLY N N 35 111.095 111.095 108.104 2.991 25913
420 1 2 . 1 1 35 35 GLY C C 35 175.730 175.730 174.345 1.385 25913
421 1 2 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.620 0.621 25913
422 1 2 . 1 1 35 35 GLY H H 35 8.511 8.511 8.444 0.067 25913
423 1 2 . 1 1 36 36 PHE N N 36 126.409 126.409 125.185 1.224 25913
424 1 2 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.427 0.724 25913
425 1 2 . 1 1 36 36 PHE C C 36 174.098 174.098 174.706 -0.608 25913
426 1 2 . 1 1 36 36 PHE CA C 36 55.269 55.269 59.112 -3.843 25913
427 1 2 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.550 -1.522 25913
428 1 2 . 1 1 36 36 PHE H H 36 8.850 8.850 7.673 1.177 25913
429 1 2 . 1 1 37 37 ILE N N 37 117.377 117.377 115.787 1.590 25913
430 1 2 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.362 -0.006 25913
431 1 2 . 1 1 37 37 ILE C C 37 175.508 175.508 174.821 0.687 25913
432 1 2 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.692 -0.005 25913
433 1 2 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.538 -1.390 25913
434 1 2 . 1 1 37 37 ILE H H 37 7.972 7.972 7.918 0.054 25913
435 1 2 . 1 1 38 38 GLU N N 38 124.869 124.869 123.286 1.583 25913
436 1 2 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.550 0.335 25913
437 1 2 . 1 1 38 38 GLU C C 38 174.300 174.300 175.410 -1.110 25913
438 1 2 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.885 -0.229 25913
439 1 2 . 1 1 38 38 GLU CB C 38 34.589 34.589 32.059 2.530 25913
440 1 2 . 1 1 38 38 GLU H H 38 9.131 9.131 8.837 0.294 25913
441 1 2 . 1 1 39 39 GLU N N 39 127.840 127.840 127.452 0.388 25913
442 1 2 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.096 0.752 25913
443 1 2 . 1 1 39 39 GLU C C 39 175.507 175.507 175.675 -0.168 25913
444 1 2 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.847 0.658 25913
445 1 2 . 1 1 39 39 GLU CB C 39 30.249 30.249 28.641 1.608 25913
446 1 2 . 1 1 39 39 GLU H H 39 8.844 8.844 8.665 0.179 25913
447 1 3 . 1 1 0 0 SER HA H 0 4.525 4.525 4.692 -0.167 25913
448 1 3 . 1 1 0 0 SER C C 0 174.776 174.776 174.733 0.043 25913
449 1 3 . 1 1 0 0 SER CA C 0 58.364 58.364 57.347 1.017 25913
450 1 3 . 1 1 0 0 SER CB C 0 64.049 64.049 65.074 -1.025 25913
451 1 3 . 1 1 1 1 MET N N 1 123.174 123.174 118.752 4.422 25913
452 1 3 . 1 1 1 1 MET HA H 1 4.486 4.486 4.043 0.443 25913
453 1 3 . 1 1 1 1 MET C C 1 176.177 176.177 175.912 0.265 25913
454 1 3 . 1 1 1 1 MET CA C 1 55.804 55.804 58.053 -2.249 25913
455 1 3 . 1 1 1 1 MET CB C 1 32.941 32.941 31.453 1.488 25913
456 1 3 . 1 1 1 1 MET H H 1 8.592 8.592 8.687 -0.095 25913
457 1 3 . 1 1 2 2 ALA N N 2 125.785 125.785 121.173 4.612 25913
458 1 3 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.514 -0.221 25913
459 1 3 . 1 1 2 2 ALA C C 2 177.812 177.812 177.654 0.158 25913
460 1 3 . 1 1 2 2 ALA CA C 2 52.809 52.809 51.844 0.965 25913
461 1 3 . 1 1 2 2 ALA CB C 2 19.224 19.224 19.556 -0.332 25913
462 1 3 . 1 1 2 2 ALA H H 2 8.337 8.337 8.076 0.261 25913
463 1 3 . 1 1 3 3 GLU N N 3 120.731 120.731 121.053 -0.322 25913
464 1 3 . 1 1 3 3 GLU HA H 3 4.256 4.256 4.365 -0.109 25913
465 1 3 . 1 1 3 3 GLU C C 3 176.186 176.186 176.071 0.115 25913
466 1 3 . 1 1 3 3 GLU CA C 3 56.377 56.377 55.434 0.943 25913
467 1 3 . 1 1 3 3 GLU CB C 3 30.549 30.549 31.056 -0.507 25913
468 1 3 . 1 1 3 3 GLU H H 3 8.274 8.274 7.523 0.751 25913
469 1 3 . 1 1 4 4 ALA N N 4 125.716 125.716 125.651 0.065 25913
470 1 3 . 1 1 4 4 ALA HA H 4 4.345 4.345 4.256 0.089 25913
471 1 3 . 1 1 4 4 ALA C C 4 177.530 177.530 177.186 0.344 25913
472 1 3 . 1 1 4 4 ALA CA C 4 52.413 52.413 52.373 0.040 25913
473 1 3 . 1 1 4 4 ALA CB C 4 19.466 19.466 19.236 0.230 25913
474 1 3 . 1 1 4 4 ALA H H 4 8.271 8.271 8.240 0.031 25913
475 1 3 . 1 1 5 5 SER N N 5 117.161 117.161 118.590 -1.429 25913
476 1 3 . 1 1 5 5 SER HA H 5 4.724 4.724 4.429 0.295 25913
477 1 3 . 1 1 5 5 SER C C 5 172.661 172.661 173.631 -0.970 25913
478 1 3 . 1 1 5 5 SER CA C 5 56.354 56.354 57.893 -1.539 25913
479 1 3 . 1 1 5 5 SER CB C 5 63.442 63.442 63.185 0.257 25913
480 1 3 . 1 1 5 5 SER H H 5 8.259 8.259 8.306 -0.047 25913
481 1 3 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.455 -0.041 25913
482 1 3 . 1 1 6 6 PRO C C 6 176.523 176.523 175.768 0.755 25913
483 1 3 . 1 1 6 6 PRO CA C 6 63.385 63.385 62.812 0.573 25913
484 1 3 . 1 1 6 6 PRO CB C 6 32.187 32.187 30.342 1.845 25913
485 1 3 . 1 1 7 7 HIS N N 7 120.170 120.170 120.989 -0.819 25913
486 1 3 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.780 0.200 25913
487 1 3 . 1 1 7 7 HIS C C 7 172.577 172.577 173.555 -0.978 25913
488 1 3 . 1 1 7 7 HIS CA C 7 53.492 53.492 53.433 0.059 25913
489 1 3 . 1 1 7 7 HIS CB C 7 29.133 29.133 30.088 -0.955 25913
490 1 3 . 1 1 7 7 HIS H H 7 8.489 8.489 8.100 0.389 25913
491 1 3 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.495 0.051 25913
492 1 3 . 1 1 8 8 PRO C C 8 177.382 177.382 176.731 0.651 25913
493 1 3 . 1 1 8 8 PRO CA C 8 63.443 63.443 63.654 -0.211 25913
494 1 3 . 1 1 8 8 PRO CB C 8 32.377 32.377 32.391 -0.014 25913
495 1 3 . 1 1 9 9 GLY N N 9 110.263 110.263 111.452 -1.189 25913
496 1 3 . 1 1 9 9 GLY C C 9 172.859 172.859 173.271 -0.412 25913
497 1 3 . 1 1 9 9 GLY CA C 9 45.211 45.211 45.970 -0.759 25913
498 1 3 . 1 1 9 9 GLY H H 9 8.635 8.635 8.959 -0.324 25913
499 1 3 . 1 1 10 10 ARG N N 10 121.025 121.025 122.952 -1.927 25913
500 1 3 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.834 -0.052 25913
501 1 3 . 1 1 10 10 ARG C C 10 175.125 175.125 174.906 0.219 25913
502 1 3 . 1 1 10 10 ARG CA C 10 55.356 55.356 55.930 -0.574 25913
503 1 3 . 1 1 10 10 ARG CB C 10 32.982 32.982 29.658 3.324 25913
504 1 3 . 1 1 10 10 ARG H H 10 8.229 8.229 8.021 0.208 25913
505 1 3 . 1 1 11 11 TYR N N 11 121.353 121.353 123.434 -2.081 25913
506 1 3 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.486 -0.158 25913
507 1 3 . 1 1 11 11 TYR C C 11 174.229 174.229 174.628 -0.399 25913
508 1 3 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.140 0.909 25913
509 1 3 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.593 -0.541 25913
510 1 3 . 1 1 11 11 TYR H H 11 8.692 8.692 9.373 -0.681 25913
511 1 3 . 1 1 12 12 PHE N N 12 122.456 122.456 122.086 0.370 25913
512 1 3 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.287 -0.403 25913
513 1 3 . 1 1 12 12 PHE C C 12 174.224 174.224 174.834 -0.610 25913
514 1 3 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.477 0.542 25913
515 1 3 . 1 1 12 12 PHE CB C 12 44.078 44.078 41.934 2.144 25913
516 1 3 . 1 1 12 12 PHE H H 12 9.415 9.415 8.921 0.494 25913
517 1 3 . 1 1 13 13 CYS N N 13 128.438 128.438 128.532 -0.094 25913
518 1 3 . 1 1 13 13 CYS HA H 13 4.653 4.653 4.949 -0.296 25913
519 1 3 . 1 1 13 13 CYS C C 13 176.686 176.686 175.168 1.518 25913
520 1 3 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.842 0.486 25913
521 1 3 . 1 1 13 13 CYS CB C 13 31.220 31.220 28.007 3.213 25913
522 1 3 . 1 1 13 13 CYS H H 13 7.942 7.942 8.967 -1.025 25913
523 1 3 . 1 1 14 14 HIS N N 14 126.467 126.467 126.549 -0.082 25913
524 1 3 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.670 -0.347 25913
525 1 3 . 1 1 14 14 HIS C C 14 175.452 175.452 176.313 -0.861 25913
526 1 3 . 1 1 14 14 HIS CA C 14 58.736 58.736 57.721 1.014 25913
527 1 3 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.407 -1.216 25913
528 1 3 . 1 1 14 14 HIS H H 14 8.971 8.971 9.565 -0.594 25913
529 1 3 . 1 1 15 15 CYS N N 15 123.882 123.882 117.831 6.051 25913
530 1 3 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.419 0.023 25913
531 1 3 . 1 1 15 15 CYS C C 15 176.939 176.939 175.767 1.172 25913
532 1 3 . 1 1 15 15 CYS CA C 15 61.704 61.704 61.360 0.344 25913
533 1 3 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.401 -0.059 25913
534 1 3 . 1 1 15 15 CYS H H 15 9.195 9.195 8.230 0.965 25913
535 1 3 . 1 1 16 16 CYS N N 16 124.898 124.898 119.790 5.108 25913
536 1 3 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.576 -0.578 25913
537 1 3 . 1 1 16 16 CYS C C 16 175.557 175.557 174.635 0.922 25913
538 1 3 . 1 1 16 16 CYS CB C 16 30.961 30.961 27.685 3.276 25913
539 1 3 . 1 1 16 16 CYS H H 16 9.794 9.794 7.971 1.823 25913
540 1 3 . 1 1 17 17 SER N N 17 114.055 114.055 114.005 0.050 25913
541 1 3 . 1 1 17 17 SER HA H 17 3.755 3.755 4.113 -0.358 25913
542 1 3 . 1 1 17 17 SER C C 17 173.790 173.790 173.263 0.527 25913
543 1 3 . 1 1 17 17 SER CA C 17 58.868 58.868 59.664 -0.796 25913
544 1 3 . 1 1 17 17 SER CB C 17 61.703 61.703 60.371 1.331 25913
545 1 3 . 1 1 17 17 SER H H 17 7.950 7.950 8.175 -0.225 25913
546 1 3 . 1 1 18 18 VAL N N 18 111.916 111.916 112.019 -0.103 25913
547 1 3 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.294 0.164 25913
548 1 3 . 1 1 18 18 VAL C C 18 173.765 173.765 173.665 0.100 25913
549 1 3 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.039 -0.007 25913
550 1 3 . 1 1 18 18 VAL CB C 18 36.667 36.667 35.351 1.316 25913
551 1 3 . 1 1 18 18 VAL H H 18 6.438 6.438 7.003 -0.565 25913
552 1 3 . 1 1 19 19 GLU N N 19 123.431 123.431 123.104 0.327 25913
553 1 3 . 1 1 19 19 GLU HA H 19 5.023 5.023 4.892 0.131 25913
554 1 3 . 1 1 19 19 GLU C C 19 176.506 176.506 175.908 0.598 25913
555 1 3 . 1 1 19 19 GLU CA C 19 56.818 56.818 56.487 0.331 25913
556 1 3 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.629 -0.464 25913
557 1 3 . 1 1 19 19 GLU H H 19 8.346 8.346 8.385 -0.039 25913
558 1 3 . 1 1 20 20 ILE N N 20 117.751 117.751 121.912 -4.161 25913
559 1 3 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.640 0.101 25913
560 1 3 . 1 1 20 20 ILE C C 20 175.511 175.511 173.940 1.571 25913
561 1 3 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.484 -0.539 25913
562 1 3 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.906 2.761 25913
563 1 3 . 1 1 20 20 ILE H H 20 8.537 8.537 8.998 -0.461 25913
564 1 3 . 1 1 21 21 VAL N N 21 124.220 124.220 122.022 2.198 25913
565 1 3 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.157 -0.571 25913
566 1 3 . 1 1 21 21 VAL C C 21 174.640 174.640 174.022 0.618 25913
567 1 3 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.803 1.915 25913
568 1 3 . 1 1 21 21 VAL CB C 21 32.503 32.503 32.976 -0.473 25913
569 1 3 . 1 1 21 21 VAL H H 21 8.203 8.203 8.364 -0.161 25913
570 1 3 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.676 -0.617 25913
571 1 3 . 1 1 22 22 PRO C C 22 175.352 175.352 176.156 -0.804 25913
572 1 3 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.623 0.038 25913
573 1 3 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.282 -0.268 25913
574 1 3 . 1 1 23 23 ARG N N 23 121.370 121.370 122.896 -1.526 25913
575 1 3 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.208 0.047 25913
576 1 3 . 1 1 23 23 ARG C C 23 175.759 175.759 176.674 -0.915 25913
577 1 3 . 1 1 23 23 ARG CA C 23 56.052 56.052 56.080 -0.028 25913
578 1 3 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.147 1.739 25913
579 1 3 . 1 1 23 23 ARG H H 23 8.635 8.635 8.084 0.551 25913
580 1 3 . 1 1 24 24 LEU N N 24 127.914 127.914 127.247 0.667 25913
581 1 3 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.729 0.444 25913
582 1 3 . 1 1 24 24 LEU C C 24 175.774 175.774 175.881 -0.107 25913
583 1 3 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.557 -5.619 25913
584 1 3 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.237 2.183 25913
585 1 3 . 1 1 24 24 LEU H H 24 8.521 8.521 8.598 -0.077 25913
586 1 3 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.169 0.171 25913
587 1 3 . 1 1 25 25 PRO C C 25 176.386 176.386 177.027 -0.641 25913
588 1 3 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.442 -0.775 25913
589 1 3 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.741 2.935 25913
590 1 3 . 1 1 26 26 ASP N N 26 122.078 122.078 115.751 6.327 25913
591 1 3 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.662 -0.275 25913
592 1 3 . 1 1 26 26 ASP C C 26 175.321 175.321 176.057 -0.736 25913
593 1 3 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.450 1.905 25913
594 1 3 . 1 1 26 26 ASP CB C 26 41.066 41.066 43.121 -2.055 25913
595 1 3 . 1 1 26 26 ASP H H 26 8.752 8.752 7.717 1.035 25913
596 1 3 . 1 1 27 27 TYR N N 27 117.607 117.607 117.511 0.096 25913
597 1 3 . 1 1 27 27 TYR HA H 27 3.449 3.449 3.992 -0.543 25913
598 1 3 . 1 1 27 27 TYR C C 27 173.074 173.074 174.286 -1.212 25913
599 1 3 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.381 1.056 25913
600 1 3 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.813 -0.753 25913
601 1 3 . 1 1 27 27 TYR H H 27 8.666 8.666 8.089 0.577 25913
602 1 3 . 1 1 28 28 ILE N N 28 111.804 111.804 112.434 -0.630 25913
603 1 3 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.482 0.293 25913
604 1 3 . 1 1 28 28 ILE C C 28 175.083 175.083 174.348 0.735 25913
605 1 3 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.017 -0.448 25913
606 1 3 . 1 1 28 28 ILE CB C 28 42.107 42.107 41.494 0.613 25913
607 1 3 . 1 1 28 28 ILE H H 28 6.761 6.761 7.297 -0.536 25913
608 1 3 . 1 1 29 29 CYS N N 29 126.875 126.875 118.705 8.170 25913
609 1 3 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.774 -0.366 25913
610 1 3 . 1 1 29 29 CYS C C 29 175.932 175.932 175.151 0.781 25913
611 1 3 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.668 0.734 25913
612 1 3 . 1 1 29 29 CYS CB C 29 32.214 32.214 28.087 4.127 25913
613 1 3 . 1 1 29 29 CYS H H 29 8.783 8.783 8.705 0.078 25913
614 1 3 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.403 -0.021 25913
615 1 3 . 1 1 30 30 PRO C C 30 176.824 176.824 177.727 -0.903 25913
616 1 3 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.715 -0.675 25913
617 1 3 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.967 0.377 25913
618 1 3 . 1 1 31 31 ARG N N 31 124.131 124.131 117.183 6.948 25913
619 1 3 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.420 -0.119 25913
620 1 3 . 1 1 31 31 ARG C C 31 177.721 177.721 177.293 0.428 25913
621 1 3 . 1 1 31 31 ARG CA C 31 58.190 58.190 58.099 0.091 25913
622 1 3 . 1 1 31 31 ARG CB C 31 31.682 31.682 30.740 0.942 25913
623 1 3 . 1 1 31 31 ARG H H 31 9.604 9.604 7.766 1.838 25913
624 1 3 . 1 1 32 32 CYS N N 32 119.758 119.758 113.533 6.225 25913
625 1 3 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.853 -0.014 25913
626 1 3 . 1 1 32 32 CYS C C 32 176.450 176.450 174.421 2.029 25913
627 1 3 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.574 1.136 25913
628 1 3 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.330 3.900 25913
629 1 3 . 1 1 32 32 CYS H H 32 8.549 8.549 7.759 0.790 25913
630 1 3 . 1 1 33 33 GLU N N 33 118.109 118.109 119.751 -1.642 25913
631 1 3 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.033 0.045 25913
632 1 3 . 1 1 33 33 GLU C C 33 174.739 174.739 176.072 -1.333 25913
633 1 3 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.570 0.948 25913
634 1 3 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.087 -0.395 25913
635 1 3 . 1 1 33 33 GLU H H 33 7.868 7.868 8.235 -0.367 25913
636 1 3 . 1 1 34 34 SER N N 34 117.224 117.224 114.781 2.443 25913
637 1 3 . 1 1 34 34 SER HA H 34 4.437 4.437 4.465 -0.028 25913
638 1 3 . 1 1 34 34 SER C C 34 175.392 175.392 175.512 -0.120 25913
639 1 3 . 1 1 34 34 SER CA C 34 59.277 59.277 59.826 -0.549 25913
640 1 3 . 1 1 34 34 SER CB C 34 65.429 65.429 64.332 1.097 25913
641 1 3 . 1 1 34 34 SER H H 34 8.786 8.786 7.997 0.789 25913
642 1 3 . 1 1 35 35 GLY N N 35 111.095 111.095 107.662 3.433 25913
643 1 3 . 1 1 35 35 GLY C C 35 175.730 175.730 174.256 1.474 25913
644 1 3 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.603 0.638 25913
645 1 3 . 1 1 35 35 GLY H H 35 8.511 8.511 8.485 0.026 25913
646 1 3 . 1 1 36 36 PHE N N 36 126.409 126.409 125.354 1.055 25913
647 1 3 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.432 0.719 25913
648 1 3 . 1 1 36 36 PHE C C 36 174.098 174.098 174.318 -0.220 25913
649 1 3 . 1 1 36 36 PHE CA C 36 55.269 55.269 59.528 -4.259 25913
650 1 3 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.674 -1.647 25913
651 1 3 . 1 1 36 36 PHE H H 36 8.850 8.850 7.608 1.242 25913
652 1 3 . 1 1 37 37 ILE N N 37 117.377 117.377 116.280 1.097 25913
653 1 3 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.277 0.079 25913
654 1 3 . 1 1 37 37 ILE C C 37 175.508 175.508 174.838 0.670 25913
655 1 3 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.715 -0.028 25913
656 1 3 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.483 -1.335 25913
657 1 3 . 1 1 37 37 ILE H H 37 7.972 7.972 7.900 0.072 25913
658 1 3 . 1 1 38 38 GLU N N 38 124.869 124.869 123.210 1.659 25913
659 1 3 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.554 0.331 25913
660 1 3 . 1 1 38 38 GLU C C 38 174.300 174.300 175.488 -1.188 25913
661 1 3 . 1 1 38 38 GLU CA C 38 54.656 54.656 53.941 0.715 25913
662 1 3 . 1 1 38 38 GLU CB C 38 34.589 34.589 31.087 3.502 25913
663 1 3 . 1 1 38 38 GLU H H 38 9.131 9.131 8.886 0.245 25913
664 1 3 . 1 1 39 39 GLU N N 39 127.840 127.840 127.263 0.577 25913
665 1 3 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.256 0.592 25913
666 1 3 . 1 1 39 39 GLU C C 39 175.507 175.507 175.695 -0.188 25913
667 1 3 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.898 0.608 25913
668 1 3 . 1 1 39 39 GLU CB C 39 30.249 30.249 28.896 1.353 25913
669 1 3 . 1 1 39 39 GLU H H 39 8.844 8.844 8.607 0.237 25913
670 1 4 . 1 1 0 0 SER HA H 0 4.525 4.525 4.774 -0.249 25913
671 1 4 . 1 1 0 0 SER C C 0 174.776 174.776 173.176 1.600 25913
672 1 4 . 1 1 0 0 SER CA C 0 58.364 58.364 58.008 0.356 25913
673 1 4 . 1 1 0 0 SER CB C 0 64.049 64.049 64.281 -0.232 25913
674 1 4 . 1 1 1 1 MET N N 1 123.174 123.174 124.196 -1.022 25913
675 1 4 . 1 1 1 1 MET HA H 1 4.486 4.486 4.635 -0.149 25913
676 1 4 . 1 1 1 1 MET C C 1 176.177 176.177 176.759 -0.582 25913
677 1 4 . 1 1 1 1 MET CA C 1 55.804 55.804 55.121 0.683 25913
678 1 4 . 1 1 1 1 MET CB C 1 32.941 32.941 33.226 -0.285 25913
679 1 4 . 1 1 1 1 MET H H 1 8.592 8.592 8.598 -0.007 25913
680 1 4 . 1 1 2 2 ALA N N 2 125.785 125.785 126.945 -1.160 25913
681 1 4 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.404 -0.111 25913
682 1 4 . 1 1 2 2 ALA C C 2 177.812 177.812 177.550 0.262 25913
683 1 4 . 1 1 2 2 ALA CA C 2 52.809 52.809 52.528 0.281 25913
684 1 4 . 1 1 2 2 ALA CB C 2 19.224 19.224 18.763 0.461 25913
685 1 4 . 1 1 2 2 ALA H H 2 8.337 8.337 8.629 -0.292 25913
686 1 4 . 1 1 3 3 GLU N N 3 120.731 120.731 119.005 1.726 25913
687 1 4 . 1 1 3 3 GLU HA H 3 4.256 4.256 4.163 0.093 25913
688 1 4 . 1 1 3 3 GLU C C 3 176.186 176.186 176.455 -0.269 25913
689 1 4 . 1 1 3 3 GLU CA C 3 56.377 56.377 57.491 -1.114 25913
690 1 4 . 1 1 3 3 GLU CB C 3 30.549 30.549 29.723 0.826 25913
691 1 4 . 1 1 3 3 GLU H H 3 8.274 8.274 8.397 -0.123 25913
692 1 4 . 1 1 4 4 ALA N N 4 125.716 125.716 123.062 2.654 25913
693 1 4 . 1 1 4 4 ALA HA H 4 4.345 4.345 4.501 -0.156 25913
694 1 4 . 1 1 4 4 ALA C C 4 177.530 177.530 177.229 0.301 25913
695 1 4 . 1 1 4 4 ALA CA C 4 52.413 52.413 51.746 0.667 25913
696 1 4 . 1 1 4 4 ALA CB C 4 19.466 19.466 19.427 0.039 25913
697 1 4 . 1 1 4 4 ALA H H 4 8.271 8.271 7.684 0.587 25913
698 1 4 . 1 1 5 5 SER N N 5 117.161 117.161 119.305 -2.144 25913
699 1 4 . 1 1 5 5 SER HA H 5 4.724 4.724 4.747 -0.023 25913
700 1 4 . 1 1 5 5 SER C C 5 172.661 172.661 173.921 -1.260 25913
701 1 4 . 1 1 5 5 SER CA C 5 56.354 56.354 56.472 -0.118 25913
702 1 4 . 1 1 5 5 SER CB C 5 63.442 63.442 63.182 0.260 25913
703 1 4 . 1 1 5 5 SER H H 5 8.259 8.259 8.540 -0.281 25913
704 1 4 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.452 -0.038 25913
705 1 4 . 1 1 6 6 PRO C C 6 176.523 176.523 175.991 0.532 25913
706 1 4 . 1 1 6 6 PRO CA C 6 63.385 63.385 63.323 0.062 25913
707 1 4 . 1 1 6 6 PRO CB C 6 32.187 32.187 31.924 0.263 25913
708 1 4 . 1 1 7 7 HIS N N 7 120.170 120.170 117.424 2.746 25913
709 1 4 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.383 0.597 25913
710 1 4 . 1 1 7 7 HIS C C 7 172.577 172.577 172.732 -0.155 25913
711 1 4 . 1 1 7 7 HIS CA C 7 53.492 53.492 55.285 -1.792 25913
712 1 4 . 1 1 7 7 HIS CB C 7 29.133 29.133 29.537 -0.404 25913
713 1 4 . 1 1 7 7 HIS H H 7 8.489 8.489 7.860 0.629 25913
714 1 4 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.471 0.075 25913
715 1 4 . 1 1 8 8 PRO C C 8 177.382 177.382 176.202 1.180 25913
716 1 4 . 1 1 8 8 PRO CA C 8 63.443 63.443 63.390 0.053 25913
717 1 4 . 1 1 8 8 PRO CB C 8 32.377 32.377 31.951 0.425 25913
718 1 4 . 1 1 9 9 GLY N N 9 110.263 110.263 108.815 1.448 25913
719 1 4 . 1 1 9 9 GLY C C 9 172.859 172.859 173.258 -0.399 25913
720 1 4 . 1 1 9 9 GLY CA C 9 45.211 45.211 45.804 -0.593 25913
721 1 4 . 1 1 9 9 GLY H H 9 8.635 8.635 8.881 -0.246 25913
722 1 4 . 1 1 10 10 ARG N N 10 121.025 121.025 122.782 -1.757 25913
723 1 4 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.636 0.146 25913
724 1 4 . 1 1 10 10 ARG C C 10 175.125 175.125 174.843 0.282 25913
725 1 4 . 1 1 10 10 ARG CA C 10 55.356 55.356 56.132 -0.776 25913
726 1 4 . 1 1 10 10 ARG CB C 10 32.982 32.982 28.847 4.135 25913
727 1 4 . 1 1 10 10 ARG H H 10 8.229 8.229 7.913 0.316 25913
728 1 4 . 1 1 11 11 TYR N N 11 121.353 121.353 123.832 -2.479 25913
729 1 4 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.600 -0.272 25913
730 1 4 . 1 1 11 11 TYR C C 11 174.229 174.229 174.809 -0.580 25913
731 1 4 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.238 0.811 25913
732 1 4 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.348 -0.297 25913
733 1 4 . 1 1 11 11 TYR H H 11 8.692 8.692 9.356 -0.664 25913
734 1 4 . 1 1 12 12 PHE N N 12 122.456 122.456 122.195 0.261 25913
735 1 4 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.304 -0.420 25913
736 1 4 . 1 1 12 12 PHE C C 12 174.224 174.224 174.646 -0.422 25913
737 1 4 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.363 0.656 25913
738 1 4 . 1 1 12 12 PHE CB C 12 44.078 44.078 41.971 2.107 25913
739 1 4 . 1 1 12 12 PHE H H 12 9.415 9.415 9.232 0.183 25913
740 1 4 . 1 1 13 13 CYS N N 13 128.438 128.438 128.509 -0.071 25913
741 1 4 . 1 1 13 13 CYS HA H 13 4.653 4.653 5.066 -0.413 25913
742 1 4 . 1 1 13 13 CYS C C 13 176.686 176.686 175.260 1.426 25913
743 1 4 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.525 0.803 25913
744 1 4 . 1 1 13 13 CYS CB C 13 31.220 31.220 28.317 2.903 25913
745 1 4 . 1 1 13 13 CYS H H 13 7.942 7.942 8.934 -0.992 25913
746 1 4 . 1 1 14 14 HIS N N 14 126.467 126.467 126.018 0.449 25913
747 1 4 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.642 -0.319 25913
748 1 4 . 1 1 14 14 HIS C C 14 175.452 175.452 176.043 -0.591 25913
749 1 4 . 1 1 14 14 HIS CA C 14 58.736 58.736 58.294 0.442 25913
750 1 4 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.559 -1.368 25913
751 1 4 . 1 1 14 14 HIS H H 14 8.971 8.971 9.468 -0.497 25913
752 1 4 . 1 1 15 15 CYS N N 15 123.882 123.882 117.373 6.509 25913
753 1 4 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.433 0.009 25913
754 1 4 . 1 1 15 15 CYS C C 15 176.939 176.939 175.730 1.209 25913
755 1 4 . 1 1 15 15 CYS CA C 15 61.704 61.704 61.225 0.479 25913
756 1 4 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.380 -0.039 25913
757 1 4 . 1 1 15 15 CYS H H 15 9.195 9.195 8.220 0.975 25913
758 1 4 . 1 1 16 16 CYS N N 16 124.898 124.898 119.446 5.452 25913
759 1 4 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.577 -0.579 25913
760 1 4 . 1 1 16 16 CYS C C 16 175.557 175.557 174.592 0.965 25913
761 1 4 . 1 1 16 16 CYS CB C 16 30.961 30.961 27.939 3.022 25913
762 1 4 . 1 1 16 16 CYS H H 16 9.794 9.794 7.923 1.871 25913
763 1 4 . 1 1 17 17 SER N N 17 114.055 114.055 114.576 -0.521 25913
764 1 4 . 1 1 17 17 SER HA H 17 3.755 3.755 3.996 -0.241 25913
765 1 4 . 1 1 17 17 SER C C 17 173.790 173.790 173.176 0.614 25913
766 1 4 . 1 1 17 17 SER CA C 17 58.868 58.868 59.678 -0.810 25913
767 1 4 . 1 1 17 17 SER CB C 17 61.703 61.703 60.372 1.331 25913
768 1 4 . 1 1 17 17 SER H H 17 7.950 7.950 8.261 -0.311 25913
769 1 4 . 1 1 18 18 VAL N N 18 111.916 111.916 111.956 -0.040 25913
770 1 4 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.295 0.163 25913
771 1 4 . 1 1 18 18 VAL C C 18 173.765 173.765 173.698 0.067 25913
772 1 4 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.151 -0.119 25913
773 1 4 . 1 1 18 18 VAL CB C 18 36.667 36.667 35.457 1.210 25913
774 1 4 . 1 1 18 18 VAL H H 18 6.438 6.438 7.008 -0.570 25913
775 1 4 . 1 1 19 19 GLU N N 19 123.431 123.431 122.229 1.202 25913
776 1 4 . 1 1 19 19 GLU HA H 19 5.023 5.023 5.155 -0.132 25913
777 1 4 . 1 1 19 19 GLU C C 19 176.506 176.506 176.021 0.485 25913
778 1 4 . 1 1 19 19 GLU CA C 19 56.818 56.818 56.150 0.668 25913
779 1 4 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.552 -0.387 25913
780 1 4 . 1 1 19 19 GLU H H 19 8.346 8.346 8.416 -0.070 25913
781 1 4 . 1 1 20 20 ILE N N 20 117.751 117.751 121.131 -3.380 25913
782 1 4 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.786 -0.045 25913
783 1 4 . 1 1 20 20 ILE C C 20 175.511 175.511 173.903 1.608 25913
784 1 4 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.327 -0.382 25913
785 1 4 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.842 2.825 25913
786 1 4 . 1 1 20 20 ILE H H 20 8.537 8.537 8.803 -0.266 25913
787 1 4 . 1 1 21 21 VAL N N 21 124.220 124.220 121.407 2.813 25913
788 1 4 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.200 -0.614 25913
789 1 4 . 1 1 21 21 VAL C C 21 174.640 174.640 174.111 0.529 25913
790 1 4 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.864 1.854 25913
791 1 4 . 1 1 21 21 VAL CB C 21 32.503 32.503 34.069 -1.566 25913
792 1 4 . 1 1 21 21 VAL H H 21 8.203 8.203 8.349 -0.146 25913
793 1 4 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.654 -0.595 25913
794 1 4 . 1 1 22 22 PRO C C 22 175.352 175.352 176.139 -0.787 25913
795 1 4 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.850 -0.189 25913
796 1 4 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.223 -0.209 25913
797 1 4 . 1 1 23 23 ARG N N 23 121.370 121.370 123.365 -1.995 25913
798 1 4 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.194 0.061 25913
799 1 4 . 1 1 23 23 ARG C C 23 175.759 175.759 176.708 -0.949 25913
800 1 4 . 1 1 23 23 ARG CA C 23 56.052 56.052 56.106 -0.054 25913
801 1 4 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.368 1.518 25913
802 1 4 . 1 1 23 23 ARG H H 23 8.635 8.635 8.200 0.435 25913
803 1 4 . 1 1 24 24 LEU N N 24 127.914 127.914 126.154 1.760 25913
804 1 4 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.639 0.534 25913
805 1 4 . 1 1 24 24 LEU C C 24 175.774 175.774 176.153 -0.379 25913
806 1 4 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.434 -5.496 25913
807 1 4 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.276 2.144 25913
808 1 4 . 1 1 24 24 LEU H H 24 8.521 8.521 8.696 -0.175 25913
809 1 4 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.168 0.172 25913
810 1 4 . 1 1 25 25 PRO C C 25 176.386 176.386 176.995 -0.609 25913
811 1 4 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.935 -1.268 25913
812 1 4 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.683 2.993 25913
813 1 4 . 1 1 26 26 ASP N N 26 122.078 122.078 113.826 8.252 25913
814 1 4 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.692 -0.305 25913
815 1 4 . 1 1 26 26 ASP C C 26 175.321 175.321 175.570 -0.249 25913
816 1 4 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.347 2.007 25913
817 1 4 . 1 1 26 26 ASP CB C 26 41.066 41.066 42.135 -1.069 25913
818 1 4 . 1 1 26 26 ASP H H 26 8.752 8.752 7.640 1.112 25913
819 1 4 . 1 1 27 27 TYR N N 27 117.607 117.607 117.449 0.158 25913
820 1 4 . 1 1 27 27 TYR HA H 27 3.449 3.449 4.031 -0.582 25913
821 1 4 . 1 1 27 27 TYR C C 27 173.074 173.074 174.574 -1.500 25913
822 1 4 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.318 1.119 25913
823 1 4 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.631 -0.571 25913
824 1 4 . 1 1 27 27 TYR H H 27 8.666 8.666 7.987 0.679 25913
825 1 4 . 1 1 28 28 ILE N N 28 111.804 111.804 112.757 -0.953 25913
826 1 4 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.531 0.244 25913
827 1 4 . 1 1 28 28 ILE C C 28 175.083 175.083 174.869 0.214 25913
828 1 4 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.638 -1.069 25913
829 1 4 . 1 1 28 28 ILE CB C 28 42.107 42.107 40.830 1.277 25913
830 1 4 . 1 1 28 28 ILE H H 28 6.761 6.761 7.332 -0.571 25913
831 1 4 . 1 1 29 29 CYS N N 29 126.875 126.875 118.808 8.067 25913
832 1 4 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.763 -0.355 25913
833 1 4 . 1 1 29 29 CYS C C 29 175.932 175.932 175.060 0.872 25913
834 1 4 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.895 0.507 25913
835 1 4 . 1 1 29 29 CYS CB C 29 32.214 32.214 27.950 4.264 25913
836 1 4 . 1 1 29 29 CYS H H 29 8.783 8.783 8.706 0.077 25913
837 1 4 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.472 -0.090 25913
838 1 4 . 1 1 30 30 PRO C C 30 176.824 176.824 177.205 -0.381 25913
839 1 4 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.429 -0.389 25913
840 1 4 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.958 0.386 25913
841 1 4 . 1 1 31 31 ARG N N 31 124.131 124.131 116.890 7.241 25913
842 1 4 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.424 -0.123 25913
843 1 4 . 1 1 31 31 ARG C C 31 177.721 177.721 177.182 0.539 25913
844 1 4 . 1 1 31 31 ARG CA C 31 58.190 58.190 57.751 0.439 25913
845 1 4 . 1 1 31 31 ARG CB C 31 31.682 31.682 30.990 0.692 25913
846 1 4 . 1 1 31 31 ARG H H 31 9.604 9.604 7.671 1.933 25913
847 1 4 . 1 1 32 32 CYS N N 32 119.758 119.758 113.910 5.848 25913
848 1 4 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.841 -0.002 25913
849 1 4 . 1 1 32 32 CYS C C 32 176.450 176.450 174.485 1.965 25913
850 1 4 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.633 1.077 25913
851 1 4 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.296 3.934 25913
852 1 4 . 1 1 32 32 CYS H H 32 8.549 8.549 7.782 0.767 25913
853 1 4 . 1 1 33 33 GLU N N 33 118.109 118.109 119.856 -1.747 25913
854 1 4 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.056 0.022 25913
855 1 4 . 1 1 33 33 GLU C C 33 174.739 174.739 176.086 -1.347 25913
856 1 4 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.558 0.960 25913
857 1 4 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.150 -0.458 25913
858 1 4 . 1 1 33 33 GLU H H 33 7.868 7.868 8.188 -0.320 25913
859 1 4 . 1 1 34 34 SER N N 34 117.224 117.224 114.843 2.381 25913
860 1 4 . 1 1 34 34 SER HA H 34 4.437 4.437 4.487 -0.050 25913
861 1 4 . 1 1 34 34 SER C C 34 175.392 175.392 175.521 -0.129 25913
862 1 4 . 1 1 34 34 SER CA C 34 59.277 59.277 59.758 -0.481 25913
863 1 4 . 1 1 34 34 SER CB C 34 65.429 65.429 64.376 1.053 25913
864 1 4 . 1 1 34 34 SER H H 34 8.786 8.786 8.028 0.758 25913
865 1 4 . 1 1 35 35 GLY N N 35 111.095 111.095 107.855 3.240 25913
866 1 4 . 1 1 35 35 GLY C C 35 175.730 175.730 174.337 1.393 25913
867 1 4 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.609 0.632 25913
868 1 4 . 1 1 35 35 GLY H H 35 8.511 8.511 8.451 0.060 25913
869 1 4 . 1 1 36 36 PHE N N 36 126.409 126.409 125.141 1.268 25913
870 1 4 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.465 0.686 25913
871 1 4 . 1 1 36 36 PHE C C 36 174.098 174.098 174.737 -0.639 25913
872 1 4 . 1 1 36 36 PHE CA C 36 55.269 55.269 59.129 -3.860 25913
873 1 4 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.680 -1.653 25913
874 1 4 . 1 1 36 36 PHE H H 36 8.850 8.850 7.653 1.197 25913
875 1 4 . 1 1 37 37 ILE N N 37 117.377 117.377 116.261 1.116 25913
876 1 4 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.456 -0.100 25913
877 1 4 . 1 1 37 37 ILE C C 37 175.508 175.508 174.863 0.645 25913
878 1 4 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.768 -0.081 25913
879 1 4 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.543 -1.395 25913
880 1 4 . 1 1 37 37 ILE H H 37 7.972 7.972 7.906 0.066 25913
881 1 4 . 1 1 38 38 GLU N N 38 124.869 124.869 123.507 1.362 25913
882 1 4 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.649 0.236 25913
883 1 4 . 1 1 38 38 GLU C C 38 174.300 174.300 175.313 -1.013 25913
884 1 4 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.906 -0.250 25913
885 1 4 . 1 1 38 38 GLU CB C 38 34.589 34.589 32.598 1.991 25913
886 1 4 . 1 1 38 38 GLU H H 38 9.131 9.131 8.983 0.148 25913
887 1 4 . 1 1 39 39 GLU N N 39 127.840 127.840 126.537 1.303 25913
888 1 4 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.262 0.586 25913
889 1 4 . 1 1 39 39 GLU C C 39 175.507 175.507 175.480 0.027 25913
890 1 4 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.759 0.746 25913
891 1 4 . 1 1 39 39 GLU CB C 39 30.249 30.249 29.229 1.020 25913
892 1 4 . 1 1 39 39 GLU H H 39 8.844 8.844 8.622 0.222 25913
893 1 5 . 1 1 0 0 SER HA H 0 4.525 4.525 4.434 0.091 25913
894 1 5 . 1 1 0 0 SER C C 0 174.776 174.776 174.181 0.595 25913
895 1 5 . 1 1 0 0 SER CA C 0 58.364 58.364 59.158 -0.794 25913
896 1 5 . 1 1 0 0 SER CB C 0 64.049 64.049 63.366 0.683 25913
897 1 5 . 1 1 1 1 MET N N 1 123.174 123.174 126.454 -3.280 25913
898 1 5 . 1 1 1 1 MET HA H 1 4.486 4.486 4.645 -0.159 25913
899 1 5 . 1 1 1 1 MET C C 1 176.177 176.177 175.128 1.049 25913
900 1 5 . 1 1 1 1 MET CA C 1 55.804 55.804 55.452 0.352 25913
901 1 5 . 1 1 1 1 MET CB C 1 32.941 32.941 33.904 -0.963 25913
902 1 5 . 1 1 1 1 MET H H 1 8.592 8.592 8.426 0.166 25913
903 1 5 . 1 1 2 2 ALA N N 2 125.785 125.785 124.352 1.433 25913
904 1 5 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.377 -0.084 25913
905 1 5 . 1 1 2 2 ALA C C 2 177.812 177.812 177.763 0.049 25913
906 1 5 . 1 1 2 2 ALA CA C 2 52.809 52.809 52.995 -0.186 25913
907 1 5 . 1 1 2 2 ALA CB C 2 19.224 19.224 18.558 0.666 25913
908 1 5 . 1 1 2 2 ALA H H 2 8.337 8.337 8.359 -0.022 25913
909 1 5 . 1 1 3 3 GLU N N 3 120.731 120.731 119.335 1.396 25913
910 1 5 . 1 1 3 3 GLU HA H 3 4.256 4.256 4.161 0.095 25913
911 1 5 . 1 1 3 3 GLU C C 3 176.186 176.186 176.845 -0.659 25913
912 1 5 . 1 1 3 3 GLU CA C 3 56.377 56.377 57.486 -1.109 25913
913 1 5 . 1 1 3 3 GLU CB C 3 30.549 30.549 28.657 1.892 25913
914 1 5 . 1 1 3 3 GLU H H 3 8.274 8.274 8.279 -0.005 25913
915 1 5 . 1 1 4 4 ALA N N 4 125.716 125.716 120.841 4.875 25913
916 1 5 . 1 1 4 4 ALA HA H 4 4.345 4.345 4.509 -0.164 25913
917 1 5 . 1 1 4 4 ALA C C 4 177.530 177.530 177.318 0.212 25913
918 1 5 . 1 1 4 4 ALA CA C 4 52.413 52.413 52.210 0.203 25913
919 1 5 . 1 1 4 4 ALA CB C 4 19.466 19.466 20.344 -0.878 25913
920 1 5 . 1 1 4 4 ALA H H 4 8.271 8.271 7.860 0.411 25913
921 1 5 . 1 1 5 5 SER N N 5 117.161 117.161 115.788 1.373 25913
922 1 5 . 1 1 5 5 SER HA H 5 4.724 4.724 4.943 -0.219 25913
923 1 5 . 1 1 5 5 SER C C 5 172.661 172.661 171.796 0.865 25913
924 1 5 . 1 1 5 5 SER CA C 5 56.354 56.354 55.967 0.387 25913
925 1 5 . 1 1 5 5 SER CB C 5 63.442 63.442 64.088 -0.645 25913
926 1 5 . 1 1 5 5 SER H H 5 8.259 8.259 8.015 0.244 25913
927 1 5 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.809 -0.395 25913
928 1 5 . 1 1 6 6 PRO C C 6 176.523 176.523 175.903 0.620 25913
929 1 5 . 1 1 6 6 PRO CA C 6 63.385 63.385 63.044 0.341 25913
930 1 5 . 1 1 6 6 PRO CB C 6 32.187 32.187 32.377 -0.190 25913
931 1 5 . 1 1 7 7 HIS N N 7 120.170 120.170 119.542 0.628 25913
932 1 5 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.932 0.048 25913
933 1 5 . 1 1 7 7 HIS C C 7 172.577 172.577 173.193 -0.616 25913
934 1 5 . 1 1 7 7 HIS CA C 7 53.492 53.492 52.664 0.828 25913
935 1 5 . 1 1 7 7 HIS CB C 7 29.133 29.133 30.114 -0.981 25913
936 1 5 . 1 1 7 7 HIS H H 7 8.489 8.489 7.915 0.574 25913
937 1 5 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.535 0.011 25913
938 1 5 . 1 1 8 8 PRO C C 8 177.382 177.382 176.232 1.150 25913
939 1 5 . 1 1 8 8 PRO CA C 8 63.443 63.443 63.100 0.343 25913
940 1 5 . 1 1 8 8 PRO CB C 8 32.377 32.377 32.760 -0.383 25913
941 1 5 . 1 1 9 9 GLY N N 9 110.263 110.263 109.527 0.736 25913
942 1 5 . 1 1 9 9 GLY C C 9 172.859 172.859 173.384 -0.525 25913
943 1 5 . 1 1 9 9 GLY CA C 9 45.211 45.211 46.259 -1.048 25913
944 1 5 . 1 1 9 9 GLY H H 9 8.635 8.635 8.994 -0.359 25913
945 1 5 . 1 1 10 10 ARG N N 10 121.025 121.025 122.946 -1.921 25913
946 1 5 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.775 0.007 25913
947 1 5 . 1 1 10 10 ARG C C 10 175.125 175.125 174.799 0.326 25913
948 1 5 . 1 1 10 10 ARG CA C 10 55.356 55.356 56.070 -0.714 25913
949 1 5 . 1 1 10 10 ARG CB C 10 32.982 32.982 29.545 3.437 25913
950 1 5 . 1 1 10 10 ARG H H 10 8.229 8.229 7.964 0.265 25913
951 1 5 . 1 1 11 11 TYR N N 11 121.353 121.353 123.459 -2.106 25913
952 1 5 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.689 -0.361 25913
953 1 5 . 1 1 11 11 TYR C C 11 174.229 174.229 174.639 -0.410 25913
954 1 5 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.068 0.981 25913
955 1 5 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.653 -0.602 25913
956 1 5 . 1 1 11 11 TYR H H 11 8.692 8.692 9.334 -0.642 25913
957 1 5 . 1 1 12 12 PHE N N 12 122.456 122.456 122.065 0.391 25913
958 1 5 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.281 -0.397 25913
959 1 5 . 1 1 12 12 PHE C C 12 174.224 174.224 174.735 -0.511 25913
960 1 5 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.465 0.554 25913
961 1 5 . 1 1 12 12 PHE CB C 12 44.078 44.078 41.976 2.102 25913
962 1 5 . 1 1 12 12 PHE H H 12 9.415 9.415 9.101 0.314 25913
963 1 5 . 1 1 13 13 CYS N N 13 128.438 128.438 128.421 0.017 25913
964 1 5 . 1 1 13 13 CYS HA H 13 4.653 4.653 5.015 -0.362 25913
965 1 5 . 1 1 13 13 CYS C C 13 176.686 176.686 175.353 1.333 25913
966 1 5 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.722 0.606 25913
967 1 5 . 1 1 13 13 CYS CB C 13 31.220 31.220 28.237 2.983 25913
968 1 5 . 1 1 13 13 CYS H H 13 7.942 7.942 8.908 -0.966 25913
969 1 5 . 1 1 14 14 HIS N N 14 126.467 126.467 125.453 1.014 25913
970 1 5 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.588 -0.265 25913
971 1 5 . 1 1 14 14 HIS C C 14 175.452 175.452 176.640 -1.188 25913
972 1 5 . 1 1 14 14 HIS CA C 14 58.736 58.736 58.594 0.142 25913
973 1 5 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.649 -1.458 25913
974 1 5 . 1 1 14 14 HIS H H 14 8.971 8.971 9.556 -0.585 25913
975 1 5 . 1 1 15 15 CYS N N 15 123.882 123.882 118.021 5.861 25913
976 1 5 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.243 0.199 25913
977 1 5 . 1 1 15 15 CYS C C 15 176.939 176.939 175.968 0.971 25913
978 1 5 . 1 1 15 15 CYS CA C 15 61.704 61.704 61.970 -0.266 25913
979 1 5 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.397 -0.056 25913
980 1 5 . 1 1 15 15 CYS H H 15 9.195 9.195 8.544 0.651 25913
981 1 5 . 1 1 16 16 CYS N N 16 124.898 124.898 118.956 5.942 25913
982 1 5 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.548 -0.550 25913
983 1 5 . 1 1 16 16 CYS C C 16 175.557 175.557 174.734 0.823 25913
984 1 5 . 1 1 16 16 CYS CB C 16 30.961 30.961 27.618 3.343 25913
985 1 5 . 1 1 16 16 CYS H H 16 9.794 9.794 8.145 1.649 25913
986 1 5 . 1 1 17 17 SER N N 17 114.055 114.055 113.749 0.306 25913
987 1 5 . 1 1 17 17 SER HA H 17 3.755 3.755 4.130 -0.375 25913
988 1 5 . 1 1 17 17 SER C C 17 173.790 173.790 173.280 0.510 25913
989 1 5 . 1 1 17 17 SER CA C 17 58.868 58.868 59.601 -0.733 25913
990 1 5 . 1 1 17 17 SER CB C 17 61.703 61.703 60.402 1.301 25913
991 1 5 . 1 1 17 17 SER H H 17 7.950 7.950 7.977 -0.027 25913
992 1 5 . 1 1 18 18 VAL N N 18 111.916 111.916 111.914 0.002 25913
993 1 5 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.275 0.183 25913
994 1 5 . 1 1 18 18 VAL C C 18 173.765 173.765 173.605 0.160 25913
995 1 5 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.015 0.017 25913
996 1 5 . 1 1 18 18 VAL CB C 18 36.667 36.667 35.368 1.298 25913
997 1 5 . 1 1 18 18 VAL H H 18 6.438 6.438 7.009 -0.571 25913
998 1 5 . 1 1 19 19 GLU N N 19 123.431 123.431 121.456 1.975 25913
999 1 5 . 1 1 19 19 GLU HA H 19 5.023 5.023 4.912 0.111 25913
1000 1 5 . 1 1 19 19 GLU C C 19 176.506 176.506 176.174 0.332 25913
1001 1 5 . 1 1 19 19 GLU CA C 19 56.818 56.818 56.504 0.314 25913
1002 1 5 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.547 -0.382 25913
1003 1 5 . 1 1 19 19 GLU H H 19 8.346 8.346 8.399 -0.053 25913
1004 1 5 . 1 1 20 20 ILE N N 20 117.751 117.751 120.717 -2.966 25913
1005 1 5 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.774 -0.033 25913
1006 1 5 . 1 1 20 20 ILE C C 20 175.511 175.511 173.768 1.743 25913
1007 1 5 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.430 -0.485 25913
1008 1 5 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.812 2.855 25913
1009 1 5 . 1 1 20 20 ILE H H 20 8.537 8.537 8.842 -0.305 25913
1010 1 5 . 1 1 21 21 VAL N N 21 124.220 124.220 121.419 2.801 25913
1011 1 5 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.188 -0.602 25913
1012 1 5 . 1 1 21 21 VAL C C 21 174.640 174.640 174.051 0.589 25913
1013 1 5 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.828 1.890 25913
1014 1 5 . 1 1 21 21 VAL CB C 21 32.503 32.503 34.265 -1.762 25913
1015 1 5 . 1 1 21 21 VAL H H 21 8.203 8.203 8.339 -0.136 25913
1016 1 5 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.715 -0.656 25913
1017 1 5 . 1 1 22 22 PRO C C 22 175.352 175.352 176.107 -0.755 25913
1018 1 5 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.619 0.042 25913
1019 1 5 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.349 -0.335 25913
1020 1 5 . 1 1 23 23 ARG N N 23 121.370 121.370 122.570 -1.200 25913
1021 1 5 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.261 -0.006 25913
1022 1 5 . 1 1 23 23 ARG C C 23 175.759 175.759 176.704 -0.945 25913
1023 1 5 . 1 1 23 23 ARG CA C 23 56.052 56.052 55.923 0.128 25913
1024 1 5 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.228 1.658 25913
1025 1 5 . 1 1 23 23 ARG H H 23 8.635 8.635 8.230 0.405 25913
1026 1 5 . 1 1 24 24 LEU N N 24 127.914 127.914 126.927 0.987 25913
1027 1 5 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.666 0.507 25913
1028 1 5 . 1 1 24 24 LEU C C 24 175.774 175.774 175.965 -0.191 25913
1029 1 5 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.686 -5.748 25913
1030 1 5 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.035 2.385 25913
1031 1 5 . 1 1 24 24 LEU H H 24 8.521 8.521 8.680 -0.159 25913
1032 1 5 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.133 0.207 25913
1033 1 5 . 1 1 25 25 PRO C C 25 176.386 176.386 177.146 -0.760 25913
1034 1 5 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.567 -0.900 25913
1035 1 5 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.733 2.943 25913
1036 1 5 . 1 1 26 26 ASP N N 26 122.078 122.078 114.156 7.922 25913
1037 1 5 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.673 -0.286 25913
1038 1 5 . 1 1 26 26 ASP C C 26 175.321 175.321 175.898 -0.577 25913
1039 1 5 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.359 1.996 25913
1040 1 5 . 1 1 26 26 ASP CB C 26 41.066 41.066 42.959 -1.893 25913
1041 1 5 . 1 1 26 26 ASP H H 26 8.752 8.752 7.719 1.033 25913
1042 1 5 . 1 1 27 27 TYR N N 27 117.607 117.607 117.737 -0.130 25913
1043 1 5 . 1 1 27 27 TYR HA H 27 3.449 3.449 3.956 -0.507 25913
1044 1 5 . 1 1 27 27 TYR C C 27 173.074 173.074 174.471 -1.397 25913
1045 1 5 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.382 1.055 25913
1046 1 5 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.515 -0.455 25913
1047 1 5 . 1 1 27 27 TYR H H 27 8.666 8.666 8.071 0.595 25913
1048 1 5 . 1 1 28 28 ILE N N 28 111.804 111.804 112.547 -0.743 25913
1049 1 5 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.529 0.246 25913
1050 1 5 . 1 1 28 28 ILE C C 28 175.083 175.083 174.868 0.215 25913
1051 1 5 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.756 -1.187 25913
1052 1 5 . 1 1 28 28 ILE CB C 28 42.107 42.107 40.921 1.186 25913
1053 1 5 . 1 1 28 28 ILE H H 28 6.761 6.761 7.246 -0.485 25913
1054 1 5 . 1 1 29 29 CYS N N 29 126.875 126.875 118.996 7.879 25913
1055 1 5 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.771 -0.363 25913
1056 1 5 . 1 1 29 29 CYS C C 29 175.932 175.932 175.126 0.806 25913
1057 1 5 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.823 0.579 25913
1058 1 5 . 1 1 29 29 CYS CB C 29 32.214 32.214 28.077 4.137 25913
1059 1 5 . 1 1 29 29 CYS H H 29 8.783 8.783 8.747 0.036 25913
1060 1 5 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.438 -0.056 25913
1061 1 5 . 1 1 30 30 PRO C C 30 176.824 176.824 177.388 -0.564 25913
1062 1 5 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.523 -0.483 25913
1063 1 5 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.957 0.387 25913
1064 1 5 . 1 1 31 31 ARG N N 31 124.131 124.131 117.050 7.081 25913
1065 1 5 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.427 -0.126 25913
1066 1 5 . 1 1 31 31 ARG C C 31 177.721 177.721 177.157 0.564 25913
1067 1 5 . 1 1 31 31 ARG CA C 31 58.190 58.190 57.705 0.485 25913
1068 1 5 . 1 1 31 31 ARG CB C 31 31.682 31.682 30.989 0.693 25913
1069 1 5 . 1 1 31 31 ARG H H 31 9.604 9.604 7.723 1.881 25913
1070 1 5 . 1 1 32 32 CYS N N 32 119.758 119.758 113.931 5.827 25913
1071 1 5 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.845 -0.006 25913
1072 1 5 . 1 1 32 32 CYS C C 32 176.450 176.450 174.313 2.137 25913
1073 1 5 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.626 1.084 25913
1074 1 5 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.453 3.777 25913
1075 1 5 . 1 1 32 32 CYS H H 32 8.549 8.549 7.734 0.815 25913
1076 1 5 . 1 1 33 33 GLU N N 33 118.109 118.109 119.817 -1.708 25913
1077 1 5 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.109 -0.031 25913
1078 1 5 . 1 1 33 33 GLU C C 33 174.739 174.739 176.015 -1.276 25913
1079 1 5 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.563 0.955 25913
1080 1 5 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.206 -0.514 25913
1081 1 5 . 1 1 33 33 GLU H H 33 7.868 7.868 8.267 -0.399 25913
1082 1 5 . 1 1 34 34 SER N N 34 117.224 117.224 115.000 2.224 25913
1083 1 5 . 1 1 34 34 SER HA H 34 4.437 4.437 4.502 -0.065 25913
1084 1 5 . 1 1 34 34 SER C C 34 175.392 175.392 175.580 -0.188 25913
1085 1 5 . 1 1 34 34 SER CA C 34 59.277 59.277 59.739 -0.461 25913
1086 1 5 . 1 1 34 34 SER CB C 34 65.429 65.429 64.482 0.947 25913
1087 1 5 . 1 1 34 34 SER H H 34 8.786 8.786 7.915 0.871 25913
1088 1 5 . 1 1 35 35 GLY N N 35 111.095 111.095 107.746 3.349 25913
1089 1 5 . 1 1 35 35 GLY C C 35 175.730 175.730 174.424 1.306 25913
1090 1 5 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.701 0.540 25913
1091 1 5 . 1 1 35 35 GLY H H 35 8.511 8.511 8.541 -0.030 25913
1092 1 5 . 1 1 36 36 PHE N N 36 126.409 126.409 124.869 1.540 25913
1093 1 5 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.507 0.644 25913
1094 1 5 . 1 1 36 36 PHE C C 36 174.098 174.098 174.579 -0.481 25913
1095 1 5 . 1 1 36 36 PHE CA C 36 55.269 55.269 58.256 -2.987 25913
1096 1 5 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.460 -1.433 25913
1097 1 5 . 1 1 36 36 PHE H H 36 8.850 8.850 7.715 1.135 25913
1098 1 5 . 1 1 37 37 ILE N N 37 117.377 117.377 115.846 1.531 25913
1099 1 5 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.415 -0.059 25913
1100 1 5 . 1 1 37 37 ILE C C 37 175.508 175.508 174.891 0.617 25913
1101 1 5 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.714 -0.027 25913
1102 1 5 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.553 -1.405 25913
1103 1 5 . 1 1 37 37 ILE H H 37 7.972 7.972 7.831 0.141 25913
1104 1 5 . 1 1 38 38 GLU N N 38 124.869 124.869 123.244 1.625 25913
1105 1 5 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.596 0.289 25913
1106 1 5 . 1 1 38 38 GLU C C 38 174.300 174.300 175.355 -1.055 25913
1107 1 5 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.902 -0.246 25913
1108 1 5 . 1 1 38 38 GLU CB C 38 34.589 34.589 32.196 2.393 25913
1109 1 5 . 1 1 38 38 GLU H H 38 9.131 9.131 8.939 0.192 25913
1110 1 5 . 1 1 39 39 GLU N N 39 127.840 127.840 127.197 0.643 25913
1111 1 5 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.352 0.496 25913
1112 1 5 . 1 1 39 39 GLU C C 39 175.507 175.507 175.690 -0.183 25913
1113 1 5 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.924 0.581 25913
1114 1 5 . 1 1 39 39 GLU CB C 39 30.249 30.249 29.132 1.117 25913
1115 1 5 . 1 1 39 39 GLU H H 39 8.844 8.844 8.614 0.230 25913
1116 1 6 . 1 1 0 0 SER HA H 0 4.525 4.525 4.644 -0.119 25913
1117 1 6 . 1 1 0 0 SER C C 0 174.776 174.776 174.125 0.651 25913
1118 1 6 . 1 1 0 0 SER CA C 0 58.364 58.364 58.617 -0.253 25913
1119 1 6 . 1 1 0 0 SER CB C 0 64.049 64.049 64.272 -0.223 25913
1120 1 6 . 1 1 1 1 MET N N 1 123.174 123.174 124.867 -1.693 25913
1121 1 6 . 1 1 1 1 MET HA H 1 4.486 4.486 4.478 0.008 25913
1122 1 6 . 1 1 1 1 MET C C 1 176.177 176.177 176.026 0.151 25913
1123 1 6 . 1 1 1 1 MET CA C 1 55.804 55.804 55.057 0.747 25913
1124 1 6 . 1 1 1 1 MET CB C 1 32.941 32.941 30.116 2.825 25913
1125 1 6 . 1 1 1 1 MET H H 1 8.592 8.592 8.765 -0.173 25913
1126 1 6 . 1 1 2 2 ALA N N 2 125.785 125.785 125.928 -0.143 25913
1127 1 6 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.437 -0.144 25913
1128 1 6 . 1 1 2 2 ALA C C 2 177.812 177.812 177.676 0.136 25913
1129 1 6 . 1 1 2 2 ALA CA C 2 52.809 52.809 52.562 0.247 25913
1130 1 6 . 1 1 2 2 ALA CB C 2 19.224 19.224 19.756 -0.532 25913
1131 1 6 . 1 1 2 2 ALA H H 2 8.337 8.337 8.076 0.261 25913
1132 1 6 . 1 1 3 3 GLU N N 3 120.731 120.731 119.639 1.092 25913
1133 1 6 . 1 1 3 3 GLU HA H 3 4.256 4.256 4.472 -0.216 25913
1134 1 6 . 1 1 3 3 GLU C C 3 176.186 176.186 175.410 0.776 25913
1135 1 6 . 1 1 3 3 GLU CA C 3 56.377 56.377 56.236 0.141 25913
1136 1 6 . 1 1 3 3 GLU CB C 3 30.549 30.549 29.616 0.933 25913
1137 1 6 . 1 1 3 3 GLU H H 3 8.274 8.274 8.388 -0.114 25913
1138 1 6 . 1 1 4 4 ALA N N 4 125.716 125.716 127.898 -2.182 25913
1139 1 6 . 1 1 4 4 ALA HA H 4 4.345 4.345 4.656 -0.311 25913
1140 1 6 . 1 1 4 4 ALA C C 4 177.530 177.530 177.722 -0.192 25913
1141 1 6 . 1 1 4 4 ALA CA C 4 52.413 52.413 52.541 -0.128 25913
1142 1 6 . 1 1 4 4 ALA CB C 4 19.466 19.466 19.358 0.108 25913
1143 1 6 . 1 1 4 4 ALA H H 4 8.271 8.271 8.505 -0.234 25913
1144 1 6 . 1 1 5 5 SER N N 5 117.161 117.161 116.060 1.101 25913
1145 1 6 . 1 1 5 5 SER HA H 5 4.724 4.724 4.842 -0.118 25913
1146 1 6 . 1 1 5 5 SER C C 5 172.661 172.661 171.984 0.677 25913
1147 1 6 . 1 1 5 5 SER CA C 5 56.354 56.354 56.207 0.147 25913
1148 1 6 . 1 1 5 5 SER CB C 5 63.442 63.442 63.649 -0.207 25913
1149 1 6 . 1 1 5 5 SER H H 5 8.259 8.259 8.098 0.161 25913
1150 1 6 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.408 0.006 25913
1151 1 6 . 1 1 6 6 PRO C C 6 176.523 176.523 175.917 0.606 25913
1152 1 6 . 1 1 6 6 PRO CA C 6 63.385 63.385 63.438 -0.053 25913
1153 1 6 . 1 1 6 6 PRO CB C 6 32.187 32.187 31.383 0.804 25913
1154 1 6 . 1 1 7 7 HIS N N 7 120.170 120.170 125.921 -5.751 25913
1155 1 6 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.783 0.197 25913
1156 1 6 . 1 1 7 7 HIS C C 7 172.577 172.577 173.691 -1.114 25913
1157 1 6 . 1 1 7 7 HIS CA C 7 53.492 53.492 53.708 -0.216 25913
1158 1 6 . 1 1 7 7 HIS CB C 7 29.133 29.133 30.956 -1.823 25913
1159 1 6 . 1 1 7 7 HIS H H 7 8.489 8.489 8.069 0.420 25913
1160 1 6 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.566 -0.020 25913
1161 1 6 . 1 1 8 8 PRO C C 8 177.382 177.382 175.802 1.580 25913
1162 1 6 . 1 1 8 8 PRO CA C 8 63.443 63.443 62.544 0.899 25913
1163 1 6 . 1 1 8 8 PRO CB C 8 32.377 32.377 33.127 -0.750 25913
1164 1 6 . 1 1 9 9 GLY N N 9 110.263 110.263 109.750 0.513 25913
1165 1 6 . 1 1 9 9 GLY C C 9 172.859 172.859 173.429 -0.570 25913
1166 1 6 . 1 1 9 9 GLY CA C 9 45.211 45.211 46.028 -0.817 25913
1167 1 6 . 1 1 9 9 GLY H H 9 8.635 8.635 8.653 -0.018 25913
1168 1 6 . 1 1 10 10 ARG N N 10 121.025 121.025 123.474 -2.449 25913
1169 1 6 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.531 0.251 25913
1170 1 6 . 1 1 10 10 ARG C C 10 175.125 175.125 175.004 0.121 25913
1171 1 6 . 1 1 10 10 ARG CA C 10 55.356 55.356 56.425 -1.069 25913
1172 1 6 . 1 1 10 10 ARG CB C 10 32.982 32.982 29.087 3.894 25913
1173 1 6 . 1 1 10 10 ARG H H 10 8.229 8.229 8.130 0.099 25913
1174 1 6 . 1 1 11 11 TYR N N 11 121.353 121.353 123.629 -2.276 25913
1175 1 6 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.683 -0.355 25913
1176 1 6 . 1 1 11 11 TYR C C 11 174.229 174.229 174.885 -0.656 25913
1177 1 6 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.121 0.928 25913
1178 1 6 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.336 -0.285 25913
1179 1 6 . 1 1 11 11 TYR H H 11 8.692 8.692 9.281 -0.589 25913
1180 1 6 . 1 1 12 12 PHE N N 12 122.456 122.456 122.068 0.388 25913
1181 1 6 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.353 -0.469 25913
1182 1 6 . 1 1 12 12 PHE C C 12 174.224 174.224 174.680 -0.456 25913
1183 1 6 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.383 0.636 25913
1184 1 6 . 1 1 12 12 PHE CB C 12 44.078 44.078 42.183 1.895 25913
1185 1 6 . 1 1 12 12 PHE H H 12 9.415 9.415 9.053 0.362 25913
1186 1 6 . 1 1 13 13 CYS N N 13 128.438 128.438 128.339 0.099 25913
1187 1 6 . 1 1 13 13 CYS HA H 13 4.653 4.653 5.102 -0.449 25913
1188 1 6 . 1 1 13 13 CYS C C 13 176.686 176.686 175.377 1.309 25913
1189 1 6 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.281 1.048 25913
1190 1 6 . 1 1 13 13 CYS CB C 13 31.220 31.220 28.475 2.745 25913
1191 1 6 . 1 1 13 13 CYS H H 13 7.942 7.942 8.794 -0.852 25913
1192 1 6 . 1 1 14 14 HIS N N 14 126.467 126.467 125.653 0.814 25913
1193 1 6 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.539 -0.216 25913
1194 1 6 . 1 1 14 14 HIS C C 14 175.452 175.452 176.457 -1.005 25913
1195 1 6 . 1 1 14 14 HIS CA C 14 58.736 58.736 58.724 0.012 25913
1196 1 6 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.627 -1.435 25913
1197 1 6 . 1 1 14 14 HIS H H 14 8.971 8.971 9.469 -0.498 25913
1198 1 6 . 1 1 15 15 CYS N N 15 123.882 123.882 118.366 5.516 25913
1199 1 6 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.288 0.154 25913
1200 1 6 . 1 1 15 15 CYS C C 15 176.939 176.939 176.160 0.779 25913
1201 1 6 . 1 1 15 15 CYS CA C 15 61.704 61.704 61.630 0.074 25913
1202 1 6 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.956 -0.615 25913
1203 1 6 . 1 1 15 15 CYS H H 15 9.195 9.195 8.188 1.008 25913
1204 1 6 . 1 1 16 16 CYS N N 16 124.898 124.898 121.222 3.676 25913
1205 1 6 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.489 -0.491 25913
1206 1 6 . 1 1 16 16 CYS C C 16 175.557 175.557 174.769 0.788 25913
1207 1 6 . 1 1 16 16 CYS CB C 16 30.961 30.961 27.185 3.776 25913
1208 1 6 . 1 1 16 16 CYS H H 16 9.794 9.794 8.077 1.717 25913
1209 1 6 . 1 1 17 17 SER N N 17 114.055 114.055 113.802 0.253 25913
1210 1 6 . 1 1 17 17 SER HA H 17 3.755 3.755 4.018 -0.263 25913
1211 1 6 . 1 1 17 17 SER C C 17 173.790 173.790 173.269 0.521 25913
1212 1 6 . 1 1 17 17 SER CA C 17 58.868 58.868 59.471 -0.603 25913
1213 1 6 . 1 1 17 17 SER CB C 17 61.703 61.703 60.643 1.060 25913
1214 1 6 . 1 1 17 17 SER H H 17 7.950 7.950 8.167 -0.217 25913
1215 1 6 . 1 1 18 18 VAL N N 18 111.916 111.916 113.068 -1.152 25913
1216 1 6 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.347 0.111 25913
1217 1 6 . 1 1 18 18 VAL C C 18 173.765 173.765 173.777 -0.012 25913
1218 1 6 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.583 -0.551 25913
1219 1 6 . 1 1 18 18 VAL CB C 18 36.667 36.667 34.889 1.778 25913
1220 1 6 . 1 1 18 18 VAL H H 18 6.438 6.438 6.996 -0.558 25913
1221 1 6 . 1 1 19 19 GLU N N 19 123.431 123.431 122.174 1.257 25913
1222 1 6 . 1 1 19 19 GLU HA H 19 5.023 5.023 5.138 -0.115 25913
1223 1 6 . 1 1 19 19 GLU C C 19 176.506 176.506 175.831 0.675 25913
1224 1 6 . 1 1 19 19 GLU CA C 19 56.818 56.818 56.377 0.441 25913
1225 1 6 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.366 -0.201 25913
1226 1 6 . 1 1 19 19 GLU H H 19 8.346 8.346 8.408 -0.062 25913
1227 1 6 . 1 1 20 20 ILE N N 20 117.751 117.751 119.711 -1.960 25913
1228 1 6 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.722 0.019 25913
1229 1 6 . 1 1 20 20 ILE C C 20 175.511 175.511 174.025 1.486 25913
1230 1 6 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.076 -0.131 25913
1231 1 6 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.629 3.038 25913
1232 1 6 . 1 1 20 20 ILE H H 20 8.537 8.537 9.030 -0.493 25913
1233 1 6 . 1 1 21 21 VAL N N 21 124.220 124.220 122.417 1.803 25913
1234 1 6 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.069 -0.483 25913
1235 1 6 . 1 1 21 21 VAL C C 21 174.640 174.640 174.192 0.448 25913
1236 1 6 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.739 1.980 25913
1237 1 6 . 1 1 21 21 VAL CB C 21 32.503 32.503 33.057 -0.554 25913
1238 1 6 . 1 1 21 21 VAL H H 21 8.203 8.203 8.410 -0.207 25913
1239 1 6 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.608 -0.549 25913
1240 1 6 . 1 1 22 22 PRO C C 22 175.352 175.352 176.137 -0.785 25913
1241 1 6 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.489 0.172 25913
1242 1 6 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.438 -0.424 25913
1243 1 6 . 1 1 23 23 ARG N N 23 121.370 121.370 122.987 -1.617 25913
1244 1 6 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.176 0.079 25913
1245 1 6 . 1 1 23 23 ARG C C 23 175.759 175.759 176.781 -1.022 25913
1246 1 6 . 1 1 23 23 ARG CA C 23 56.052 56.052 56.217 -0.165 25913
1247 1 6 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.163 1.723 25913
1248 1 6 . 1 1 23 23 ARG H H 23 8.635 8.635 8.156 0.479 25913
1249 1 6 . 1 1 24 24 LEU N N 24 127.914 127.914 127.403 0.511 25913
1250 1 6 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.788 0.385 25913
1251 1 6 . 1 1 24 24 LEU C C 24 175.774 175.774 175.960 -0.186 25913
1252 1 6 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.511 -5.573 25913
1253 1 6 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.220 2.200 25913
1254 1 6 . 1 1 24 24 LEU H H 24 8.521 8.521 8.534 -0.013 25913
1255 1 6 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.179 0.161 25913
1256 1 6 . 1 1 25 25 PRO C C 25 176.386 176.386 176.937 -0.551 25913
1257 1 6 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.422 -0.755 25913
1258 1 6 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.766 2.910 25913
1259 1 6 . 1 1 26 26 ASP N N 26 122.078 122.078 115.452 6.626 25913
1260 1 6 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.677 -0.290 25913
1261 1 6 . 1 1 26 26 ASP C C 26 175.321 175.321 175.999 -0.678 25913
1262 1 6 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.318 2.037 25913
1263 1 6 . 1 1 26 26 ASP CB C 26 41.066 41.066 43.601 -2.535 25913
1264 1 6 . 1 1 26 26 ASP H H 26 8.752 8.752 7.803 0.949 25913
1265 1 6 . 1 1 27 27 TYR N N 27 117.607 117.607 117.487 0.120 25913
1266 1 6 . 1 1 27 27 TYR HA H 27 3.449 3.449 3.989 -0.540 25913
1267 1 6 . 1 1 27 27 TYR C C 27 173.074 173.074 174.347 -1.273 25913
1268 1 6 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.383 1.054 25913
1269 1 6 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.840 -0.780 25913
1270 1 6 . 1 1 27 27 TYR H H 27 8.666 8.666 8.224 0.442 25913
1271 1 6 . 1 1 28 28 ILE N N 28 111.804 111.804 113.103 -1.299 25913
1272 1 6 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.467 0.308 25913
1273 1 6 . 1 1 28 28 ILE C C 28 175.083 175.083 174.683 0.400 25913
1274 1 6 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.146 -0.577 25913
1275 1 6 . 1 1 28 28 ILE CB C 28 42.107 42.107 41.147 0.960 25913
1276 1 6 . 1 1 28 28 ILE H H 28 6.761 6.761 7.314 -0.553 25913
1277 1 6 . 1 1 29 29 CYS N N 29 126.875 126.875 118.931 7.944 25913
1278 1 6 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.758 -0.350 25913
1279 1 6 . 1 1 29 29 CYS C C 29 175.932 175.932 175.050 0.882 25913
1280 1 6 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.842 0.560 25913
1281 1 6 . 1 1 29 29 CYS CB C 29 32.214 32.214 27.958 4.256 25913
1282 1 6 . 1 1 29 29 CYS H H 29 8.783 8.783 8.712 0.071 25913
1283 1 6 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.459 -0.077 25913
1284 1 6 . 1 1 30 30 PRO C C 30 176.824 176.824 177.408 -0.584 25913
1285 1 6 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.446 -0.406 25913
1286 1 6 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.923 0.421 25913
1287 1 6 . 1 1 31 31 ARG N N 31 124.131 124.131 117.025 7.106 25913
1288 1 6 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.457 -0.156 25913
1289 1 6 . 1 1 31 31 ARG C C 31 177.721 177.721 177.064 0.657 25913
1290 1 6 . 1 1 31 31 ARG CA C 31 58.190 58.190 57.639 0.551 25913
1291 1 6 . 1 1 31 31 ARG CB C 31 31.682 31.682 31.179 0.503 25913
1292 1 6 . 1 1 31 31 ARG H H 31 9.604 9.604 7.684 1.920 25913
1293 1 6 . 1 1 32 32 CYS N N 32 119.758 119.758 113.952 5.806 25913
1294 1 6 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.835 0.004 25913
1295 1 6 . 1 1 32 32 CYS C C 32 176.450 176.450 174.289 2.161 25913
1296 1 6 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.682 1.028 25913
1297 1 6 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.512 3.718 25913
1298 1 6 . 1 1 32 32 CYS H H 32 8.549 8.549 7.723 0.826 25913
1299 1 6 . 1 1 33 33 GLU N N 33 118.109 118.109 119.905 -1.796 25913
1300 1 6 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.063 0.015 25913
1301 1 6 . 1 1 33 33 GLU C C 33 174.739 174.739 176.061 -1.322 25913
1302 1 6 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.485 1.033 25913
1303 1 6 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.188 -0.496 25913
1304 1 6 . 1 1 33 33 GLU H H 33 7.868 7.868 8.232 -0.364 25913
1305 1 6 . 1 1 34 34 SER N N 34 117.224 117.224 115.079 2.145 25913
1306 1 6 . 1 1 34 34 SER HA H 34 4.437 4.437 4.504 -0.067 25913
1307 1 6 . 1 1 34 34 SER C C 34 175.392 175.392 175.675 -0.283 25913
1308 1 6 . 1 1 34 34 SER CA C 34 59.277 59.277 59.816 -0.539 25913
1309 1 6 . 1 1 34 34 SER CB C 34 65.429 65.429 64.357 1.072 25913
1310 1 6 . 1 1 34 34 SER H H 34 8.786 8.786 7.998 0.788 25913
1311 1 6 . 1 1 35 35 GLY N N 35 111.095 111.095 107.666 3.429 25913
1312 1 6 . 1 1 35 35 GLY C C 35 175.730 175.730 174.587 1.143 25913
1313 1 6 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.693 0.548 25913
1314 1 6 . 1 1 35 35 GLY H H 35 8.511 8.511 8.468 0.043 25913
1315 1 6 . 1 1 36 36 PHE N N 36 126.409 126.409 125.138 1.271 25913
1316 1 6 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.400 0.751 25913
1317 1 6 . 1 1 36 36 PHE C C 36 174.098 174.098 174.665 -0.567 25913
1318 1 6 . 1 1 36 36 PHE CA C 36 55.269 55.269 58.886 -3.616 25913
1319 1 6 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.332 -1.305 25913
1320 1 6 . 1 1 36 36 PHE H H 36 8.850 8.850 7.760 1.090 25913
1321 1 6 . 1 1 37 37 ILE N N 37 117.377 117.377 115.572 1.805 25913
1322 1 6 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.464 -0.108 25913
1323 1 6 . 1 1 37 37 ILE C C 37 175.508 175.508 174.922 0.586 25913
1324 1 6 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.554 0.133 25913
1325 1 6 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.546 -1.398 25913
1326 1 6 . 1 1 37 37 ILE H H 37 7.972 7.972 7.884 0.088 25913
1327 1 6 . 1 1 38 38 GLU N N 38 124.869 124.869 122.936 1.933 25913
1328 1 6 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.591 0.294 25913
1329 1 6 . 1 1 38 38 GLU C C 38 174.300 174.300 175.322 -1.022 25913
1330 1 6 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.901 -0.245 25913
1331 1 6 . 1 1 38 38 GLU CB C 38 34.589 34.589 32.327 2.262 25913
1332 1 6 . 1 1 38 38 GLU H H 38 9.131 9.131 8.894 0.237 25913
1333 1 6 . 1 1 39 39 GLU N N 39 127.840 127.840 127.073 0.767 25913
1334 1 6 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.179 0.669 25913
1335 1 6 . 1 1 39 39 GLU C C 39 175.507 175.507 175.498 0.009 25913
1336 1 6 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.767 0.737 25913
1337 1 6 . 1 1 39 39 GLU CB C 39 30.249 30.249 28.821 1.428 25913
1338 1 6 . 1 1 39 39 GLU H H 39 8.844 8.844 8.644 0.200 25913
1339 1 7 . 1 1 0 0 SER HA H 0 4.525 4.525 4.006 0.519 25913
1340 1 7 . 1 1 0 0 SER C C 0 174.776 174.776 176.009 -1.233 25913
1341 1 7 . 1 1 0 0 SER CA C 0 58.364 58.364 60.882 -2.518 25913
1342 1 7 . 1 1 0 0 SER CB C 0 64.049 64.049 62.238 1.811 25913
1343 1 7 . 1 1 1 1 MET N N 1 123.174 123.174 121.535 1.639 25913
1344 1 7 . 1 1 1 1 MET HA H 1 4.486 4.486 4.434 0.052 25913
1345 1 7 . 1 1 1 1 MET C C 1 176.177 176.177 176.608 -0.431 25913
1346 1 7 . 1 1 1 1 MET CA C 1 55.804 55.804 56.657 -0.853 25913
1347 1 7 . 1 1 1 1 MET CB C 1 32.941 32.941 33.097 -0.156 25913
1348 1 7 . 1 1 1 1 MET H H 1 8.592 8.592 7.982 0.610 25913
1349 1 7 . 1 1 2 2 ALA N N 2 125.785 125.785 120.406 5.379 25913
1350 1 7 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.474 -0.181 25913
1351 1 7 . 1 1 2 2 ALA C C 2 177.812 177.812 177.909 -0.097 25913
1352 1 7 . 1 1 2 2 ALA CA C 2 52.809 52.809 52.145 0.664 25913
1353 1 7 . 1 1 2 2 ALA CB C 2 19.224 19.224 18.740 0.484 25913
1354 1 7 . 1 1 2 2 ALA H H 2 8.337 8.337 7.410 0.927 25913
1355 1 7 . 1 1 3 3 GLU N N 3 120.731 120.731 118.880 1.851 25913
1356 1 7 . 1 1 3 3 GLU HA H 3 4.256 4.256 4.479 -0.223 25913
1357 1 7 . 1 1 3 3 GLU C C 3 176.186 176.186 176.040 0.146 25913
1358 1 7 . 1 1 3 3 GLU CA C 3 56.377 56.377 56.191 0.187 25913
1359 1 7 . 1 1 3 3 GLU CB C 3 30.549 30.549 29.846 0.703 25913
1360 1 7 . 1 1 3 3 GLU H H 3 8.274 8.274 7.662 0.612 25913
1361 1 7 . 1 1 4 4 ALA N N 4 125.716 125.716 122.089 3.627 25913
1362 1 7 . 1 1 4 4 ALA HA H 4 4.345 4.345 4.511 -0.166 25913
1363 1 7 . 1 1 4 4 ALA C C 4 177.530 177.530 177.560 -0.030 25913
1364 1 7 . 1 1 4 4 ALA CA C 4 52.413 52.413 51.828 0.584 25913
1365 1 7 . 1 1 4 4 ALA CB C 4 19.466 19.466 19.063 0.403 25913
1366 1 7 . 1 1 4 4 ALA H H 4 8.271 8.271 8.007 0.264 25913
1367 1 7 . 1 1 5 5 SER N N 5 117.161 117.161 116.544 0.617 25913
1368 1 7 . 1 1 5 5 SER HA H 5 4.724 4.724 4.411 0.313 25913
1369 1 7 . 1 1 5 5 SER C C 5 172.661 172.661 173.688 -1.027 25913
1370 1 7 . 1 1 5 5 SER CA C 5 56.354 56.354 59.457 -3.103 25913
1371 1 7 . 1 1 5 5 SER CB C 5 63.442 63.442 62.275 1.167 25913
1372 1 7 . 1 1 5 5 SER H H 5 8.259 8.259 8.394 -0.135 25913
1373 1 7 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.457 -0.043 25913
1374 1 7 . 1 1 6 6 PRO C C 6 176.523 176.523 176.017 0.506 25913
1375 1 7 . 1 1 6 6 PRO CA C 6 63.385 63.385 63.225 0.160 25913
1376 1 7 . 1 1 6 6 PRO CB C 6 32.187 32.187 32.165 0.022 25913
1377 1 7 . 1 1 7 7 HIS N N 7 120.170 120.170 122.661 -2.491 25913
1378 1 7 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.812 0.168 25913
1379 1 7 . 1 1 7 7 HIS C C 7 172.577 172.577 174.355 -1.778 25913
1380 1 7 . 1 1 7 7 HIS CA C 7 53.492 53.492 53.378 0.114 25913
1381 1 7 . 1 1 7 7 HIS CB C 7 29.133 29.133 29.505 -0.372 25913
1382 1 7 . 1 1 7 7 HIS H H 7 8.489 8.489 8.164 0.325 25913
1383 1 7 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.565 -0.019 25913
1384 1 7 . 1 1 8 8 PRO C C 8 177.382 177.382 176.381 1.001 25913
1385 1 7 . 1 1 8 8 PRO CA C 8 63.443 63.443 62.901 0.542 25913
1386 1 7 . 1 1 8 8 PRO CB C 8 32.377 32.377 32.700 -0.323 25913
1387 1 7 . 1 1 9 9 GLY N N 9 110.263 110.263 107.359 2.904 25913
1388 1 7 . 1 1 9 9 GLY C C 9 172.859 172.859 173.259 -0.400 25913
1389 1 7 . 1 1 9 9 GLY CA C 9 45.211 45.211 46.066 -0.856 25913
1390 1 7 . 1 1 9 9 GLY H H 9 8.635 8.635 8.961 -0.326 25913
1391 1 7 . 1 1 10 10 ARG N N 10 121.025 121.025 122.875 -1.850 25913
1392 1 7 . 1 1 10 10 ARG HA H 10 4.782 4.782 5.109 -0.327 25913
1393 1 7 . 1 1 10 10 ARG C C 10 175.125 175.125 174.852 0.273 25913
1394 1 7 . 1 1 10 10 ARG CA C 10 55.356 55.356 55.831 -0.475 25913
1395 1 7 . 1 1 10 10 ARG CB C 10 32.982 32.982 29.427 3.555 25913
1396 1 7 . 1 1 10 10 ARG H H 10 8.229 8.229 7.957 0.272 25913
1397 1 7 . 1 1 11 11 TYR N N 11 121.353 121.353 123.673 -2.320 25913
1398 1 7 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.699 -0.371 25913
1399 1 7 . 1 1 11 11 TYR C C 11 174.229 174.229 174.738 -0.509 25913
1400 1 7 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.020 1.029 25913
1401 1 7 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.478 -0.427 25913
1402 1 7 . 1 1 11 11 TYR H H 11 8.692 8.692 9.442 -0.750 25913
1403 1 7 . 1 1 12 12 PHE N N 12 122.456 122.456 122.256 0.200 25913
1404 1 7 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.319 -0.435 25913
1405 1 7 . 1 1 12 12 PHE C C 12 174.224 174.224 174.979 -0.755 25913
1406 1 7 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.419 0.600 25913
1407 1 7 . 1 1 12 12 PHE CB C 12 44.078 44.078 41.859 2.219 25913
1408 1 7 . 1 1 12 12 PHE H H 12 9.415 9.415 9.057 0.358 25913
1409 1 7 . 1 1 13 13 CYS N N 13 128.438 128.438 128.510 -0.072 25913
1410 1 7 . 1 1 13 13 CYS HA H 13 4.653 4.653 4.936 -0.283 25913
1411 1 7 . 1 1 13 13 CYS C C 13 176.686 176.686 175.936 0.750 25913
1412 1 7 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.906 0.422 25913
1413 1 7 . 1 1 13 13 CYS CB C 13 31.220 31.220 27.448 3.772 25913
1414 1 7 . 1 1 13 13 CYS H H 13 7.942 7.942 8.989 -1.047 25913
1415 1 7 . 1 1 14 14 HIS N N 14 126.467 126.467 126.528 -0.061 25913
1416 1 7 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.500 -0.177 25913
1417 1 7 . 1 1 14 14 HIS C C 14 175.452 175.452 176.577 -1.125 25913
1418 1 7 . 1 1 14 14 HIS CA C 14 58.736 58.736 58.636 0.100 25913
1419 1 7 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.248 -1.058 25913
1420 1 7 . 1 1 14 14 HIS H H 14 8.971 8.971 9.619 -0.648 25913
1421 1 7 . 1 1 15 15 CYS N N 15 123.882 123.882 117.415 6.467 25913
1422 1 7 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.315 0.127 25913
1423 1 7 . 1 1 15 15 CYS C C 15 176.939 176.939 175.771 1.168 25913
1424 1 7 . 1 1 15 15 CYS CA C 15 61.704 61.704 61.517 0.187 25913
1425 1 7 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.905 -0.564 25913
1426 1 7 . 1 1 15 15 CYS H H 15 9.195 9.195 8.298 0.897 25913
1427 1 7 . 1 1 16 16 CYS N N 16 124.898 124.898 119.374 5.524 25913
1428 1 7 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.582 -0.584 25913
1429 1 7 . 1 1 16 16 CYS C C 16 175.557 175.557 174.676 0.881 25913
1430 1 7 . 1 1 16 16 CYS CB C 16 30.961 30.961 27.757 3.204 25913
1431 1 7 . 1 1 16 16 CYS H H 16 9.794 9.794 8.107 1.687 25913
1432 1 7 . 1 1 17 17 SER N N 17 114.055 114.055 114.566 -0.511 25913
1433 1 7 . 1 1 17 17 SER HA H 17 3.755 3.755 4.153 -0.398 25913
1434 1 7 . 1 1 17 17 SER C C 17 173.790 173.790 173.253 0.537 25913
1435 1 7 . 1 1 17 17 SER CA C 17 58.868 58.868 59.576 -0.708 25913
1436 1 7 . 1 1 17 17 SER CB C 17 61.703 61.703 60.605 1.098 25913
1437 1 7 . 1 1 17 17 SER H H 17 7.950 7.950 8.280 -0.330 25913
1438 1 7 . 1 1 18 18 VAL N N 18 111.916 111.916 112.503 -0.587 25913
1439 1 7 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.206 0.252 25913
1440 1 7 . 1 1 18 18 VAL C C 18 173.765 173.765 173.433 0.332 25913
1441 1 7 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.623 -0.591 25913
1442 1 7 . 1 1 18 18 VAL CB C 18 36.667 36.667 35.120 1.547 25913
1443 1 7 . 1 1 18 18 VAL H H 18 6.438 6.438 7.085 -0.647 25913
1444 1 7 . 1 1 19 19 GLU N N 19 123.431 123.431 122.083 1.348 25913
1445 1 7 . 1 1 19 19 GLU HA H 19 5.023 5.023 5.201 -0.178 25913
1446 1 7 . 1 1 19 19 GLU C C 19 176.506 176.506 176.031 0.475 25913
1447 1 7 . 1 1 19 19 GLU CA C 19 56.818 56.818 55.695 1.123 25913
1448 1 7 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.479 -0.314 25913
1449 1 7 . 1 1 19 19 GLU H H 19 8.346 8.346 8.352 -0.006 25913
1450 1 7 . 1 1 20 20 ILE N N 20 117.751 117.751 121.256 -3.505 25913
1451 1 7 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.793 -0.052 25913
1452 1 7 . 1 1 20 20 ILE C C 20 175.511 175.511 173.781 1.730 25913
1453 1 7 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.460 -0.515 25913
1454 1 7 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.642 3.025 25913
1455 1 7 . 1 1 20 20 ILE H H 20 8.537 8.537 8.838 -0.301 25913
1456 1 7 . 1 1 21 21 VAL N N 21 124.220 124.220 121.986 2.234 25913
1457 1 7 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.185 -0.599 25913
1458 1 7 . 1 1 21 21 VAL C C 21 174.640 174.640 174.159 0.481 25913
1459 1 7 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.908 1.810 25913
1460 1 7 . 1 1 21 21 VAL CB C 21 32.503 32.503 33.224 -0.721 25913
1461 1 7 . 1 1 21 21 VAL H H 21 8.203 8.203 8.382 -0.179 25913
1462 1 7 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.679 -0.620 25913
1463 1 7 . 1 1 22 22 PRO C C 22 175.352 175.352 176.138 -0.786 25913
1464 1 7 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.583 0.078 25913
1465 1 7 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.316 -0.302 25913
1466 1 7 . 1 1 23 23 ARG N N 23 121.370 121.370 122.319 -0.949 25913
1467 1 7 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.220 0.035 25913
1468 1 7 . 1 1 23 23 ARG C C 23 175.759 175.759 176.553 -0.794 25913
1469 1 7 . 1 1 23 23 ARG CA C 23 56.052 56.052 56.022 0.030 25913
1470 1 7 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.194 1.692 25913
1471 1 7 . 1 1 23 23 ARG H H 23 8.635 8.635 8.109 0.526 25913
1472 1 7 . 1 1 24 24 LEU N N 24 127.914 127.914 127.213 0.701 25913
1473 1 7 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.762 0.411 25913
1474 1 7 . 1 1 24 24 LEU C C 24 175.774 175.774 175.880 -0.106 25913
1475 1 7 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.469 -5.531 25913
1476 1 7 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.266 2.154 25913
1477 1 7 . 1 1 24 24 LEU H H 24 8.521 8.521 8.651 -0.130 25913
1478 1 7 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.167 0.173 25913
1479 1 7 . 1 1 25 25 PRO C C 25 176.386 176.386 176.976 -0.590 25913
1480 1 7 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.470 -0.803 25913
1481 1 7 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.712 2.963 25913
1482 1 7 . 1 1 26 26 ASP N N 26 122.078 122.078 115.559 6.519 25913
1483 1 7 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.668 -0.281 25913
1484 1 7 . 1 1 26 26 ASP C C 26 175.321 175.321 176.029 -0.708 25913
1485 1 7 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.340 2.015 25913
1486 1 7 . 1 1 26 26 ASP CB C 26 41.066 41.066 42.902 -1.836 25913
1487 1 7 . 1 1 26 26 ASP H H 26 8.752 8.752 7.624 1.128 25913
1488 1 7 . 1 1 27 27 TYR N N 27 117.607 117.607 117.329 0.278 25913
1489 1 7 . 1 1 27 27 TYR HA H 27 3.449 3.449 3.986 -0.537 25913
1490 1 7 . 1 1 27 27 TYR C C 27 173.074 173.074 174.304 -1.230 25913
1491 1 7 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.370 1.067 25913
1492 1 7 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.839 -0.779 25913
1493 1 7 . 1 1 27 27 TYR H H 27 8.666 8.666 8.082 0.584 25913
1494 1 7 . 1 1 28 28 ILE N N 28 111.804 111.804 112.551 -0.747 25913
1495 1 7 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.565 0.210 25913
1496 1 7 . 1 1 28 28 ILE C C 28 175.083 175.083 174.497 0.586 25913
1497 1 7 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.535 -0.966 25913
1498 1 7 . 1 1 28 28 ILE CB C 28 42.107 42.107 41.209 0.898 25913
1499 1 7 . 1 1 28 28 ILE H H 28 6.761 6.761 7.268 -0.507 25913
1500 1 7 . 1 1 29 29 CYS N N 29 126.875 126.875 118.994 7.881 25913
1501 1 7 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.784 -0.376 25913
1502 1 7 . 1 1 29 29 CYS C C 29 175.932 175.932 175.048 0.884 25913
1503 1 7 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.827 0.575 25913
1504 1 7 . 1 1 29 29 CYS CB C 29 32.214 32.214 28.126 4.088 25913
1505 1 7 . 1 1 29 29 CYS H H 29 8.783 8.783 8.764 0.019 25913
1506 1 7 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.477 -0.095 25913
1507 1 7 . 1 1 30 30 PRO C C 30 176.824 176.824 177.158 -0.334 25913
1508 1 7 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.402 -0.362 25913
1509 1 7 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.868 0.476 25913
1510 1 7 . 1 1 31 31 ARG N N 31 124.131 124.131 117.007 7.124 25913
1511 1 7 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.424 -0.123 25913
1512 1 7 . 1 1 31 31 ARG C C 31 177.721 177.721 177.153 0.568 25913
1513 1 7 . 1 1 31 31 ARG CA C 31 58.190 58.190 57.623 0.567 25913
1514 1 7 . 1 1 31 31 ARG CB C 31 31.682 31.682 31.004 0.678 25913
1515 1 7 . 1 1 31 31 ARG H H 31 9.604 9.604 7.709 1.895 25913
1516 1 7 . 1 1 32 32 CYS N N 32 119.758 119.758 113.896 5.862 25913
1517 1 7 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.832 0.007 25913
1518 1 7 . 1 1 32 32 CYS C C 32 176.450 176.450 174.381 2.069 25913
1519 1 7 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.672 1.038 25913
1520 1 7 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.561 3.669 25913
1521 1 7 . 1 1 32 32 CYS H H 32 8.549 8.549 7.744 0.805 25913
1522 1 7 . 1 1 33 33 GLU N N 33 118.109 118.109 120.086 -1.977 25913
1523 1 7 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.130 -0.052 25913
1524 1 7 . 1 1 33 33 GLU C C 33 174.739 174.739 176.075 -1.336 25913
1525 1 7 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.508 1.010 25913
1526 1 7 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.435 -0.743 25913
1527 1 7 . 1 1 33 33 GLU H H 33 7.868 7.868 8.200 -0.332 25913
1528 1 7 . 1 1 34 34 SER N N 34 117.224 117.224 115.026 2.198 25913
1529 1 7 . 1 1 34 34 SER HA H 34 4.437 4.437 4.503 -0.066 25913
1530 1 7 . 1 1 34 34 SER C C 34 175.392 175.392 175.610 -0.218 25913
1531 1 7 . 1 1 34 34 SER CA C 34 59.277 59.277 59.755 -0.478 25913
1532 1 7 . 1 1 34 34 SER CB C 34 65.429 65.429 64.404 1.025 25913
1533 1 7 . 1 1 34 34 SER H H 34 8.786 8.786 7.928 0.858 25913
1534 1 7 . 1 1 35 35 GLY N N 35 111.095 111.095 107.528 3.567 25913
1535 1 7 . 1 1 35 35 GLY C C 35 175.730 175.730 174.368 1.362 25913
1536 1 7 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.702 0.539 25913
1537 1 7 . 1 1 35 35 GLY H H 35 8.511 8.511 8.571 -0.060 25913
1538 1 7 . 1 1 36 36 PHE N N 36 126.409 126.409 124.996 1.413 25913
1539 1 7 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.461 0.690 25913
1540 1 7 . 1 1 36 36 PHE C C 36 174.098 174.098 174.228 -0.130 25913
1541 1 7 . 1 1 36 36 PHE CA C 36 55.269 55.269 59.207 -3.938 25913
1542 1 7 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.417 -1.391 25913
1543 1 7 . 1 1 36 36 PHE H H 36 8.850 8.850 7.657 1.193 25913
1544 1 7 . 1 1 37 37 ILE N N 37 117.377 117.377 115.677 1.700 25913
1545 1 7 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.249 0.107 25913
1546 1 7 . 1 1 37 37 ILE C C 37 175.508 175.508 174.882 0.626 25913
1547 1 7 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.530 0.157 25913
1548 1 7 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.565 -1.417 25913
1549 1 7 . 1 1 37 37 ILE H H 37 7.972 7.972 7.799 0.173 25913
1550 1 7 . 1 1 38 38 GLU N N 38 124.869 124.869 122.426 2.443 25913
1551 1 7 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.591 0.294 25913
1552 1 7 . 1 1 38 38 GLU C C 38 174.300 174.300 175.410 -1.110 25913
1553 1 7 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.245 0.411 25913
1554 1 7 . 1 1 38 38 GLU CB C 38 34.589 34.589 31.663 2.926 25913
1555 1 7 . 1 1 38 38 GLU H H 38 9.131 9.131 8.727 0.404 25913
1556 1 7 . 1 1 39 39 GLU N N 39 127.840 127.840 127.313 0.527 25913
1557 1 7 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.132 0.716 25913
1558 1 7 . 1 1 39 39 GLU C C 39 175.507 175.507 175.608 -0.101 25913
1559 1 7 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.715 0.790 25913
1560 1 7 . 1 1 39 39 GLU CB C 39 30.249 30.249 28.820 1.429 25913
1561 1 7 . 1 1 39 39 GLU H H 39 8.844 8.844 8.682 0.162 25913
1562 1 8 . 1 1 0 0 SER HA H 0 4.525 4.525 4.789 -0.264 25913
1563 1 8 . 1 1 0 0 SER C C 0 174.776 174.776 174.947 -0.171 25913
1564 1 8 . 1 1 0 0 SER CA C 0 58.364 58.364 57.180 1.184 25913
1565 1 8 . 1 1 0 0 SER CB C 0 64.049 64.049 65.377 -1.328 25913
1566 1 8 . 1 1 1 1 MET N N 1 123.174 123.174 125.062 -1.888 25913
1567 1 8 . 1 1 1 1 MET HA H 1 4.486 4.486 4.566 -0.080 25913
1568 1 8 . 1 1 1 1 MET C C 1 176.177 176.177 175.633 0.544 25913
1569 1 8 . 1 1 1 1 MET CA C 1 55.804 55.804 55.804 -0.000 25913
1570 1 8 . 1 1 1 1 MET CB C 1 32.941 32.941 29.991 2.950 25913
1571 1 8 . 1 1 1 1 MET H H 1 8.592 8.592 9.183 -0.591 25913
1572 1 8 . 1 1 2 2 ALA N N 2 125.785 125.785 125.087 0.698 25913
1573 1 8 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.451 -0.158 25913
1574 1 8 . 1 1 2 2 ALA C C 2 177.812 177.812 178.380 -0.568 25913
1575 1 8 . 1 1 2 2 ALA CA C 2 52.809 52.809 53.632 -0.823 25913
1576 1 8 . 1 1 2 2 ALA CB C 2 19.224 19.224 19.585 -0.361 25913
1577 1 8 . 1 1 2 2 ALA H H 2 8.337 8.337 8.567 -0.230 25913
1578 1 8 . 1 1 3 3 GLU N N 3 120.731 120.731 120.478 0.253 25913
1579 1 8 . 1 1 3 3 GLU HA H 3 4.256 4.256 4.176 0.080 25913
1580 1 8 . 1 1 3 3 GLU C C 3 176.186 176.186 177.273 -1.087 25913
1581 1 8 . 1 1 3 3 GLU CA C 3 56.377 56.377 58.233 -1.856 25913
1582 1 8 . 1 1 3 3 GLU CB C 3 30.549 30.549 30.081 0.469 25913
1583 1 8 . 1 1 3 3 GLU H H 3 8.274 8.274 8.039 0.235 25913
1584 1 8 . 1 1 4 4 ALA N N 4 125.716 125.716 123.283 2.433 25913
1585 1 8 . 1 1 4 4 ALA HA H 4 4.345 4.345 4.580 -0.235 25913
1586 1 8 . 1 1 4 4 ALA C C 4 177.530 177.530 176.030 1.500 25913
1587 1 8 . 1 1 4 4 ALA CA C 4 52.413 52.413 51.595 0.818 25913
1588 1 8 . 1 1 4 4 ALA CB C 4 19.466 19.466 18.737 0.729 25913
1589 1 8 . 1 1 4 4 ALA H H 4 8.271 8.271 7.707 0.564 25913
1590 1 8 . 1 1 5 5 SER N N 5 117.161 117.161 116.768 0.393 25913
1591 1 8 . 1 1 5 5 SER HA H 5 4.724 4.724 4.366 0.358 25913
1592 1 8 . 1 1 5 5 SER C C 5 172.661 172.661 173.493 -0.832 25913
1593 1 8 . 1 1 5 5 SER CA C 5 56.354 56.354 57.850 -1.496 25913
1594 1 8 . 1 1 5 5 SER CB C 5 63.442 63.442 64.346 -0.904 25913
1595 1 8 . 1 1 5 5 SER H H 5 8.259 8.259 8.262 -0.003 25913
1596 1 8 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.684 -0.270 25913
1597 1 8 . 1 1 6 6 PRO C C 6 176.523 176.523 175.957 0.566 25913
1598 1 8 . 1 1 6 6 PRO CA C 6 63.385 63.385 62.436 0.949 25913
1599 1 8 . 1 1 6 6 PRO CB C 6 32.187 32.187 31.108 1.079 25913
1600 1 8 . 1 1 7 7 HIS N N 7 120.170 120.170 118.384 1.786 25913
1601 1 8 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.335 0.645 25913
1602 1 8 . 1 1 7 7 HIS C C 7 172.577 172.577 172.778 -0.201 25913
1603 1 8 . 1 1 7 7 HIS CA C 7 53.492 53.492 55.766 -2.274 25913
1604 1 8 . 1 1 7 7 HIS CB C 7 29.133 29.133 29.633 -0.500 25913
1605 1 8 . 1 1 7 7 HIS H H 7 8.489 8.489 7.902 0.587 25913
1606 1 8 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.490 0.056 25913
1607 1 8 . 1 1 8 8 PRO C C 8 177.382 177.382 176.452 0.930 25913
1608 1 8 . 1 1 8 8 PRO CA C 8 63.443 63.443 63.160 0.283 25913
1609 1 8 . 1 1 8 8 PRO CB C 8 32.377 32.377 32.373 0.004 25913
1610 1 8 . 1 1 9 9 GLY N N 9 110.263 110.263 109.656 0.607 25913
1611 1 8 . 1 1 9 9 GLY C C 9 172.859 172.859 173.296 -0.437 25913
1612 1 8 . 1 1 9 9 GLY CA C 9 45.211 45.211 46.169 -0.958 25913
1613 1 8 . 1 1 9 9 GLY H H 9 8.635 8.635 8.929 -0.294 25913
1614 1 8 . 1 1 10 10 ARG N N 10 121.025 121.025 123.209 -2.184 25913
1615 1 8 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.786 -0.004 25913
1616 1 8 . 1 1 10 10 ARG C C 10 175.125 175.125 174.809 0.316 25913
1617 1 8 . 1 1 10 10 ARG CA C 10 55.356 55.356 56.068 -0.712 25913
1618 1 8 . 1 1 10 10 ARG CB C 10 32.982 32.982 29.165 3.817 25913
1619 1 8 . 1 1 10 10 ARG H H 10 8.229 8.229 8.063 0.166 25913
1620 1 8 . 1 1 11 11 TYR N N 11 121.353 121.353 123.660 -2.307 25913
1621 1 8 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.711 -0.383 25913
1622 1 8 . 1 1 11 11 TYR C C 11 174.229 174.229 174.736 -0.507 25913
1623 1 8 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.058 0.991 25913
1624 1 8 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.541 -0.490 25913
1625 1 8 . 1 1 11 11 TYR H H 11 8.692 8.692 9.386 -0.694 25913
1626 1 8 . 1 1 12 12 PHE N N 12 122.456 122.456 122.098 0.358 25913
1627 1 8 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.303 -0.419 25913
1628 1 8 . 1 1 12 12 PHE C C 12 174.224 174.224 174.839 -0.615 25913
1629 1 8 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.417 0.602 25913
1630 1 8 . 1 1 12 12 PHE CB C 12 44.078 44.078 41.842 2.236 25913
1631 1 8 . 1 1 12 12 PHE H H 12 9.415 9.415 9.102 0.313 25913
1632 1 8 . 1 1 13 13 CYS N N 13 128.438 128.438 128.579 -0.141 25913
1633 1 8 . 1 1 13 13 CYS HA H 13 4.653 4.653 4.990 -0.337 25913
1634 1 8 . 1 1 13 13 CYS C C 13 176.686 176.686 175.314 1.372 25913
1635 1 8 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.699 0.629 25913
1636 1 8 . 1 1 13 13 CYS CB C 13 31.220 31.220 27.974 3.246 25913
1637 1 8 . 1 1 13 13 CYS H H 13 7.942 7.942 8.921 -0.979 25913
1638 1 8 . 1 1 14 14 HIS N N 14 126.467 126.467 126.421 0.046 25913
1639 1 8 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.635 -0.312 25913
1640 1 8 . 1 1 14 14 HIS C C 14 175.452 175.452 175.913 -0.461 25913
1641 1 8 . 1 1 14 14 HIS CA C 14 58.736 58.736 58.098 0.638 25913
1642 1 8 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.518 -1.327 25913
1643 1 8 . 1 1 14 14 HIS H H 14 8.971 8.971 9.449 -0.478 25913
1644 1 8 . 1 1 15 15 CYS N N 15 123.882 123.882 117.727 6.155 25913
1645 1 8 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.407 0.035 25913
1646 1 8 . 1 1 15 15 CYS C C 15 176.939 176.939 175.838 1.101 25913
1647 1 8 . 1 1 15 15 CYS CA C 15 61.704 61.704 61.259 0.445 25913
1648 1 8 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.200 0.141 25913
1649 1 8 . 1 1 15 15 CYS H H 15 9.195 9.195 8.224 0.971 25913
1650 1 8 . 1 1 16 16 CYS N N 16 124.898 124.898 119.934 4.964 25913
1651 1 8 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.563 -0.565 25913
1652 1 8 . 1 1 16 16 CYS C C 16 175.557 175.557 174.636 0.921 25913
1653 1 8 . 1 1 16 16 CYS CB C 16 30.961 30.961 27.695 3.266 25913
1654 1 8 . 1 1 16 16 CYS H H 16 9.794 9.794 7.949 1.845 25913
1655 1 8 . 1 1 17 17 SER N N 17 114.055 114.055 114.086 -0.031 25913
1656 1 8 . 1 1 17 17 SER HA H 17 3.755 3.755 4.069 -0.314 25913
1657 1 8 . 1 1 17 17 SER C C 17 173.790 173.790 173.230 0.560 25913
1658 1 8 . 1 1 17 17 SER CA C 17 58.868 58.868 59.678 -0.810 25913
1659 1 8 . 1 1 17 17 SER CB C 17 61.703 61.703 60.336 1.367 25913
1660 1 8 . 1 1 17 17 SER H H 17 7.950 7.950 8.170 -0.220 25913
1661 1 8 . 1 1 18 18 VAL N N 18 111.916 111.916 111.958 -0.042 25913
1662 1 8 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.246 0.212 25913
1663 1 8 . 1 1 18 18 VAL C C 18 173.765 173.765 173.606 0.159 25913
1664 1 8 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.049 -0.017 25913
1665 1 8 . 1 1 18 18 VAL CB C 18 36.667 36.667 35.446 1.222 25913
1666 1 8 . 1 1 18 18 VAL H H 18 6.438 6.438 7.021 -0.583 25913
1667 1 8 . 1 1 19 19 GLU N N 19 123.431 123.431 123.251 0.180 25913
1668 1 8 . 1 1 19 19 GLU HA H 19 5.023 5.023 4.990 0.033 25913
1669 1 8 . 1 1 19 19 GLU C C 19 176.506 176.506 175.635 0.871 25913
1670 1 8 . 1 1 19 19 GLU CA C 19 56.818 56.818 56.347 0.471 25913
1671 1 8 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.595 -0.430 25913
1672 1 8 . 1 1 19 19 GLU H H 19 8.346 8.346 8.333 0.013 25913
1673 1 8 . 1 1 20 20 ILE N N 20 117.751 117.751 119.922 -2.171 25913
1674 1 8 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.578 0.163 25913
1675 1 8 . 1 1 20 20 ILE C C 20 175.511 175.511 173.734 1.777 25913
1676 1 8 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.142 -0.197 25913
1677 1 8 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.896 2.771 25913
1678 1 8 . 1 1 20 20 ILE H H 20 8.537 8.537 9.236 -0.699 25913
1679 1 8 . 1 1 21 21 VAL N N 21 124.220 124.220 121.785 2.435 25913
1680 1 8 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.317 -0.731 25913
1681 1 8 . 1 1 21 21 VAL C C 21 174.640 174.640 173.814 0.826 25913
1682 1 8 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.785 1.933 25913
1683 1 8 . 1 1 21 21 VAL CB C 21 32.503 32.503 33.982 -1.479 25913
1684 1 8 . 1 1 21 21 VAL H H 21 8.203 8.203 8.384 -0.181 25913
1685 1 8 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.630 -0.571 25913
1686 1 8 . 1 1 22 22 PRO C C 22 175.352 175.352 176.048 -0.696 25913
1687 1 8 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.654 0.007 25913
1688 1 8 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.294 -0.280 25913
1689 1 8 . 1 1 23 23 ARG N N 23 121.370 121.370 121.950 -0.580 25913
1690 1 8 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.299 -0.044 25913
1691 1 8 . 1 1 23 23 ARG C C 23 175.759 175.759 176.589 -0.830 25913
1692 1 8 . 1 1 23 23 ARG CA C 23 56.052 56.052 55.819 0.233 25913
1693 1 8 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.269 1.617 25913
1694 1 8 . 1 1 23 23 ARG H H 23 8.635 8.635 8.156 0.479 25913
1695 1 8 . 1 1 24 24 LEU N N 24 127.914 127.914 127.195 0.719 25913
1696 1 8 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.748 0.425 25913
1697 1 8 . 1 1 24 24 LEU C C 24 175.774 175.774 175.905 -0.131 25913
1698 1 8 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.505 -5.567 25913
1699 1 8 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.268 2.152 25913
1700 1 8 . 1 1 24 24 LEU H H 24 8.521 8.521 8.699 -0.178 25913
1701 1 8 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.188 0.152 25913
1702 1 8 . 1 1 25 25 PRO C C 25 176.386 176.386 176.999 -0.613 25913
1703 1 8 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.440 -0.773 25913
1704 1 8 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.748 2.928 25913
1705 1 8 . 1 1 26 26 ASP N N 26 122.078 122.078 115.603 6.475 25913
1706 1 8 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.668 -0.281 25913
1707 1 8 . 1 1 26 26 ASP C C 26 175.321 175.321 176.082 -0.761 25913
1708 1 8 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.415 1.940 25913
1709 1 8 . 1 1 26 26 ASP CB C 26 41.066 41.066 43.167 -2.101 25913
1710 1 8 . 1 1 26 26 ASP H H 26 8.752 8.752 7.698 1.054 25913
1711 1 8 . 1 1 27 27 TYR N N 27 117.607 117.607 117.210 0.397 25913
1712 1 8 . 1 1 27 27 TYR HA H 27 3.449 3.449 3.979 -0.530 25913
1713 1 8 . 1 1 27 27 TYR C C 27 173.074 173.074 174.365 -1.291 25913
1714 1 8 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.331 1.107 25913
1715 1 8 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.849 -0.789 25913
1716 1 8 . 1 1 27 27 TYR H H 27 8.666 8.666 8.128 0.538 25913
1717 1 8 . 1 1 28 28 ILE N N 28 111.804 111.804 113.001 -1.197 25913
1718 1 8 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.522 0.253 25913
1719 1 8 . 1 1 28 28 ILE C C 28 175.083 175.083 174.642 0.441 25913
1720 1 8 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.637 -1.068 25913
1721 1 8 . 1 1 28 28 ILE CB C 28 42.107 42.107 40.923 1.184 25913
1722 1 8 . 1 1 28 28 ILE H H 28 6.761 6.761 7.251 -0.490 25913
1723 1 8 . 1 1 29 29 CYS N N 29 126.875 126.875 119.079 7.796 25913
1724 1 8 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.760 -0.352 25913
1725 1 8 . 1 1 29 29 CYS C C 29 175.932 175.932 175.201 0.731 25913
1726 1 8 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.741 0.661 25913
1727 1 8 . 1 1 29 29 CYS CB C 29 32.214 32.214 28.003 4.211 25913
1728 1 8 . 1 1 29 29 CYS H H 29 8.783 8.783 8.735 0.048 25913
1729 1 8 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.392 -0.010 25913
1730 1 8 . 1 1 30 30 PRO C C 30 176.824 176.824 177.769 -0.945 25913
1731 1 8 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.730 -0.689 25913
1732 1 8 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.968 0.376 25913
1733 1 8 . 1 1 31 31 ARG N N 31 124.131 124.131 117.555 6.576 25913
1734 1 8 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.392 -0.091 25913
1735 1 8 . 1 1 31 31 ARG C C 31 177.721 177.721 177.233 0.488 25913
1736 1 8 . 1 1 31 31 ARG CA C 31 58.190 58.190 58.074 0.116 25913
1737 1 8 . 1 1 31 31 ARG CB C 31 31.682 31.682 30.648 1.034 25913
1738 1 8 . 1 1 31 31 ARG H H 31 9.604 9.604 7.756 1.848 25913
1739 1 8 . 1 1 32 32 CYS N N 32 119.758 119.758 113.553 6.205 25913
1740 1 8 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.854 -0.015 25913
1741 1 8 . 1 1 32 32 CYS C C 32 176.450 176.450 174.569 1.881 25913
1742 1 8 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.572 1.138 25913
1743 1 8 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.344 3.886 25913
1744 1 8 . 1 1 32 32 CYS H H 32 8.549 8.549 7.767 0.782 25913
1745 1 8 . 1 1 33 33 GLU N N 33 118.109 118.109 119.773 -1.664 25913
1746 1 8 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.029 0.049 25913
1747 1 8 . 1 1 33 33 GLU C C 33 174.739 174.739 176.082 -1.343 25913
1748 1 8 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.563 0.955 25913
1749 1 8 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.149 -0.457 25913
1750 1 8 . 1 1 33 33 GLU H H 33 7.868 7.868 8.236 -0.368 25913
1751 1 8 . 1 1 34 34 SER N N 34 117.224 117.224 114.798 2.426 25913
1752 1 8 . 1 1 34 34 SER HA H 34 4.437 4.437 4.468 -0.032 25913
1753 1 8 . 1 1 34 34 SER C C 34 175.392 175.392 175.514 -0.122 25913
1754 1 8 . 1 1 34 34 SER CA C 34 59.277 59.277 59.871 -0.594 25913
1755 1 8 . 1 1 34 34 SER CB C 34 65.429 65.429 64.332 1.097 25913
1756 1 8 . 1 1 34 34 SER H H 34 8.786 8.786 7.982 0.804 25913
1757 1 8 . 1 1 35 35 GLY N N 35 111.095 111.095 107.649 3.446 25913
1758 1 8 . 1 1 35 35 GLY C C 35 175.730 175.730 174.207 1.523 25913
1759 1 8 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.593 0.648 25913
1760 1 8 . 1 1 35 35 GLY H H 35 8.511 8.511 8.472 0.039 25913
1761 1 8 . 1 1 36 36 PHE N N 36 126.409 126.409 125.114 1.295 25913
1762 1 8 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.449 0.702 25913
1763 1 8 . 1 1 36 36 PHE C C 36 174.098 174.098 174.801 -0.703 25913
1764 1 8 . 1 1 36 36 PHE CA C 36 55.269 55.269 59.130 -3.861 25913
1765 1 8 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.810 -1.783 25913
1766 1 8 . 1 1 36 36 PHE H H 36 8.850 8.850 7.640 1.210 25913
1767 1 8 . 1 1 37 37 ILE N N 37 117.377 117.377 116.230 1.147 25913
1768 1 8 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.365 -0.009 25913
1769 1 8 . 1 1 37 37 ILE C C 37 175.508 175.508 174.748 0.760 25913
1770 1 8 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.758 -0.070 25913
1771 1 8 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.686 -1.538 25913
1772 1 8 . 1 1 37 37 ILE H H 37 7.972 7.972 7.833 0.139 25913
1773 1 8 . 1 1 38 38 GLU N N 38 124.869 124.869 122.695 2.174 25913
1774 1 8 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.615 0.270 25913
1775 1 8 . 1 1 38 38 GLU C C 38 174.300 174.300 175.353 -1.053 25913
1776 1 8 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.914 -0.258 25913
1777 1 8 . 1 1 38 38 GLU CB C 38 34.589 34.589 32.417 2.171 25913
1778 1 8 . 1 1 38 38 GLU H H 38 9.131 9.131 8.814 0.317 25913
1779 1 8 . 1 1 39 39 GLU N N 39 127.840 127.840 126.934 0.906 25913
1780 1 8 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.146 0.702 25913
1781 1 8 . 1 1 39 39 GLU C C 39 175.507 175.507 175.617 -0.110 25913
1782 1 8 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.695 0.810 25913
1783 1 8 . 1 1 39 39 GLU CB C 39 30.249 30.249 28.884 1.365 25913
1784 1 8 . 1 1 39 39 GLU H H 39 8.844 8.844 8.661 0.183 25913
1785 1 9 . 1 1 0 0 SER HA H 0 4.525 4.525 4.255 0.270 25913
1786 1 9 . 1 1 0 0 SER C C 0 174.776 174.776 174.610 0.166 25913
1787 1 9 . 1 1 0 0 SER CA C 0 58.364 58.364 58.978 -0.614 25913
1788 1 9 . 1 1 0 0 SER CB C 0 64.049 64.049 62.360 1.689 25913
1789 1 9 . 1 1 1 1 MET N N 1 123.174 123.174 112.806 10.368 25913
1790 1 9 . 1 1 1 1 MET HA H 1 4.486 4.486 4.112 0.374 25913
1791 1 9 . 1 1 1 1 MET C C 1 176.177 176.177 174.876 1.301 25913
1792 1 9 . 1 1 1 1 MET CA C 1 55.804 55.804 56.096 -0.291 25913
1793 1 9 . 1 1 1 1 MET CB C 1 32.941 32.941 30.985 1.956 25913
1794 1 9 . 1 1 1 1 MET H H 1 8.592 8.592 8.263 0.329 25913
1795 1 9 . 1 1 2 2 ALA N N 2 125.785 125.785 121.912 3.873 25913
1796 1 9 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.474 -0.181 25913
1797 1 9 . 1 1 2 2 ALA C C 2 177.812 177.812 176.354 1.458 25913
1798 1 9 . 1 1 2 2 ALA CA C 2 52.809 52.809 52.131 0.678 25913
1799 1 9 . 1 1 2 2 ALA CB C 2 19.224 19.224 19.750 -0.526 25913
1800 1 9 . 1 1 2 2 ALA H H 2 8.337 8.337 7.551 0.786 25913
1801 1 9 . 1 1 3 3 GLU N N 3 120.731 120.731 117.750 2.981 25913
1802 1 9 . 1 1 3 3 GLU HA H 3 4.256 4.256 4.057 0.199 25913
1803 1 9 . 1 1 3 3 GLU C C 3 176.186 176.186 175.499 0.687 25913
1804 1 9 . 1 1 3 3 GLU CA C 3 56.377 56.377 56.786 -0.409 25913
1805 1 9 . 1 1 3 3 GLU CB C 3 30.549 30.549 29.830 0.719 25913
1806 1 9 . 1 1 3 3 GLU H H 3 8.274 8.274 8.301 -0.027 25913
1807 1 9 . 1 1 4 4 ALA N N 4 125.716 125.716 128.594 -2.878 25913
1808 1 9 . 1 1 4 4 ALA HA H 4 4.345 4.345 4.624 -0.279 25913
1809 1 9 . 1 1 4 4 ALA C C 4 177.530 177.530 176.483 1.047 25913
1810 1 9 . 1 1 4 4 ALA CA C 4 52.413 52.413 52.205 0.208 25913
1811 1 9 . 1 1 4 4 ALA CB C 4 19.466 19.466 18.565 0.901 25913
1812 1 9 . 1 1 4 4 ALA H H 4 8.271 8.271 8.434 -0.163 25913
1813 1 9 . 1 1 5 5 SER N N 5 117.161 117.161 117.360 -0.199 25913
1814 1 9 . 1 1 5 5 SER HA H 5 4.724 4.724 4.965 -0.241 25913
1815 1 9 . 1 1 5 5 SER C C 5 172.661 172.661 173.287 -0.626 25913
1816 1 9 . 1 1 5 5 SER CA C 5 56.354 56.354 56.341 0.013 25913
1817 1 9 . 1 1 5 5 SER CB C 5 63.442 63.442 63.775 -0.333 25913
1818 1 9 . 1 1 5 5 SER H H 5 8.259 8.259 7.829 0.430 25913
1819 1 9 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.319 0.095 25913
1820 1 9 . 1 1 6 6 PRO C C 6 176.523 176.523 175.989 0.534 25913
1821 1 9 . 1 1 6 6 PRO CA C 6 63.385 63.385 64.763 -1.378 25913
1822 1 9 . 1 1 6 6 PRO CB C 6 32.187 32.187 31.625 0.562 25913
1823 1 9 . 1 1 7 7 HIS N N 7 120.170 120.170 117.109 3.061 25913
1824 1 9 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.402 0.578 25913
1825 1 9 . 1 1 7 7 HIS C C 7 172.577 172.577 173.022 -0.445 25913
1826 1 9 . 1 1 7 7 HIS CA C 7 53.492 53.492 55.043 -1.551 25913
1827 1 9 . 1 1 7 7 HIS CB C 7 29.133 29.133 29.590 -0.457 25913
1828 1 9 . 1 1 7 7 HIS H H 7 8.489 8.489 8.295 0.194 25913
1829 1 9 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.708 -0.163 25913
1830 1 9 . 1 1 8 8 PRO C C 8 177.382 177.382 175.527 1.855 25913
1831 1 9 . 1 1 8 8 PRO CA C 8 63.443 63.443 62.057 1.386 25913
1832 1 9 . 1 1 8 8 PRO CB C 8 32.377 32.377 33.010 -0.633 25913
1833 1 9 . 1 1 9 9 GLY N N 9 110.263 110.263 106.949 3.314 25913
1834 1 9 . 1 1 9 9 GLY C C 9 172.859 172.859 173.511 -0.652 25913
1835 1 9 . 1 1 9 9 GLY CA C 9 45.211 45.211 45.721 -0.510 25913
1836 1 9 . 1 1 9 9 GLY H H 9 8.635 8.635 8.797 -0.162 25913
1837 1 9 . 1 1 10 10 ARG N N 10 121.025 121.025 122.682 -1.657 25913
1838 1 9 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.590 0.192 25913
1839 1 9 . 1 1 10 10 ARG C C 10 175.125 175.125 174.887 0.238 25913
1840 1 9 . 1 1 10 10 ARG CA C 10 55.356 55.356 56.336 -0.980 25913
1841 1 9 . 1 1 10 10 ARG CB C 10 32.982 32.982 28.884 4.098 25913
1842 1 9 . 1 1 10 10 ARG H H 10 8.229 8.229 7.898 0.331 25913
1843 1 9 . 1 1 11 11 TYR N N 11 121.353 121.353 123.735 -2.382 25913
1844 1 9 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.625 -0.297 25913
1845 1 9 . 1 1 11 11 TYR C C 11 174.229 174.229 174.820 -0.591 25913
1846 1 9 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.081 0.968 25913
1847 1 9 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.409 -0.358 25913
1848 1 9 . 1 1 11 11 TYR H H 11 8.692 8.692 9.364 -0.672 25913
1849 1 9 . 1 1 12 12 PHE N N 12 122.456 122.456 121.800 0.656 25913
1850 1 9 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.291 -0.407 25913
1851 1 9 . 1 1 12 12 PHE C C 12 174.224 174.224 174.598 -0.374 25913
1852 1 9 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.480 0.539 25913
1853 1 9 . 1 1 12 12 PHE CB C 12 44.078 44.078 42.156 1.922 25913
1854 1 9 . 1 1 12 12 PHE H H 12 9.415 9.415 8.977 0.438 25913
1855 1 9 . 1 1 13 13 CYS N N 13 128.438 128.438 128.426 0.012 25913
1856 1 9 . 1 1 13 13 CYS HA H 13 4.653 4.653 5.046 -0.393 25913
1857 1 9 . 1 1 13 13 CYS C C 13 176.686 176.686 175.338 1.348 25913
1858 1 9 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.507 0.821 25913
1859 1 9 . 1 1 13 13 CYS CB C 13 31.220 31.220 28.192 3.028 25913
1860 1 9 . 1 1 13 13 CYS H H 13 7.942 7.942 8.909 -0.967 25913
1861 1 9 . 1 1 14 14 HIS N N 14 126.467 126.467 125.931 0.536 25913
1862 1 9 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.564 -0.241 25913
1863 1 9 . 1 1 14 14 HIS C C 14 175.452 175.452 176.321 -0.869 25913
1864 1 9 . 1 1 14 14 HIS CA C 14 58.736 58.736 58.503 0.233 25913
1865 1 9 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.541 -1.350 25913
1866 1 9 . 1 1 14 14 HIS H H 14 8.971 8.971 9.589 -0.618 25913
1867 1 9 . 1 1 15 15 CYS N N 15 123.882 123.882 117.633 6.249 25913
1868 1 9 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.350 0.092 25913
1869 1 9 . 1 1 15 15 CYS C C 15 176.939 176.939 175.897 1.042 25913
1870 1 9 . 1 1 15 15 CYS CA C 15 61.704 61.704 61.884 -0.180 25913
1871 1 9 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.299 0.042 25913
1872 1 9 . 1 1 15 15 CYS H H 15 9.195 9.195 8.322 0.873 25913
1873 1 9 . 1 1 16 16 CYS N N 16 124.898 124.898 117.879 7.019 25913
1874 1 9 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.595 -0.597 25913
1875 1 9 . 1 1 16 16 CYS C C 16 175.557 175.557 173.960 1.597 25913
1876 1 9 . 1 1 16 16 CYS CB C 16 30.961 30.961 28.536 2.425 25913
1877 1 9 . 1 1 16 16 CYS H H 16 9.794 9.794 7.817 1.977 25913
1878 1 9 . 1 1 17 17 SER N N 17 114.055 114.055 114.618 -0.563 25913
1879 1 9 . 1 1 17 17 SER HA H 17 3.755 3.755 4.095 -0.340 25913
1880 1 9 . 1 1 17 17 SER C C 17 173.790 173.790 173.184 0.606 25913
1881 1 9 . 1 1 17 17 SER CA C 17 58.868 58.868 59.338 -0.470 25913
1882 1 9 . 1 1 17 17 SER CB C 17 61.703 61.703 60.863 0.840 25913
1883 1 9 . 1 1 17 17 SER H H 17 7.950 7.950 7.951 -0.001 25913
1884 1 9 . 1 1 18 18 VAL N N 18 111.916 111.916 112.683 -0.767 25913
1885 1 9 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.307 0.151 25913
1886 1 9 . 1 1 18 18 VAL C C 18 173.765 173.765 173.495 0.270 25913
1887 1 9 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.676 -0.644 25913
1888 1 9 . 1 1 18 18 VAL CB C 18 36.667 36.667 34.918 1.749 25913
1889 1 9 . 1 1 18 18 VAL H H 18 6.438 6.438 7.053 -0.615 25913
1890 1 9 . 1 1 19 19 GLU N N 19 123.431 123.431 122.972 0.459 25913
1891 1 9 . 1 1 19 19 GLU HA H 19 5.023 5.023 5.021 0.002 25913
1892 1 9 . 1 1 19 19 GLU C C 19 176.506 176.506 175.895 0.611 25913
1893 1 9 . 1 1 19 19 GLU CA C 19 56.818 56.818 55.908 0.910 25913
1894 1 9 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.687 -0.522 25913
1895 1 9 . 1 1 19 19 GLU H H 19 8.346 8.346 8.356 -0.010 25913
1896 1 9 . 1 1 20 20 ILE N N 20 117.751 117.751 121.987 -4.236 25913
1897 1 9 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.642 0.099 25913
1898 1 9 . 1 1 20 20 ILE C C 20 175.511 175.511 173.902 1.609 25913
1899 1 9 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.487 -0.542 25913
1900 1 9 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.952 2.715 25913
1901 1 9 . 1 1 20 20 ILE H H 20 8.537 8.537 8.991 -0.454 25913
1902 1 9 . 1 1 21 21 VAL N N 21 124.220 124.220 121.949 2.271 25913
1903 1 9 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.163 -0.577 25913
1904 1 9 . 1 1 21 21 VAL C C 21 174.640 174.640 174.072 0.568 25913
1905 1 9 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.822 1.896 25913
1906 1 9 . 1 1 21 21 VAL CB C 21 32.503 32.503 33.049 -0.546 25913
1907 1 9 . 1 1 21 21 VAL H H 21 8.203 8.203 8.350 -0.147 25913
1908 1 9 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.689 -0.630 25913
1909 1 9 . 1 1 22 22 PRO C C 22 175.352 175.352 176.145 -0.793 25913
1910 1 9 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.515 0.146 25913
1911 1 9 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.344 -0.330 25913
1912 1 9 . 1 1 23 23 ARG N N 23 121.370 121.370 122.636 -1.266 25913
1913 1 9 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.243 0.012 25913
1914 1 9 . 1 1 23 23 ARG C C 23 175.759 175.759 176.668 -0.909 25913
1915 1 9 . 1 1 23 23 ARG CA C 23 56.052 56.052 56.039 0.013 25913
1916 1 9 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.184 1.702 25913
1917 1 9 . 1 1 23 23 ARG H H 23 8.635 8.635 8.065 0.570 25913
1918 1 9 . 1 1 24 24 LEU N N 24 127.914 127.914 127.413 0.501 25913
1919 1 9 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.776 0.397 25913
1920 1 9 . 1 1 24 24 LEU C C 24 175.774 175.774 175.892 -0.118 25913
1921 1 9 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.587 -5.649 25913
1922 1 9 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.277 2.143 25913
1923 1 9 . 1 1 24 24 LEU H H 24 8.521 8.521 8.719 -0.198 25913
1924 1 9 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.183 0.157 25913
1925 1 9 . 1 1 25 25 PRO C C 25 176.386 176.386 176.954 -0.568 25913
1926 1 9 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.493 -0.826 25913
1927 1 9 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.780 2.896 25913
1928 1 9 . 1 1 26 26 ASP N N 26 122.078 122.078 115.598 6.480 25913
1929 1 9 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.657 -0.270 25913
1930 1 9 . 1 1 26 26 ASP C C 26 175.321 175.321 176.046 -0.725 25913
1931 1 9 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.608 1.747 25913
1932 1 9 . 1 1 26 26 ASP CB C 26 41.066 41.066 42.024 -0.958 25913
1933 1 9 . 1 1 26 26 ASP H H 26 8.752 8.752 7.628 1.124 25913
1934 1 9 . 1 1 27 27 TYR N N 27 117.607 117.607 116.523 1.084 25913
1935 1 9 . 1 1 27 27 TYR HA H 27 3.449 3.449 4.019 -0.570 25913
1936 1 9 . 1 1 27 27 TYR C C 27 173.074 173.074 174.320 -1.246 25913
1937 1 9 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.277 1.160 25913
1938 1 9 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.763 -0.703 25913
1939 1 9 . 1 1 27 27 TYR H H 27 8.666 8.666 8.174 0.492 25913
1940 1 9 . 1 1 28 28 ILE N N 28 111.804 111.804 112.492 -0.688 25913
1941 1 9 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.502 0.273 25913
1942 1 9 . 1 1 28 28 ILE C C 28 175.083 175.083 174.330 0.753 25913
1943 1 9 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.106 -0.537 25913
1944 1 9 . 1 1 28 28 ILE CB C 28 42.107 42.107 41.500 0.607 25913
1945 1 9 . 1 1 28 28 ILE H H 28 6.761 6.761 7.287 -0.526 25913
1946 1 9 . 1 1 29 29 CYS N N 29 126.875 126.875 118.705 8.170 25913
1947 1 9 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.790 -0.382 25913
1948 1 9 . 1 1 29 29 CYS C C 29 175.932 175.932 175.121 0.811 25913
1949 1 9 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.687 0.715 25913
1950 1 9 . 1 1 29 29 CYS CB C 29 32.214 32.214 28.126 4.088 25913
1951 1 9 . 1 1 29 29 CYS H H 29 8.783 8.783 8.726 0.057 25913
1952 1 9 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.449 -0.067 25913
1953 1 9 . 1 1 30 30 PRO C C 30 176.824 176.824 177.187 -0.363 25913
1954 1 9 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.153 -0.114 25913
1955 1 9 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.980 0.364 25913
1956 1 9 . 1 1 31 31 ARG N N 31 124.131 124.131 117.486 6.645 25913
1957 1 9 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.454 -0.153 25913
1958 1 9 . 1 1 31 31 ARG C C 31 177.721 177.721 177.168 0.553 25913
1959 1 9 . 1 1 31 31 ARG CA C 31 58.190 58.190 57.663 0.527 25913
1960 1 9 . 1 1 31 31 ARG CB C 31 31.682 31.682 30.967 0.715 25913
1961 1 9 . 1 1 31 31 ARG H H 31 9.604 9.604 7.682 1.922 25913
1962 1 9 . 1 1 32 32 CYS N N 32 119.758 119.758 114.363 5.395 25913
1963 1 9 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.856 -0.017 25913
1964 1 9 . 1 1 32 32 CYS C C 32 176.450 176.450 174.434 2.016 25913
1965 1 9 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.637 1.073 25913
1966 1 9 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.324 3.906 25913
1967 1 9 . 1 1 32 32 CYS H H 32 8.549 8.549 7.776 0.773 25913
1968 1 9 . 1 1 33 33 GLU N N 33 118.109 118.109 119.855 -1.746 25913
1969 1 9 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.053 0.025 25913
1970 1 9 . 1 1 33 33 GLU C C 33 174.739 174.739 176.096 -1.357 25913
1971 1 9 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.546 0.972 25913
1972 1 9 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.083 -0.391 25913
1973 1 9 . 1 1 33 33 GLU H H 33 7.868 7.868 8.231 -0.363 25913
1974 1 9 . 1 1 34 34 SER N N 34 117.224 117.224 115.090 2.134 25913
1975 1 9 . 1 1 34 34 SER HA H 34 4.437 4.437 4.486 -0.049 25913
1976 1 9 . 1 1 34 34 SER C C 34 175.392 175.392 175.608 -0.216 25913
1977 1 9 . 1 1 34 34 SER CA C 34 59.277 59.277 59.885 -0.608 25913
1978 1 9 . 1 1 34 34 SER CB C 34 65.429 65.429 64.413 1.016 25913
1979 1 9 . 1 1 34 34 SER H H 34 8.786 8.786 7.991 0.795 25913
1980 1 9 . 1 1 35 35 GLY N N 35 111.095 111.095 108.043 3.052 25913
1981 1 9 . 1 1 35 35 GLY C C 35 175.730 175.730 174.571 1.159 25913
1982 1 9 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.612 0.629 25913
1983 1 9 . 1 1 35 35 GLY H H 35 8.511 8.511 8.406 0.105 25913
1984 1 9 . 1 1 36 36 PHE N N 36 126.409 126.409 125.119 1.290 25913
1985 1 9 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.478 0.673 25913
1986 1 9 . 1 1 36 36 PHE C C 36 174.098 174.098 174.662 -0.564 25913
1987 1 9 . 1 1 36 36 PHE CA C 36 55.269 55.269 58.831 -3.562 25913
1988 1 9 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.440 -1.413 25913
1989 1 9 . 1 1 36 36 PHE H H 36 8.850 8.850 7.802 1.048 25913
1990 1 9 . 1 1 37 37 ILE N N 37 117.377 117.377 115.695 1.682 25913
1991 1 9 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.482 -0.126 25913
1992 1 9 . 1 1 37 37 ILE C C 37 175.508 175.508 175.003 0.505 25913
1993 1 9 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.602 0.084 25913
1994 1 9 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.455 -1.306 25913
1995 1 9 . 1 1 37 37 ILE H H 37 7.972 7.972 7.959 0.013 25913
1996 1 9 . 1 1 38 38 GLU N N 38 124.869 124.869 123.180 1.689 25913
1997 1 9 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.584 0.301 25913
1998 1 9 . 1 1 38 38 GLU C C 38 174.300 174.300 175.310 -1.010 25913
1999 1 9 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.867 -0.211 25913
2000 1 9 . 1 1 38 38 GLU CB C 38 34.589 34.589 32.259 2.330 25913
2001 1 9 . 1 1 38 38 GLU H H 38 9.131 9.131 8.912 0.219 25913
2002 1 9 . 1 1 39 39 GLU N N 39 127.840 127.840 127.169 0.671 25913
2003 1 9 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.089 0.759 25913
2004 1 9 . 1 1 39 39 GLU C C 39 175.507 175.507 175.527 -0.020 25913
2005 1 9 . 1 1 39 39 GLU CA C 39 56.505 56.505 56.123 0.382 25913
2006 1 9 . 1 1 39 39 GLU CB C 39 30.249 30.249 29.034 1.215 25913
2007 1 9 . 1 1 39 39 GLU H H 39 8.844 8.844 8.583 0.261 25913
2008 1 10 . 1 1 0 0 SER HA H 0 4.525 4.525 4.395 0.130 25913
2009 1 10 . 1 1 0 0 SER C C 0 174.776 174.776 175.605 -0.829 25913
2010 1 10 . 1 1 0 0 SER CA C 0 58.364 58.364 58.900 -0.536 25913
2011 1 10 . 1 1 0 0 SER CB C 0 64.049 64.049 63.701 0.348 25913
2012 1 10 . 1 1 1 1 MET N N 1 123.174 123.174 121.729 1.445 25913
2013 1 10 . 1 1 1 1 MET HA H 1 4.486 4.486 4.493 -0.007 25913
2014 1 10 . 1 1 1 1 MET C C 1 176.177 176.177 175.244 0.933 25913
2015 1 10 . 1 1 1 1 MET CA C 1 55.804 55.804 53.774 2.030 25913
2016 1 10 . 1 1 1 1 MET CB C 1 32.941 32.941 30.101 2.840 25913
2017 1 10 . 1 1 1 1 MET H H 1 8.592 8.592 8.150 0.442 25913
2018 1 10 . 1 1 2 2 ALA N N 2 125.785 125.785 122.564 3.221 25913
2019 1 10 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.446 -0.153 25913
2020 1 10 . 1 1 2 2 ALA C C 2 177.812 177.812 177.002 0.810 25913
2021 1 10 . 1 1 2 2 ALA CA C 2 52.809 52.809 52.018 0.791 25913
2022 1 10 . 1 1 2 2 ALA CB C 2 19.224 19.224 19.335 -0.111 25913
2023 1 10 . 1 1 2 2 ALA H H 2 8.337 8.337 7.824 0.513 25913
2024 1 10 . 1 1 3 3 GLU N N 3 120.731 120.731 115.980 4.751 25913
2025 1 10 . 1 1 3 3 GLU HA H 3 4.256 4.256 3.853 0.403 25913
2026 1 10 . 1 1 3 3 GLU C C 3 176.186 176.186 175.610 0.576 25913
2027 1 10 . 1 1 3 3 GLU CA C 3 56.377 56.377 56.868 -0.492 25913
2028 1 10 . 1 1 3 3 GLU CB C 3 30.549 30.549 27.476 3.073 25913
2029 1 10 . 1 1 3 3 GLU H H 3 8.274 8.274 8.475 -0.201 25913
2030 1 10 . 1 1 4 4 ALA N N 4 125.716 125.716 120.989 4.727 25913
2031 1 10 . 1 1 4 4 ALA HA H 4 4.345 4.345 4.530 -0.185 25913
2032 1 10 . 1 1 4 4 ALA C C 4 177.530 177.530 177.277 0.253 25913
2033 1 10 . 1 1 4 4 ALA CA C 4 52.413 52.413 52.899 -0.486 25913
2034 1 10 . 1 1 4 4 ALA CB C 4 19.466 19.466 20.739 -1.273 25913
2035 1 10 . 1 1 4 4 ALA H H 4 8.271 8.271 8.183 0.088 25913
2036 1 10 . 1 1 5 5 SER N N 5 117.161 117.161 114.967 2.194 25913
2037 1 10 . 1 1 5 5 SER HA H 5 4.724 4.724 4.639 0.085 25913
2038 1 10 . 1 1 5 5 SER C C 5 172.661 172.661 172.715 -0.054 25913
2039 1 10 . 1 1 5 5 SER CA C 5 56.354 56.354 55.667 0.687 25913
2040 1 10 . 1 1 5 5 SER CB C 5 63.442 63.442 63.955 -0.513 25913
2041 1 10 . 1 1 5 5 SER H H 5 8.259 8.259 7.701 0.558 25913
2042 1 10 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.712 -0.298 25913
2043 1 10 . 1 1 6 6 PRO C C 6 176.523 176.523 175.668 0.855 25913
2044 1 10 . 1 1 6 6 PRO CA C 6 63.385 63.385 63.042 0.343 25913
2045 1 10 . 1 1 6 6 PRO CB C 6 32.187 32.187 31.794 0.393 25913
2046 1 10 . 1 1 7 7 HIS N N 7 120.170 120.170 116.519 3.651 25913
2047 1 10 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.927 0.053 25913
2048 1 10 . 1 1 7 7 HIS C C 7 172.577 172.577 172.569 0.008 25913
2049 1 10 . 1 1 7 7 HIS CA C 7 53.492 53.492 52.944 0.548 25913
2050 1 10 . 1 1 7 7 HIS CB C 7 29.133 29.133 29.708 -0.575 25913
2051 1 10 . 1 1 7 7 HIS H H 7 8.489 8.489 7.351 1.138 25913
2052 1 10 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.441 0.105 25913
2053 1 10 . 1 1 8 8 PRO C C 8 177.382 177.382 176.834 0.548 25913
2054 1 10 . 1 1 8 8 PRO CA C 8 63.443 63.443 63.647 -0.203 25913
2055 1 10 . 1 1 8 8 PRO CB C 8 32.377 32.377 32.297 0.080 25913
2056 1 10 . 1 1 9 9 GLY N N 9 110.263 110.263 109.530 0.733 25913
2057 1 10 . 1 1 9 9 GLY C C 9 172.859 172.859 173.145 -0.286 25913
2058 1 10 . 1 1 9 9 GLY CA C 9 45.211 45.211 46.051 -0.840 25913
2059 1 10 . 1 1 9 9 GLY H H 9 8.635 8.635 8.953 -0.318 25913
2060 1 10 . 1 1 10 10 ARG N N 10 121.025 121.025 123.236 -2.211 25913
2061 1 10 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.974 -0.192 25913
2062 1 10 . 1 1 10 10 ARG C C 10 175.125 175.125 174.896 0.229 25913
2063 1 10 . 1 1 10 10 ARG CA C 10 55.356 55.356 55.943 -0.587 25913
2064 1 10 . 1 1 10 10 ARG CB C 10 32.982 32.982 29.286 3.696 25913
2065 1 10 . 1 1 10 10 ARG H H 10 8.229 8.229 8.039 0.190 25913
2066 1 10 . 1 1 11 11 TYR N N 11 121.353 121.353 123.841 -2.488 25913
2067 1 10 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.665 -0.337 25913
2068 1 10 . 1 1 11 11 TYR C C 11 174.229 174.229 174.658 -0.429 25913
2069 1 10 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.085 0.964 25913
2070 1 10 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.418 -0.367 25913
2071 1 10 . 1 1 11 11 TYR H H 11 8.692 8.692 9.369 -0.677 25913
2072 1 10 . 1 1 12 12 PHE N N 12 122.456 122.456 122.220 0.236 25913
2073 1 10 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.309 -0.425 25913
2074 1 10 . 1 1 12 12 PHE C C 12 174.224 174.224 174.922 -0.698 25913
2075 1 10 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.406 0.613 25913
2076 1 10 . 1 1 12 12 PHE CB C 12 44.078 44.078 41.861 2.217 25913
2077 1 10 . 1 1 12 12 PHE H H 12 9.415 9.415 8.982 0.433 25913
2078 1 10 . 1 1 13 13 CYS N N 13 128.438 128.438 128.447 -0.009 25913
2079 1 10 . 1 1 13 13 CYS HA H 13 4.653 4.653 5.013 -0.360 25913
2080 1 10 . 1 1 13 13 CYS C C 13 176.686 176.686 175.357 1.329 25913
2081 1 10 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.673 0.655 25913
2082 1 10 . 1 1 13 13 CYS CB C 13 31.220 31.220 28.238 2.982 25913
2083 1 10 . 1 1 13 13 CYS H H 13 7.942 7.942 8.844 -0.902 25913
2084 1 10 . 1 1 14 14 HIS N N 14 126.467 126.467 125.942 0.525 25913
2085 1 10 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.596 -0.273 25913
2086 1 10 . 1 1 14 14 HIS C C 14 175.452 175.452 176.408 -0.956 25913
2087 1 10 . 1 1 14 14 HIS CA C 14 58.736 58.736 58.545 0.191 25913
2088 1 10 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.814 -1.623 25913
2089 1 10 . 1 1 14 14 HIS H H 14 8.971 8.971 9.539 -0.568 25913
2090 1 10 . 1 1 15 15 CYS N N 15 123.882 123.882 118.635 5.247 25913
2091 1 10 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.276 0.166 25913
2092 1 10 . 1 1 15 15 CYS C C 15 176.939 176.939 176.153 0.786 25913
2093 1 10 . 1 1 15 15 CYS CA C 15 61.704 61.704 61.760 -0.056 25913
2094 1 10 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.882 -0.541 25913
2095 1 10 . 1 1 15 15 CYS H H 15 9.195 9.195 8.228 0.967 25913
2096 1 10 . 1 1 16 16 CYS N N 16 124.898 124.898 118.657 6.241 25913
2097 1 10 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.554 -0.556 25913
2098 1 10 . 1 1 16 16 CYS C C 16 175.557 175.557 174.226 1.331 25913
2099 1 10 . 1 1 16 16 CYS CB C 16 30.961 30.961 28.316 2.645 25913
2100 1 10 . 1 1 16 16 CYS H H 16 9.794 9.794 7.820 1.974 25913
2101 1 10 . 1 1 17 17 SER N N 17 114.055 114.055 114.216 -0.161 25913
2102 1 10 . 1 1 17 17 SER HA H 17 3.755 3.755 4.173 -0.418 25913
2103 1 10 . 1 1 17 17 SER C C 17 173.790 173.790 173.148 0.642 25913
2104 1 10 . 1 1 17 17 SER CA C 17 58.868 58.868 59.280 -0.412 25913
2105 1 10 . 1 1 17 17 SER CB C 17 61.703 61.703 61.018 0.685 25913
2106 1 10 . 1 1 17 17 SER H H 17 7.950 7.950 8.056 -0.106 25913
2107 1 10 . 1 1 18 18 VAL N N 18 111.916 111.916 113.210 -1.294 25913
2108 1 10 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.162 0.296 25913
2109 1 10 . 1 1 18 18 VAL C C 18 173.765 173.765 173.629 0.136 25913
2110 1 10 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.162 -0.130 25913
2111 1 10 . 1 1 18 18 VAL CB C 18 36.667 36.667 35.123 1.544 25913
2112 1 10 . 1 1 18 18 VAL H H 18 6.438 6.438 6.724 -0.286 25913
2113 1 10 . 1 1 19 19 GLU N N 19 123.431 123.431 122.233 1.198 25913
2114 1 10 . 1 1 19 19 GLU HA H 19 5.023 5.023 4.951 0.072 25913
2115 1 10 . 1 1 19 19 GLU C C 19 176.506 176.506 176.031 0.475 25913
2116 1 10 . 1 1 19 19 GLU CA C 19 56.818 56.818 55.969 0.848 25913
2117 1 10 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.771 -0.606 25913
2118 1 10 . 1 1 19 19 GLU H H 19 8.346 8.346 8.325 0.021 25913
2119 1 10 . 1 1 20 20 ILE N N 20 117.751 117.751 121.702 -3.951 25913
2120 1 10 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.715 0.026 25913
2121 1 10 . 1 1 20 20 ILE C C 20 175.511 175.511 173.894 1.617 25913
2122 1 10 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.502 -0.556 25913
2123 1 10 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.960 2.707 25913
2124 1 10 . 1 1 20 20 ILE H H 20 8.537 8.537 9.076 -0.539 25913
2125 1 10 . 1 1 21 21 VAL N N 21 124.220 124.220 121.901 2.319 25913
2126 1 10 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.323 -0.737 25913
2127 1 10 . 1 1 21 21 VAL C C 21 174.640 174.640 174.255 0.385 25913
2128 1 10 . 1 1 21 21 VAL CA C 21 59.718 59.718 58.025 1.693 25913
2129 1 10 . 1 1 21 21 VAL CB C 21 32.503 32.503 33.975 -1.472 25913
2130 1 10 . 1 1 21 21 VAL H H 21 8.203 8.203 8.337 -0.134 25913
2131 1 10 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.589 -0.530 25913
2132 1 10 . 1 1 22 22 PRO C C 22 175.352 175.352 176.152 -0.800 25913
2133 1 10 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.511 0.150 25913
2134 1 10 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.486 -0.472 25913
2135 1 10 . 1 1 23 23 ARG N N 23 121.370 121.370 122.382 -1.012 25913
2136 1 10 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.172 0.083 25913
2137 1 10 . 1 1 23 23 ARG C C 23 175.759 175.759 176.727 -0.968 25913
2138 1 10 . 1 1 23 23 ARG CA C 23 56.052 56.052 56.230 -0.178 25913
2139 1 10 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.056 1.830 25913
2140 1 10 . 1 1 23 23 ARG H H 23 8.635 8.635 8.090 0.545 25913
2141 1 10 . 1 1 24 24 LEU N N 24 127.914 127.914 127.347 0.567 25913
2142 1 10 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.759 0.414 25913
2143 1 10 . 1 1 24 24 LEU C C 24 175.774 175.774 175.920 -0.146 25913
2144 1 10 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.412 -5.474 25913
2145 1 10 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.203 2.217 25913
2146 1 10 . 1 1 24 24 LEU H H 24 8.521 8.521 8.574 -0.053 25913
2147 1 10 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.152 0.188 25913
2148 1 10 . 1 1 25 25 PRO C C 25 176.386 176.386 177.060 -0.674 25913
2149 1 10 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.525 -0.858 25913
2150 1 10 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.737 2.939 25913
2151 1 10 . 1 1 26 26 ASP N N 26 122.078 122.078 115.279 6.799 25913
2152 1 10 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.661 -0.274 25913
2153 1 10 . 1 1 26 26 ASP C C 26 175.321 175.321 176.163 -0.842 25913
2154 1 10 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.364 1.991 25913
2155 1 10 . 1 1 26 26 ASP CB C 26 41.066 41.066 43.151 -2.085 25913
2156 1 10 . 1 1 26 26 ASP H H 26 8.752 8.752 7.742 1.010 25913
2157 1 10 . 1 1 27 27 TYR N N 27 117.607 117.607 117.402 0.205 25913
2158 1 10 . 1 1 27 27 TYR HA H 27 3.449 3.449 3.984 -0.535 25913
2159 1 10 . 1 1 27 27 TYR C C 27 173.074 173.074 174.197 -1.123 25913
2160 1 10 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.414 1.023 25913
2161 1 10 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.843 -0.783 25913
2162 1 10 . 1 1 27 27 TYR H H 27 8.666 8.666 8.253 0.413 25913
2163 1 10 . 1 1 28 28 ILE N N 28 111.804 111.804 112.386 -0.582 25913
2164 1 10 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.498 0.277 25913
2165 1 10 . 1 1 28 28 ILE C C 28 175.083 175.083 174.324 0.759 25913
2166 1 10 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.022 -0.453 25913
2167 1 10 . 1 1 28 28 ILE CB C 28 42.107 42.107 41.525 0.582 25913
2168 1 10 . 1 1 28 28 ILE H H 28 6.761 6.761 7.285 -0.524 25913
2169 1 10 . 1 1 29 29 CYS N N 29 126.875 126.875 118.896 7.979 25913
2170 1 10 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.767 -0.359 25913
2171 1 10 . 1 1 29 29 CYS C C 29 175.932 175.932 175.174 0.758 25913
2172 1 10 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.727 0.674 25913
2173 1 10 . 1 1 29 29 CYS CB C 29 32.214 32.214 28.000 4.214 25913
2174 1 10 . 1 1 29 29 CYS H H 29 8.783 8.783 8.710 0.073 25913
2175 1 10 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.411 -0.029 25913
2176 1 10 . 1 1 30 30 PRO C C 30 176.824 176.824 177.723 -0.899 25913
2177 1 10 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.614 -0.574 25913
2178 1 10 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.915 0.429 25913
2179 1 10 . 1 1 31 31 ARG N N 31 124.131 124.131 117.515 6.616 25913
2180 1 10 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.415 -0.114 25913
2181 1 10 . 1 1 31 31 ARG C C 31 177.721 177.721 177.166 0.555 25913
2182 1 10 . 1 1 31 31 ARG CA C 31 58.190 58.190 57.963 0.227 25913
2183 1 10 . 1 1 31 31 ARG CB C 31 31.682 31.682 30.774 0.908 25913
2184 1 10 . 1 1 31 31 ARG H H 31 9.604 9.604 7.734 1.870 25913
2185 1 10 . 1 1 32 32 CYS N N 32 119.758 119.758 113.755 6.003 25913
2186 1 10 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.846 -0.007 25913
2187 1 10 . 1 1 32 32 CYS C C 32 176.450 176.450 174.331 2.119 25913
2188 1 10 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.531 1.179 25913
2189 1 10 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.453 3.777 25913
2190 1 10 . 1 1 32 32 CYS H H 32 8.549 8.549 7.734 0.815 25913
2191 1 10 . 1 1 33 33 GLU N N 33 118.109 118.109 120.000 -1.891 25913
2192 1 10 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.031 0.047 25913
2193 1 10 . 1 1 33 33 GLU C C 33 174.739 174.739 175.990 -1.251 25913
2194 1 10 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.476 1.042 25913
2195 1 10 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.087 -0.395 25913
2196 1 10 . 1 1 33 33 GLU H H 33 7.868 7.868 8.276 -0.408 25913
2197 1 10 . 1 1 34 34 SER N N 34 117.224 117.224 115.054 2.170 25913
2198 1 10 . 1 1 34 34 SER HA H 34 4.437 4.437 4.475 -0.038 25913
2199 1 10 . 1 1 34 34 SER C C 34 175.392 175.392 175.687 -0.295 25913
2200 1 10 . 1 1 34 34 SER CA C 34 59.277 59.277 59.948 -0.671 25913
2201 1 10 . 1 1 34 34 SER CB C 34 65.429 65.429 64.315 1.114 25913
2202 1 10 . 1 1 34 34 SER H H 34 8.786 8.786 8.114 0.672 25913
2203 1 10 . 1 1 35 35 GLY N N 35 111.095 111.095 107.836 3.259 25913
2204 1 10 . 1 1 35 35 GLY C C 35 175.730 175.730 174.829 0.901 25913
2205 1 10 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.759 0.482 25913
2206 1 10 . 1 1 35 35 GLY H H 35 8.511 8.511 8.520 -0.009 25913
2207 1 10 . 1 1 36 36 PHE N N 36 126.409 126.409 124.885 1.524 25913
2208 1 10 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.512 0.639 25913
2209 1 10 . 1 1 36 36 PHE C C 36 174.098 174.098 174.614 -0.516 25913
2210 1 10 . 1 1 36 36 PHE CA C 36 55.269 55.269 57.781 -2.512 25913
2211 1 10 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.108 -1.081 25913
2212 1 10 . 1 1 36 36 PHE H H 36 8.850 8.850 7.867 0.983 25913
2213 1 10 . 1 1 37 37 ILE N N 37 117.377 117.377 114.926 2.451 25913
2214 1 10 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.410 -0.054 25913
2215 1 10 . 1 1 37 37 ILE C C 37 175.508 175.508 174.984 0.524 25913
2216 1 10 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.682 0.005 25913
2217 1 10 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.501 -1.353 25913
2218 1 10 . 1 1 37 37 ILE H H 37 7.972 7.972 7.926 0.046 25913
2219 1 10 . 1 1 38 38 GLU N N 38 124.869 124.869 123.049 1.820 25913
2220 1 10 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.661 0.224 25913
2221 1 10 . 1 1 38 38 GLU C C 38 174.300 174.300 175.254 -0.954 25913
2222 1 10 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.881 -0.225 25913
2223 1 10 . 1 1 38 38 GLU CB C 38 34.589 34.589 32.639 1.950 25913
2224 1 10 . 1 1 38 38 GLU H H 38 9.131 9.131 8.875 0.256 25913
2225 1 10 . 1 1 39 39 GLU N N 39 127.840 127.840 127.330 0.510 25913
2226 1 10 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.256 0.592 25913
2227 1 10 . 1 1 39 39 GLU C C 39 175.507 175.507 175.728 -0.221 25913
2228 1 10 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.986 0.519 25913
2229 1 10 . 1 1 39 39 GLU CB C 39 30.249 30.249 28.948 1.301 25913
2230 1 10 . 1 1 39 39 GLU H H 39 8.844 8.844 8.629 0.215 25913
2231 1 11 . 1 1 0 0 SER HA H 0 4.525 4.525 4.307 0.218 25913
2232 1 11 . 1 1 0 0 SER C C 0 174.776 174.776 174.604 0.172 25913
2233 1 11 . 1 1 0 0 SER CA C 0 58.364 58.364 58.556 -0.192 25913
2234 1 11 . 1 1 0 0 SER CB C 0 64.049 64.049 63.113 0.936 25913
2235 1 11 . 1 1 1 1 MET N N 1 123.174 123.174 118.119 5.055 25913
2236 1 11 . 1 1 1 1 MET HA H 1 4.486 4.486 4.638 -0.152 25913
2237 1 11 . 1 1 1 1 MET C C 1 176.177 176.177 175.275 0.902 25913
2238 1 11 . 1 1 1 1 MET CA C 1 55.804 55.804 55.771 0.033 25913
2239 1 11 . 1 1 1 1 MET CB C 1 32.941 32.941 30.870 2.071 25913
2240 1 11 . 1 1 1 1 MET H H 1 8.592 8.592 8.345 0.247 25913
2241 1 11 . 1 1 2 2 ALA N N 2 125.785 125.785 123.619 2.166 25913
2242 1 11 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.537 -0.244 25913
2243 1 11 . 1 1 2 2 ALA C C 2 177.812 177.812 177.418 0.394 25913
2244 1 11 . 1 1 2 2 ALA CA C 2 52.809 52.809 51.895 0.913 25913
2245 1 11 . 1 1 2 2 ALA CB C 2 19.224 19.224 19.668 -0.444 25913
2246 1 11 . 1 1 2 2 ALA H H 2 8.337 8.337 8.143 0.194 25913
2247 1 11 . 1 1 3 3 GLU N N 3 120.731 120.731 119.520 1.211 25913
2248 1 11 . 1 1 3 3 GLU HA H 3 4.256 4.256 4.342 -0.086 25913
2249 1 11 . 1 1 3 3 GLU C C 3 176.186 176.186 177.186 -1.000 25913
2250 1 11 . 1 1 3 3 GLU CA C 3 56.377 56.377 56.082 0.295 25913
2251 1 11 . 1 1 3 3 GLU CB C 3 30.549 30.549 29.473 1.076 25913
2252 1 11 . 1 1 3 3 GLU H H 3 8.274 8.274 8.601 -0.327 25913
2253 1 11 . 1 1 4 4 ALA N N 4 125.716 125.716 122.913 2.803 25913
2254 1 11 . 1 1 4 4 ALA HA H 4 4.345 4.345 4.233 0.112 25913
2255 1 11 . 1 1 4 4 ALA C C 4 177.530 177.530 177.858 -0.328 25913
2256 1 11 . 1 1 4 4 ALA CA C 4 52.413 52.413 53.619 -1.206 25913
2257 1 11 . 1 1 4 4 ALA CB C 4 19.466 19.466 18.958 0.508 25913
2258 1 11 . 1 1 4 4 ALA H H 4 8.271 8.271 7.936 0.335 25913
2259 1 11 . 1 1 5 5 SER N N 5 117.161 117.161 114.282 2.879 25913
2260 1 11 . 1 1 5 5 SER HA H 5 4.724 4.724 4.819 -0.095 25913
2261 1 11 . 1 1 5 5 SER C C 5 172.661 172.661 173.062 -0.401 25913
2262 1 11 . 1 1 5 5 SER CA C 5 56.354 56.354 55.139 1.215 25913
2263 1 11 . 1 1 5 5 SER CB C 5 63.442 63.442 63.119 0.323 25913
2264 1 11 . 1 1 5 5 SER H H 5 8.259 8.259 7.784 0.475 25913
2265 1 11 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.334 0.080 25913
2266 1 11 . 1 1 6 6 PRO C C 6 176.523 176.523 176.136 0.387 25913
2267 1 11 . 1 1 6 6 PRO CA C 6 63.385 63.385 64.599 -1.214 25913
2268 1 11 . 1 1 6 6 PRO CB C 6 32.187 32.187 32.016 0.171 25913
2269 1 11 . 1 1 7 7 HIS N N 7 120.170 120.170 112.953 7.217 25913
2270 1 11 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.817 0.163 25913
2271 1 11 . 1 1 7 7 HIS C C 7 172.577 172.577 172.554 0.023 25913
2272 1 11 . 1 1 7 7 HIS CA C 7 53.492 53.492 52.493 0.999 25913
2273 1 11 . 1 1 7 7 HIS CB C 7 29.133 29.133 29.703 -0.570 25913
2274 1 11 . 1 1 7 7 HIS H H 7 8.489 8.489 7.459 1.030 25913
2275 1 11 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.467 0.079 25913
2276 1 11 . 1 1 8 8 PRO C C 8 177.382 177.382 176.516 0.866 25913
2277 1 11 . 1 1 8 8 PRO CA C 8 63.443 63.443 63.416 0.027 25913
2278 1 11 . 1 1 8 8 PRO CB C 8 32.377 32.377 32.594 -0.217 25913
2279 1 11 . 1 1 9 9 GLY N N 9 110.263 110.263 108.006 2.257 25913
2280 1 11 . 1 1 9 9 GLY C C 9 172.859 172.859 173.335 -0.476 25913
2281 1 11 . 1 1 9 9 GLY CA C 9 45.211 45.211 46.339 -1.128 25913
2282 1 11 . 1 1 9 9 GLY H H 9 8.635 8.635 8.998 -0.363 25913
2283 1 11 . 1 1 10 10 ARG N N 10 121.025 121.025 123.798 -2.773 25913
2284 1 11 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.668 0.114 25913
2285 1 11 . 1 1 10 10 ARG C C 10 175.125 175.125 174.921 0.204 25913
2286 1 11 . 1 1 10 10 ARG CA C 10 55.356 55.356 56.375 -1.019 25913
2287 1 11 . 1 1 10 10 ARG CB C 10 32.982 32.982 28.948 4.034 25913
2288 1 11 . 1 1 10 10 ARG H H 10 8.229 8.229 8.016 0.213 25913
2289 1 11 . 1 1 11 11 TYR N N 11 121.353 121.353 123.712 -2.359 25913
2290 1 11 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.665 -0.337 25913
2291 1 11 . 1 1 11 11 TYR C C 11 174.229 174.229 174.819 -0.590 25913
2292 1 11 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.020 1.028 25913
2293 1 11 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.453 -0.402 25913
2294 1 11 . 1 1 11 11 TYR H H 11 8.692 8.692 9.361 -0.669 25913
2295 1 11 . 1 1 12 12 PHE N N 12 122.456 122.456 122.026 0.430 25913
2296 1 11 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.288 -0.404 25913
2297 1 11 . 1 1 12 12 PHE C C 12 174.224 174.224 174.835 -0.611 25913
2298 1 11 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.471 0.548 25913
2299 1 11 . 1 1 12 12 PHE CB C 12 44.078 44.078 41.975 2.103 25913
2300 1 11 . 1 1 12 12 PHE H H 12 9.415 9.415 8.936 0.479 25913
2301 1 11 . 1 1 13 13 CYS N N 13 128.438 128.438 128.631 -0.193 25913
2302 1 11 . 1 1 13 13 CYS HA H 13 4.653 4.653 4.896 -0.243 25913
2303 1 11 . 1 1 13 13 CYS C C 13 176.686 176.686 175.266 1.420 25913
2304 1 11 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.796 0.532 25913
2305 1 11 . 1 1 13 13 CYS CB C 13 31.220 31.220 27.666 3.554 25913
2306 1 11 . 1 1 13 13 CYS H H 13 7.942 7.942 8.928 -0.987 25913
2307 1 11 . 1 1 14 14 HIS N N 14 126.467 126.467 126.271 0.196 25913
2308 1 11 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.546 -0.223 25913
2309 1 11 . 1 1 14 14 HIS C C 14 175.452 175.452 176.529 -1.077 25913
2310 1 11 . 1 1 14 14 HIS CA C 14 58.736 58.736 57.760 0.977 25913
2311 1 11 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.360 -1.169 25913
2312 1 11 . 1 1 14 14 HIS H H 14 8.971 8.971 9.451 -0.480 25913
2313 1 11 . 1 1 15 15 CYS N N 15 123.882 123.882 118.189 5.693 25913
2314 1 11 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.287 0.155 25913
2315 1 11 . 1 1 15 15 CYS C C 15 176.939 176.939 175.969 0.970 25913
2316 1 11 . 1 1 15 15 CYS CA C 15 61.704 61.704 61.149 0.555 25913
2317 1 11 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.963 -0.622 25913
2318 1 11 . 1 1 15 15 CYS H H 15 9.195 9.195 8.150 1.045 25913
2319 1 11 . 1 1 16 16 CYS N N 16 124.898 124.898 120.662 4.236 25913
2320 1 11 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.549 -0.551 25913
2321 1 11 . 1 1 16 16 CYS C C 16 175.557 175.557 174.691 0.866 25913
2322 1 11 . 1 1 16 16 CYS CB C 16 30.961 30.961 27.358 3.603 25913
2323 1 11 . 1 1 16 16 CYS H H 16 9.794 9.794 8.090 1.704 25913
2324 1 11 . 1 1 17 17 SER N N 17 114.055 114.055 113.645 0.410 25913
2325 1 11 . 1 1 17 17 SER HA H 17 3.755 3.755 4.120 -0.365 25913
2326 1 11 . 1 1 17 17 SER C C 17 173.790 173.790 173.269 0.521 25913
2327 1 11 . 1 1 17 17 SER CA C 17 58.868 58.868 59.597 -0.729 25913
2328 1 11 . 1 1 17 17 SER CB C 17 61.703 61.703 60.416 1.287 25913
2329 1 11 . 1 1 17 17 SER H H 17 7.950 7.950 8.236 -0.286 25913
2330 1 11 . 1 1 18 18 VAL N N 18 111.916 111.916 111.906 0.010 25913
2331 1 11 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.302 0.156 25913
2332 1 11 . 1 1 18 18 VAL C C 18 173.765 173.765 173.574 0.191 25913
2333 1 11 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.090 -0.058 25913
2334 1 11 . 1 1 18 18 VAL CB C 18 36.667 36.667 35.516 1.151 25913
2335 1 11 . 1 1 18 18 VAL H H 18 6.438 6.438 7.025 -0.587 25913
2336 1 11 . 1 1 19 19 GLU N N 19 123.431 123.431 122.135 1.296 25913
2337 1 11 . 1 1 19 19 GLU HA H 19 5.023 5.023 4.989 0.034 25913
2338 1 11 . 1 1 19 19 GLU C C 19 176.506 176.506 176.111 0.395 25913
2339 1 11 . 1 1 19 19 GLU CA C 19 56.818 56.818 56.239 0.579 25913
2340 1 11 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.532 -0.367 25913
2341 1 11 . 1 1 19 19 GLU H H 19 8.346 8.346 8.445 -0.099 25913
2342 1 11 . 1 1 20 20 ILE N N 20 117.751 117.751 120.769 -3.018 25913
2343 1 11 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.736 0.005 25913
2344 1 11 . 1 1 20 20 ILE C C 20 175.511 175.511 173.896 1.615 25913
2345 1 11 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.282 -0.337 25913
2346 1 11 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.786 2.881 25913
2347 1 11 . 1 1 20 20 ILE H H 20 8.537 8.537 9.074 -0.537 25913
2348 1 11 . 1 1 21 21 VAL N N 21 124.220 124.220 122.307 1.913 25913
2349 1 11 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.244 -0.658 25913
2350 1 11 . 1 1 21 21 VAL C C 21 174.640 174.640 174.271 0.369 25913
2351 1 11 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.736 1.982 25913
2352 1 11 . 1 1 21 21 VAL CB C 21 32.503 32.503 33.035 -0.532 25913
2353 1 11 . 1 1 21 21 VAL H H 21 8.203 8.203 8.413 -0.210 25913
2354 1 11 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.600 -0.541 25913
2355 1 11 . 1 1 22 22 PRO C C 22 175.352 175.352 176.077 -0.725 25913
2356 1 11 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.378 0.283 25913
2357 1 11 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.601 -0.587 25913
2358 1 11 . 1 1 23 23 ARG N N 23 121.370 121.370 121.749 -0.379 25913
2359 1 11 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.251 0.004 25913
2360 1 11 . 1 1 23 23 ARG C C 23 175.759 175.759 176.608 -0.849 25913
2361 1 11 . 1 1 23 23 ARG CA C 23 56.052 56.052 55.960 0.092 25913
2362 1 11 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.166 1.720 25913
2363 1 11 . 1 1 23 23 ARG H H 23 8.635 8.635 8.082 0.553 25913
2364 1 11 . 1 1 24 24 LEU N N 24 127.914 127.914 127.177 0.737 25913
2365 1 11 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.843 0.330 25913
2366 1 11 . 1 1 24 24 LEU C C 24 175.774 175.774 176.012 -0.238 25913
2367 1 11 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.493 -5.555 25913
2368 1 11 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.132 2.288 25913
2369 1 11 . 1 1 24 24 LEU H H 24 8.521 8.521 8.702 -0.181 25913
2370 1 11 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.126 0.214 25913
2371 1 11 . 1 1 25 25 PRO C C 25 176.386 176.386 177.204 -0.818 25913
2372 1 11 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.558 -0.891 25913
2373 1 11 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.701 2.975 25913
2374 1 11 . 1 1 26 26 ASP N N 26 122.078 122.078 115.224 6.854 25913
2375 1 11 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.618 -0.231 25913
2376 1 11 . 1 1 26 26 ASP C C 26 175.321 175.321 176.162 -0.841 25913
2377 1 11 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.516 1.839 25913
2378 1 11 . 1 1 26 26 ASP CB C 26 41.066 41.066 42.849 -1.783 25913
2379 1 11 . 1 1 26 26 ASP H H 26 8.752 8.752 7.678 1.074 25913
2380 1 11 . 1 1 27 27 TYR N N 27 117.607 117.607 117.458 0.149 25913
2381 1 11 . 1 1 27 27 TYR HA H 27 3.449 3.449 4.017 -0.568 25913
2382 1 11 . 1 1 27 27 TYR C C 27 173.074 173.074 174.199 -1.125 25913
2383 1 11 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.140 1.297 25913
2384 1 11 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.825 -0.765 25913
2385 1 11 . 1 1 27 27 TYR H H 27 8.666 8.666 8.158 0.508 25913
2386 1 11 . 1 1 28 28 ILE N N 28 111.804 111.804 112.859 -1.055 25913
2387 1 11 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.490 0.285 25913
2388 1 11 . 1 1 28 28 ILE C C 28 175.083 175.083 174.537 0.546 25913
2389 1 11 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.035 -0.466 25913
2390 1 11 . 1 1 28 28 ILE CB C 28 42.107 42.107 41.414 0.693 25913
2391 1 11 . 1 1 28 28 ILE H H 28 6.761 6.761 7.358 -0.597 25913
2392 1 11 . 1 1 29 29 CYS N N 29 126.875 126.875 119.007 7.868 25913
2393 1 11 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.760 -0.352 25913
2394 1 11 . 1 1 29 29 CYS C C 29 175.932 175.932 175.096 0.836 25913
2395 1 11 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.809 0.593 25913
2396 1 11 . 1 1 29 29 CYS CB C 29 32.214 32.214 27.970 4.244 25913
2397 1 11 . 1 1 29 29 CYS H H 29 8.783 8.783 8.730 0.053 25913
2398 1 11 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.446 -0.064 25913
2399 1 11 . 1 1 30 30 PRO C C 30 176.824 176.824 177.452 -0.628 25913
2400 1 11 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.473 -0.433 25913
2401 1 11 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.878 0.467 25913
2402 1 11 . 1 1 31 31 ARG N N 31 124.131 124.131 117.996 6.135 25913
2403 1 11 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.439 -0.138 25913
2404 1 11 . 1 1 31 31 ARG C C 31 177.721 177.721 177.171 0.550 25913
2405 1 11 . 1 1 31 31 ARG CA C 31 58.190 58.190 57.928 0.262 25913
2406 1 11 . 1 1 31 31 ARG CB C 31 31.682 31.682 30.813 0.869 25913
2407 1 11 . 1 1 31 31 ARG H H 31 9.604 9.604 7.669 1.935 25913
2408 1 11 . 1 1 32 32 CYS N N 32 119.758 119.758 114.125 5.633 25913
2409 1 11 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.841 -0.002 25913
2410 1 11 . 1 1 32 32 CYS C C 32 176.450 176.450 174.557 1.893 25913
2411 1 11 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.576 1.134 25913
2412 1 11 . 1 1 32 32 CYS CB C 32 33.230 33.230 28.990 4.240 25913
2413 1 11 . 1 1 32 32 CYS H H 32 8.549 8.549 7.802 0.747 25913
2414 1 11 . 1 1 33 33 GLU N N 33 118.109 118.109 119.565 -1.456 25913
2415 1 11 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.059 0.019 25913
2416 1 11 . 1 1 33 33 GLU C C 33 174.739 174.739 176.036 -1.297 25913
2417 1 11 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.495 1.023 25913
2418 1 11 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.249 -0.557 25913
2419 1 11 . 1 1 33 33 GLU H H 33 7.868 7.868 8.147 -0.279 25913
2420 1 11 . 1 1 34 34 SER N N 34 117.224 117.224 114.903 2.321 25913
2421 1 11 . 1 1 34 34 SER HA H 34 4.437 4.437 4.499 -0.062 25913
2422 1 11 . 1 1 34 34 SER C C 34 175.392 175.392 175.532 -0.140 25913
2423 1 11 . 1 1 34 34 SER CA C 34 59.277 59.277 59.912 -0.635 25913
2424 1 11 . 1 1 34 34 SER CB C 34 65.429 65.429 64.449 0.980 25913
2425 1 11 . 1 1 34 34 SER H H 34 8.786 8.786 8.002 0.784 25913
2426 1 11 . 1 1 35 35 GLY N N 35 111.095 111.095 107.489 3.606 25913
2427 1 11 . 1 1 35 35 GLY C C 35 175.730 175.730 174.350 1.380 25913
2428 1 11 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.610 0.631 25913
2429 1 11 . 1 1 35 35 GLY H H 35 8.511 8.511 8.448 0.063 25913
2430 1 11 . 1 1 36 36 PHE N N 36 126.409 126.409 125.439 0.970 25913
2431 1 11 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.406 0.745 25913
2432 1 11 . 1 1 36 36 PHE C C 36 174.098 174.098 174.359 -0.261 25913
2433 1 11 . 1 1 36 36 PHE CA C 36 55.269 55.269 59.676 -4.407 25913
2434 1 11 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.514 -1.487 25913
2435 1 11 . 1 1 36 36 PHE H H 36 8.850 8.850 7.585 1.265 25913
2436 1 11 . 1 1 37 37 ILE N N 37 117.377 117.377 115.833 1.544 25913
2437 1 11 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.202 0.154 25913
2438 1 11 . 1 1 37 37 ILE C C 37 175.508 175.508 174.790 0.718 25913
2439 1 11 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.536 0.151 25913
2440 1 11 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.563 -1.415 25913
2441 1 11 . 1 1 37 37 ILE H H 37 7.972 7.972 7.874 0.098 25913
2442 1 11 . 1 1 38 38 GLU N N 38 124.869 124.869 122.386 2.483 25913
2443 1 11 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.520 0.365 25913
2444 1 11 . 1 1 38 38 GLU C C 38 174.300 174.300 175.396 -1.096 25913
2445 1 11 . 1 1 38 38 GLU CA C 38 54.656 54.656 53.975 0.681 25913
2446 1 11 . 1 1 38 38 GLU CB C 38 34.589 34.589 31.347 3.242 25913
2447 1 11 . 1 1 38 38 GLU H H 38 9.131 9.131 8.725 0.406 25913
2448 1 11 . 1 1 39 39 GLU N N 39 127.840 127.840 127.224 0.616 25913
2449 1 11 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.090 0.758 25913
2450 1 11 . 1 1 39 39 GLU C C 39 175.507 175.507 175.728 -0.221 25913
2451 1 11 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.592 0.913 25913
2452 1 11 . 1 1 39 39 GLU CB C 39 30.249 30.249 28.584 1.665 25913
2453 1 11 . 1 1 39 39 GLU H H 39 8.844 8.844 8.635 0.209 25913
2454 1 12 . 1 1 0 0 SER HA H 0 4.525 4.525 4.674 -0.149 25913
2455 1 12 . 1 1 0 0 SER C C 0 174.776 174.776 174.430 0.346 25913
2456 1 12 . 1 1 0 0 SER CA C 0 58.364 58.364 58.043 0.321 25913
2457 1 12 . 1 1 0 0 SER CB C 0 64.049 64.049 64.553 -0.504 25913
2458 1 12 . 1 1 1 1 MET N N 1 123.174 123.174 122.243 0.931 25913
2459 1 12 . 1 1 1 1 MET HA H 1 4.486 4.486 4.264 0.222 25913
2460 1 12 . 1 1 1 1 MET C C 1 176.177 176.177 175.755 0.422 25913
2461 1 12 . 1 1 1 1 MET CA C 1 55.804 55.804 55.761 0.043 25913
2462 1 12 . 1 1 1 1 MET CB C 1 32.941 32.941 31.636 1.305 25913
2463 1 12 . 1 1 1 1 MET H H 1 8.592 8.592 8.660 -0.068 25913
2464 1 12 . 1 1 2 2 ALA N N 2 125.785 125.785 121.207 4.578 25913
2465 1 12 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.377 -0.084 25913
2466 1 12 . 1 1 2 2 ALA C C 2 177.812 177.812 178.343 -0.531 25913
2467 1 12 . 1 1 2 2 ALA CA C 2 52.809 52.809 53.032 -0.223 25913
2468 1 12 . 1 1 2 2 ALA CB C 2 19.224 19.224 19.641 -0.417 25913
2469 1 12 . 1 1 2 2 ALA H H 2 8.337 8.337 8.073 0.264 25913
2470 1 12 . 1 1 3 3 GLU N N 3 120.731 120.731 117.778 2.953 25913
2471 1 12 . 1 1 3 3 GLU HA H 3 4.256 4.256 4.444 -0.188 25913
2472 1 12 . 1 1 3 3 GLU C C 3 176.186 176.186 177.598 -1.412 25913
2473 1 12 . 1 1 3 3 GLU CA C 3 56.377 56.377 56.981 -0.604 25913
2474 1 12 . 1 1 3 3 GLU CB C 3 30.549 30.549 30.082 0.467 25913
2475 1 12 . 1 1 3 3 GLU H H 3 8.274 8.274 8.261 0.013 25913
2476 1 12 . 1 1 4 4 ALA N N 4 125.716 125.716 122.466 3.250 25913
2477 1 12 . 1 1 4 4 ALA HA H 4 4.345 4.345 3.988 0.357 25913
2478 1 12 . 1 1 4 4 ALA C C 4 177.530 177.530 177.546 -0.016 25913
2479 1 12 . 1 1 4 4 ALA CA C 4 52.413 52.413 53.708 -1.294 25913
2480 1 12 . 1 1 4 4 ALA CB C 4 19.466 19.466 17.701 1.765 25913
2481 1 12 . 1 1 4 4 ALA H H 4 8.271 8.271 8.164 0.107 25913
2482 1 12 . 1 1 5 5 SER N N 5 117.161 117.161 115.149 2.012 25913
2483 1 12 . 1 1 5 5 SER HA H 5 4.724 4.724 4.238 0.486 25913
2484 1 12 . 1 1 5 5 SER C C 5 172.661 172.661 172.962 -0.301 25913
2485 1 12 . 1 1 5 5 SER CA C 5 56.354 56.354 57.729 -1.375 25913
2486 1 12 . 1 1 5 5 SER CB C 5 63.442 63.442 63.203 0.239 25913
2487 1 12 . 1 1 5 5 SER H H 5 8.259 8.259 8.370 -0.111 25913
2488 1 12 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.690 -0.276 25913
2489 1 12 . 1 1 6 6 PRO C C 6 176.523 176.523 175.704 0.819 25913
2490 1 12 . 1 1 6 6 PRO CA C 6 63.385 63.385 63.177 0.208 25913
2491 1 12 . 1 1 6 6 PRO CB C 6 32.187 32.187 31.832 0.355 25913
2492 1 12 . 1 1 7 7 HIS N N 7 120.170 120.170 118.689 1.481 25913
2493 1 12 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.906 0.074 25913
2494 1 12 . 1 1 7 7 HIS C C 7 172.577 172.577 173.534 -0.957 25913
2495 1 12 . 1 1 7 7 HIS CA C 7 53.492 53.492 52.710 0.782 25913
2496 1 12 . 1 1 7 7 HIS CB C 7 29.133 29.133 30.499 -1.366 25913
2497 1 12 . 1 1 7 7 HIS H H 7 8.489 8.489 7.427 1.062 25913
2498 1 12 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.585 -0.039 25913
2499 1 12 . 1 1 8 8 PRO C C 8 177.382 177.382 175.991 1.391 25913
2500 1 12 . 1 1 8 8 PRO CA C 8 63.443 63.443 62.878 0.565 25913
2501 1 12 . 1 1 8 8 PRO CB C 8 32.377 32.377 32.986 -0.609 25913
2502 1 12 . 1 1 9 9 GLY N N 9 110.263 110.263 108.062 2.201 25913
2503 1 12 . 1 1 9 9 GLY C C 9 172.859 172.859 173.557 -0.698 25913
2504 1 12 . 1 1 9 9 GLY CA C 9 45.211 45.211 46.133 -0.922 25913
2505 1 12 . 1 1 9 9 GLY H H 9 8.635 8.635 8.965 -0.330 25913
2506 1 12 . 1 1 10 10 ARG N N 10 121.025 121.025 123.716 -2.691 25913
2507 1 12 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.589 0.193 25913
2508 1 12 . 1 1 10 10 ARG C C 10 175.125 175.125 174.915 0.210 25913
2509 1 12 . 1 1 10 10 ARG CA C 10 55.356 55.356 56.456 -1.100 25913
2510 1 12 . 1 1 10 10 ARG CB C 10 32.982 32.982 28.870 4.112 25913
2511 1 12 . 1 1 10 10 ARG H H 10 8.229 8.229 7.985 0.244 25913
2512 1 12 . 1 1 11 11 TYR N N 11 121.353 121.353 123.685 -2.332 25913
2513 1 12 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.713 -0.385 25913
2514 1 12 . 1 1 11 11 TYR C C 11 174.229 174.229 174.838 -0.609 25913
2515 1 12 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.099 0.950 25913
2516 1 12 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.486 -0.435 25913
2517 1 12 . 1 1 11 11 TYR H H 11 8.692 8.692 9.266 -0.574 25913
2518 1 12 . 1 1 12 12 PHE N N 12 122.456 122.456 122.006 0.450 25913
2519 1 12 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.348 -0.464 25913
2520 1 12 . 1 1 12 12 PHE C C 12 174.224 174.224 174.800 -0.576 25913
2521 1 12 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.455 0.564 25913
2522 1 12 . 1 1 12 12 PHE CB C 12 44.078 44.078 42.104 1.974 25913
2523 1 12 . 1 1 12 12 PHE H H 12 9.415 9.415 9.051 0.364 25913
2524 1 12 . 1 1 13 13 CYS N N 13 128.438 128.438 128.450 -0.012 25913
2525 1 12 . 1 1 13 13 CYS HA H 13 4.653 4.653 4.969 -0.316 25913
2526 1 12 . 1 1 13 13 CYS C C 13 176.686 176.686 175.311 1.375 25913
2527 1 12 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.702 0.626 25913
2528 1 12 . 1 1 13 13 CYS CB C 13 31.220 31.220 28.064 3.156 25913
2529 1 12 . 1 1 13 13 CYS H H 13 7.942 7.942 8.908 -0.966 25913
2530 1 12 . 1 1 14 14 HIS N N 14 126.467 126.467 125.825 0.642 25913
2531 1 12 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.608 -0.285 25913
2532 1 12 . 1 1 14 14 HIS C C 14 175.452 175.452 176.262 -0.810 25913
2533 1 12 . 1 1 14 14 HIS CA C 14 58.736 58.736 57.954 0.782 25913
2534 1 12 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.649 -1.458 25913
2535 1 12 . 1 1 14 14 HIS H H 14 8.971 8.971 9.471 -0.500 25913
2536 1 12 . 1 1 15 15 CYS N N 15 123.882 123.882 118.171 5.711 25913
2537 1 12 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.306 0.136 25913
2538 1 12 . 1 1 15 15 CYS C C 15 176.939 176.939 176.087 0.852 25913
2539 1 12 . 1 1 15 15 CYS CA C 15 61.704 61.704 60.982 0.722 25913
2540 1 12 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.929 -0.588 25913
2541 1 12 . 1 1 15 15 CYS H H 15 9.195 9.195 8.139 1.056 25913
2542 1 12 . 1 1 16 16 CYS N N 16 124.898 124.898 120.609 4.289 25913
2543 1 12 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.501 -0.503 25913
2544 1 12 . 1 1 16 16 CYS C C 16 175.557 175.557 174.782 0.775 25913
2545 1 12 . 1 1 16 16 CYS CB C 16 30.961 30.961 27.259 3.702 25913
2546 1 12 . 1 1 16 16 CYS H H 16 9.794 9.794 8.113 1.681 25913
2547 1 12 . 1 1 17 17 SER N N 17 114.055 114.055 113.907 0.148 25913
2548 1 12 . 1 1 17 17 SER HA H 17 3.755 3.755 4.113 -0.358 25913
2549 1 12 . 1 1 17 17 SER C C 17 173.790 173.790 173.277 0.513 25913
2550 1 12 . 1 1 17 17 SER CA C 17 58.868 58.868 59.470 -0.602 25913
2551 1 12 . 1 1 17 17 SER CB C 17 61.703 61.703 60.661 1.042 25913
2552 1 12 . 1 1 17 17 SER H H 17 7.950 7.950 8.156 -0.206 25913
2553 1 12 . 1 1 18 18 VAL N N 18 111.916 111.916 112.800 -0.884 25913
2554 1 12 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.297 0.161 25913
2555 1 12 . 1 1 18 18 VAL C C 18 173.765 173.765 173.554 0.211 25913
2556 1 12 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.575 -0.543 25913
2557 1 12 . 1 1 18 18 VAL CB C 18 36.667 36.667 34.811 1.856 25913
2558 1 12 . 1 1 18 18 VAL H H 18 6.438 6.438 6.984 -0.546 25913
2559 1 12 . 1 1 19 19 GLU N N 19 123.431 123.431 121.801 1.630 25913
2560 1 12 . 1 1 19 19 GLU HA H 19 5.023 5.023 5.070 -0.047 25913
2561 1 12 . 1 1 19 19 GLU C C 19 176.506 176.506 175.818 0.688 25913
2562 1 12 . 1 1 19 19 GLU CA C 19 56.818 56.818 56.286 0.532 25913
2563 1 12 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.497 -0.332 25913
2564 1 12 . 1 1 19 19 GLU H H 19 8.346 8.346 8.380 -0.034 25913
2565 1 12 . 1 1 20 20 ILE N N 20 117.751 117.751 120.156 -2.405 25913
2566 1 12 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.714 0.027 25913
2567 1 12 . 1 1 20 20 ILE C C 20 175.511 175.511 173.926 1.585 25913
2568 1 12 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.422 -0.477 25913
2569 1 12 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.487 3.180 25913
2570 1 12 . 1 1 20 20 ILE H H 20 8.537 8.537 8.846 -0.309 25913
2571 1 12 . 1 1 21 21 VAL N N 21 124.220 124.220 122.151 2.069 25913
2572 1 12 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.166 -0.580 25913
2573 1 12 . 1 1 21 21 VAL C C 21 174.640 174.640 174.075 0.565 25913
2574 1 12 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.811 1.907 25913
2575 1 12 . 1 1 21 21 VAL CB C 21 32.503 32.503 32.853 -0.351 25913
2576 1 12 . 1 1 21 21 VAL H H 21 8.203 8.203 8.374 -0.171 25913
2577 1 12 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.693 -0.634 25913
2578 1 12 . 1 1 22 22 PRO C C 22 175.352 175.352 176.133 -0.781 25913
2579 1 12 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.670 -0.010 25913
2580 1 12 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.385 -0.371 25913
2581 1 12 . 1 1 23 23 ARG N N 23 121.370 121.370 122.616 -1.246 25913
2582 1 12 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.219 0.036 25913
2583 1 12 . 1 1 23 23 ARG C C 23 175.759 175.759 176.704 -0.945 25913
2584 1 12 . 1 1 23 23 ARG CA C 23 56.052 56.052 56.049 0.003 25913
2585 1 12 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.224 1.662 25913
2586 1 12 . 1 1 23 23 ARG H H 23 8.635 8.635 8.133 0.502 25913
2587 1 12 . 1 1 24 24 LEU N N 24 127.914 127.914 127.101 0.813 25913
2588 1 12 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.692 0.481 25913
2589 1 12 . 1 1 24 24 LEU C C 24 175.774 175.774 176.009 -0.235 25913
2590 1 12 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.622 -5.684 25913
2591 1 12 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.038 2.382 25913
2592 1 12 . 1 1 24 24 LEU H H 24 8.521 8.521 8.669 -0.148 25913
2593 1 12 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.147 0.193 25913
2594 1 12 . 1 1 25 25 PRO C C 25 176.386 176.386 177.121 -0.735 25913
2595 1 12 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.544 -0.877 25913
2596 1 12 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.720 2.956 25913
2597 1 12 . 1 1 26 26 ASP N N 26 122.078 122.078 114.402 7.676 25913
2598 1 12 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.652 -0.265 25913
2599 1 12 . 1 1 26 26 ASP C C 26 175.321 175.321 175.979 -0.658 25913
2600 1 12 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.401 1.954 25913
2601 1 12 . 1 1 26 26 ASP CB C 26 41.066 41.066 42.841 -1.775 25913
2602 1 12 . 1 1 26 26 ASP H H 26 8.752 8.752 7.786 0.966 25913
2603 1 12 . 1 1 27 27 TYR N N 27 117.607 117.607 118.259 -0.652 25913
2604 1 12 . 1 1 27 27 TYR HA H 27 3.449 3.449 3.955 -0.506 25913
2605 1 12 . 1 1 27 27 TYR C C 27 173.074 173.074 174.375 -1.301 25913
2606 1 12 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.235 1.202 25913
2607 1 12 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.643 -0.583 25913
2608 1 12 . 1 1 27 27 TYR H H 27 8.666 8.666 8.082 0.584 25913
2609 1 12 . 1 1 28 28 ILE N N 28 111.804 111.804 112.469 -0.665 25913
2610 1 12 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.522 0.253 25913
2611 1 12 . 1 1 28 28 ILE C C 28 175.083 175.083 174.741 0.342 25913
2612 1 12 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.696 -1.127 25913
2613 1 12 . 1 1 28 28 ILE CB C 28 42.107 42.107 40.989 1.117 25913
2614 1 12 . 1 1 28 28 ILE H H 28 6.761 6.761 7.250 -0.489 25913
2615 1 12 . 1 1 29 29 CYS N N 29 126.875 126.875 119.005 7.870 25913
2616 1 12 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.762 -0.354 25913
2617 1 12 . 1 1 29 29 CYS C C 29 175.932 175.932 175.070 0.862 25913
2618 1 12 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.814 0.588 25913
2619 1 12 . 1 1 29 29 CYS CB C 29 32.214 32.214 27.980 4.234 25913
2620 1 12 . 1 1 29 29 CYS H H 29 8.783 8.783 8.716 0.067 25913
2621 1 12 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.463 -0.081 25913
2622 1 12 . 1 1 30 30 PRO C C 30 176.824 176.824 177.191 -0.367 25913
2623 1 12 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.333 -0.293 25913
2624 1 12 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.907 0.437 25913
2625 1 12 . 1 1 31 31 ARG N N 31 124.131 124.131 116.794 7.337 25913
2626 1 12 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.404 -0.103 25913
2627 1 12 . 1 1 31 31 ARG C C 31 177.721 177.721 177.137 0.584 25913
2628 1 12 . 1 1 31 31 ARG CA C 31 58.190 58.190 57.199 0.991 25913
2629 1 12 . 1 1 31 31 ARG CB C 31 31.682 31.682 31.316 0.366 25913
2630 1 12 . 1 1 31 31 ARG H H 31 9.604 9.604 7.664 1.940 25913
2631 1 12 . 1 1 32 32 CYS N N 32 119.758 119.758 114.158 5.600 25913
2632 1 12 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.833 0.006 25913
2633 1 12 . 1 1 32 32 CYS C C 32 176.450 176.450 174.291 2.159 25913
2634 1 12 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.691 1.019 25913
2635 1 12 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.554 3.676 25913
2636 1 12 . 1 1 32 32 CYS H H 32 8.549 8.549 7.744 0.805 25913
2637 1 12 . 1 1 33 33 GLU N N 33 118.109 118.109 120.166 -2.057 25913
2638 1 12 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.054 0.024 25913
2639 1 12 . 1 1 33 33 GLU C C 33 174.739 174.739 175.978 -1.239 25913
2640 1 12 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.481 1.037 25913
2641 1 12 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.353 -0.661 25913
2642 1 12 . 1 1 33 33 GLU H H 33 7.868 7.868 8.223 -0.355 25913
2643 1 12 . 1 1 34 34 SER N N 34 117.224 117.224 114.876 2.348 25913
2644 1 12 . 1 1 34 34 SER HA H 34 4.437 4.437 4.532 -0.095 25913
2645 1 12 . 1 1 34 34 SER C C 34 175.392 175.392 175.515 -0.123 25913
2646 1 12 . 1 1 34 34 SER CA C 34 59.277 59.277 59.562 -0.285 25913
2647 1 12 . 1 1 34 34 SER CB C 34 65.429 65.429 64.449 0.980 25913
2648 1 12 . 1 1 34 34 SER H H 34 8.786 8.786 8.100 0.686 25913
2649 1 12 . 1 1 35 35 GLY N N 35 111.095 111.095 107.656 3.439 25913
2650 1 12 . 1 1 35 35 GLY C C 35 175.730 175.730 174.355 1.375 25913
2651 1 12 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.660 0.581 25913
2652 1 12 . 1 1 35 35 GLY H H 35 8.511 8.511 8.506 0.005 25913
2653 1 12 . 1 1 36 36 PHE N N 36 126.409 126.409 125.168 1.241 25913
2654 1 12 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.408 0.743 25913
2655 1 12 . 1 1 36 36 PHE C C 36 174.098 174.098 174.708 -0.610 25913
2656 1 12 . 1 1 36 36 PHE CA C 36 55.269 55.269 58.984 -3.715 25913
2657 1 12 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.577 -1.550 25913
2658 1 12 . 1 1 36 36 PHE H H 36 8.850 8.850 7.677 1.173 25913
2659 1 12 . 1 1 37 37 ILE N N 37 117.377 117.377 115.900 1.477 25913
2660 1 12 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.324 0.032 25913
2661 1 12 . 1 1 37 37 ILE C C 37 175.508 175.508 174.787 0.721 25913
2662 1 12 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.612 0.075 25913
2663 1 12 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.532 -1.384 25913
2664 1 12 . 1 1 37 37 ILE H H 37 7.972 7.972 7.852 0.120 25913
2665 1 12 . 1 1 38 38 GLU N N 38 124.869 124.869 122.852 2.017 25913
2666 1 12 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.562 0.323 25913
2667 1 12 . 1 1 38 38 GLU C C 38 174.300 174.300 175.321 -1.021 25913
2668 1 12 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.890 -0.234 25913
2669 1 12 . 1 1 38 38 GLU CB C 38 34.589 34.589 32.297 2.292 25913
2670 1 12 . 1 1 38 38 GLU H H 38 9.131 9.131 8.863 0.268 25913
2671 1 12 . 1 1 39 39 GLU N N 39 127.840 127.840 126.956 0.884 25913
2672 1 12 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.227 0.621 25913
2673 1 12 . 1 1 39 39 GLU C C 39 175.507 175.507 175.542 -0.035 25913
2674 1 12 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.772 0.733 25913
2675 1 12 . 1 1 39 39 GLU CB C 39 30.249 30.249 29.025 1.224 25913
2676 1 12 . 1 1 39 39 GLU H H 39 8.844 8.844 8.638 0.206 25913
2677 1 13 . 1 1 0 0 SER HA H 0 4.525 4.525 4.357 0.168 25913
2678 1 13 . 1 1 0 0 SER C C 0 174.776 174.776 175.822 -1.046 25913
2679 1 13 . 1 1 0 0 SER CA C 0 58.364 58.364 58.690 -0.326 25913
2680 1 13 . 1 1 0 0 SER CB C 0 64.049 64.049 63.968 0.081 25913
2681 1 13 . 1 1 1 1 MET N N 1 123.174 123.174 120.807 2.367 25913
2682 1 13 . 1 1 1 1 MET HA H 1 4.486 4.486 4.044 0.442 25913
2683 1 13 . 1 1 1 1 MET C C 1 176.177 176.177 175.165 1.012 25913
2684 1 13 . 1 1 1 1 MET CA C 1 55.804 55.804 57.243 -1.439 25913
2685 1 13 . 1 1 1 1 MET CB C 1 32.941 32.941 31.535 1.406 25913
2686 1 13 . 1 1 1 1 MET H H 1 8.592 8.592 8.076 0.516 25913
2687 1 13 . 1 1 2 2 ALA N N 2 125.785 125.785 120.695 5.090 25913
2688 1 13 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.441 -0.148 25913
2689 1 13 . 1 1 2 2 ALA C C 2 177.812 177.812 177.640 0.172 25913
2690 1 13 . 1 1 2 2 ALA CA C 2 52.809 52.809 51.145 1.664 25913
2691 1 13 . 1 1 2 2 ALA CB C 2 19.224 19.224 18.282 0.942 25913
2692 1 13 . 1 1 2 2 ALA H H 2 8.337 8.337 7.680 0.657 25913
2693 1 13 . 1 1 3 3 GLU N N 3 120.731 120.731 121.821 -1.090 25913
2694 1 13 . 1 1 3 3 GLU HA H 3 4.256 4.256 4.103 0.153 25913
2695 1 13 . 1 1 3 3 GLU C C 3 176.186 176.186 176.715 -0.529 25913
2696 1 13 . 1 1 3 3 GLU CA C 3 56.377 56.377 59.129 -2.752 25913
2697 1 13 . 1 1 3 3 GLU CB C 3 30.549 30.549 29.286 1.263 25913
2698 1 13 . 1 1 3 3 GLU H H 3 8.274 8.274 7.835 0.439 25913
2699 1 13 . 1 1 4 4 ALA N N 4 125.716 125.716 121.493 4.223 25913
2700 1 13 . 1 1 4 4 ALA HA H 4 4.345 4.345 4.518 -0.173 25913
2701 1 13 . 1 1 4 4 ALA C C 4 177.530 177.530 176.557 0.973 25913
2702 1 13 . 1 1 4 4 ALA CA C 4 52.413 52.413 52.042 0.371 25913
2703 1 13 . 1 1 4 4 ALA CB C 4 19.466 19.466 18.728 0.738 25913
2704 1 13 . 1 1 4 4 ALA H H 4 8.271 8.271 8.267 0.004 25913
2705 1 13 . 1 1 5 5 SER N N 5 117.161 117.161 114.844 2.317 25913
2706 1 13 . 1 1 5 5 SER HA H 5 4.724 4.724 4.883 -0.159 25913
2707 1 13 . 1 1 5 5 SER C C 5 172.661 172.661 171.782 0.879 25913
2708 1 13 . 1 1 5 5 SER CA C 5 56.354 56.354 56.089 0.265 25913
2709 1 13 . 1 1 5 5 SER CB C 5 63.442 63.442 64.492 -1.050 25913
2710 1 13 . 1 1 5 5 SER H H 5 8.259 8.259 7.740 0.519 25913
2711 1 13 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.410 0.004 25913
2712 1 13 . 1 1 6 6 PRO C C 6 176.523 176.523 175.312 1.211 25913
2713 1 13 . 1 1 6 6 PRO CA C 6 63.385 63.385 63.549 -0.164 25913
2714 1 13 . 1 1 6 6 PRO CB C 6 32.187 32.187 31.863 0.324 25913
2715 1 13 . 1 1 7 7 HIS N N 7 120.170 120.170 121.327 -1.157 25913
2716 1 13 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.940 0.040 25913
2717 1 13 . 1 1 7 7 HIS C C 7 172.577 172.577 173.119 -0.542 25913
2718 1 13 . 1 1 7 7 HIS CA C 7 53.492 53.492 53.284 0.208 25913
2719 1 13 . 1 1 7 7 HIS CB C 7 29.133 29.133 31.335 -2.202 25913
2720 1 13 . 1 1 7 7 HIS H H 7 8.489 8.489 7.656 0.833 25913
2721 1 13 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.729 -0.183 25913
2722 1 13 . 1 1 8 8 PRO C C 8 177.382 177.382 176.374 1.008 25913
2723 1 13 . 1 1 8 8 PRO CA C 8 63.443 63.443 63.115 0.328 25913
2724 1 13 . 1 1 8 8 PRO CB C 8 32.377 32.377 32.859 -0.482 25913
2725 1 13 . 1 1 9 9 GLY N N 9 110.263 110.263 110.939 -0.676 25913
2726 1 13 . 1 1 9 9 GLY C C 9 172.859 172.859 173.488 -0.629 25913
2727 1 13 . 1 1 9 9 GLY CA C 9 45.211 45.211 46.237 -1.026 25913
2728 1 13 . 1 1 9 9 GLY H H 9 8.635 8.635 8.871 -0.236 25913
2729 1 13 . 1 1 10 10 ARG N N 10 121.025 121.025 123.576 -2.551 25913
2730 1 13 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.733 0.049 25913
2731 1 13 . 1 1 10 10 ARG C C 10 175.125 175.125 174.925 0.200 25913
2732 1 13 . 1 1 10 10 ARG CA C 10 55.356 55.356 56.248 -0.892 25913
2733 1 13 . 1 1 10 10 ARG CB C 10 32.982 32.982 29.125 3.857 25913
2734 1 13 . 1 1 10 10 ARG H H 10 8.229 8.229 8.112 0.117 25913
2735 1 13 . 1 1 11 11 TYR N N 11 121.353 121.353 123.745 -2.392 25913
2736 1 13 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.681 -0.353 25913
2737 1 13 . 1 1 11 11 TYR C C 11 174.229 174.229 174.724 -0.495 25913
2738 1 13 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.125 0.924 25913
2739 1 13 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.513 -0.462 25913
2740 1 13 . 1 1 11 11 TYR H H 11 8.692 8.692 9.390 -0.698 25913
2741 1 13 . 1 1 12 12 PHE N N 12 122.456 122.456 122.044 0.412 25913
2742 1 13 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.339 -0.455 25913
2743 1 13 . 1 1 12 12 PHE C C 12 174.224 174.224 174.730 -0.506 25913
2744 1 13 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.412 0.607 25913
2745 1 13 . 1 1 12 12 PHE CB C 12 44.078 44.078 42.044 2.034 25913
2746 1 13 . 1 1 12 12 PHE H H 12 9.415 9.415 9.083 0.332 25913
2747 1 13 . 1 1 13 13 CYS N N 13 128.438 128.438 128.378 0.060 25913
2748 1 13 . 1 1 13 13 CYS HA H 13 4.653 4.653 5.043 -0.390 25913
2749 1 13 . 1 1 13 13 CYS C C 13 176.686 176.686 175.299 1.387 25913
2750 1 13 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.624 0.704 25913
2751 1 13 . 1 1 13 13 CYS CB C 13 31.220 31.220 28.328 2.892 25913
2752 1 13 . 1 1 13 13 CYS H H 13 7.942 7.942 8.923 -0.981 25913
2753 1 13 . 1 1 14 14 HIS N N 14 126.467 126.467 125.550 0.917 25913
2754 1 13 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.609 -0.286 25913
2755 1 13 . 1 1 14 14 HIS C C 14 175.452 175.452 176.429 -0.977 25913
2756 1 13 . 1 1 14 14 HIS CA C 14 58.736 58.736 58.122 0.614 25913
2757 1 13 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.667 -1.476 25913
2758 1 13 . 1 1 14 14 HIS H H 14 8.971 8.971 9.565 -0.594 25913
2759 1 13 . 1 1 15 15 CYS N N 15 123.882 123.882 118.054 5.828 25913
2760 1 13 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.270 0.172 25913
2761 1 13 . 1 1 15 15 CYS C C 15 176.939 176.939 175.938 1.001 25913
2762 1 13 . 1 1 15 15 CYS CA C 15 61.704 61.704 62.006 -0.302 25913
2763 1 13 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.712 -0.371 25913
2764 1 13 . 1 1 15 15 CYS H H 15 9.195 9.195 8.327 0.868 25913
2765 1 13 . 1 1 16 16 CYS N N 16 124.898 124.898 119.018 5.880 25913
2766 1 13 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.539 -0.541 25913
2767 1 13 . 1 1 16 16 CYS C C 16 175.557 175.557 174.673 0.884 25913
2768 1 13 . 1 1 16 16 CYS CB C 16 30.961 30.961 27.567 3.394 25913
2769 1 13 . 1 1 16 16 CYS H H 16 9.794 9.794 8.147 1.647 25913
2770 1 13 . 1 1 17 17 SER N N 17 114.055 114.055 113.846 0.209 25913
2771 1 13 . 1 1 17 17 SER HA H 17 3.755 3.755 4.071 -0.316 25913
2772 1 13 . 1 1 17 17 SER C C 17 173.790 173.790 173.267 0.523 25913
2773 1 13 . 1 1 17 17 SER CA C 17 58.868 58.868 59.457 -0.589 25913
2774 1 13 . 1 1 17 17 SER CB C 17 61.703 61.703 60.445 1.258 25913
2775 1 13 . 1 1 17 17 SER H H 17 7.950 7.950 7.970 -0.020 25913
2776 1 13 . 1 1 18 18 VAL N N 18 111.916 111.916 111.883 0.033 25913
2777 1 13 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.304 0.154 25913
2778 1 13 . 1 1 18 18 VAL C C 18 173.765 173.765 173.616 0.149 25913
2779 1 13 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.059 -0.027 25913
2780 1 13 . 1 1 18 18 VAL CB C 18 36.667 36.667 35.464 1.203 25913
2781 1 13 . 1 1 18 18 VAL H H 18 6.438 6.438 6.986 -0.548 25913
2782 1 13 . 1 1 19 19 GLU N N 19 123.431 123.431 122.130 1.301 25913
2783 1 13 . 1 1 19 19 GLU HA H 19 5.023 5.023 4.994 0.029 25913
2784 1 13 . 1 1 19 19 GLU C C 19 176.506 176.506 175.806 0.700 25913
2785 1 13 . 1 1 19 19 GLU CA C 19 56.818 56.818 56.539 0.279 25913
2786 1 13 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.524 -0.359 25913
2787 1 13 . 1 1 19 19 GLU H H 19 8.346 8.346 8.403 -0.057 25913
2788 1 13 . 1 1 20 20 ILE N N 20 117.751 117.751 120.182 -2.431 25913
2789 1 13 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.753 -0.012 25913
2790 1 13 . 1 1 20 20 ILE C C 20 175.511 175.511 173.925 1.586 25913
2791 1 13 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.353 -0.408 25913
2792 1 13 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.601 3.066 25913
2793 1 13 . 1 1 20 20 ILE H H 20 8.537 8.537 8.837 -0.300 25913
2794 1 13 . 1 1 21 21 VAL N N 21 124.220 124.220 121.422 2.798 25913
2795 1 13 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.240 -0.654 25913
2796 1 13 . 1 1 21 21 VAL C C 21 174.640 174.640 174.102 0.538 25913
2797 1 13 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.827 1.891 25913
2798 1 13 . 1 1 21 21 VAL CB C 21 32.503 32.503 34.123 -1.620 25913
2799 1 13 . 1 1 21 21 VAL H H 21 8.203 8.203 8.352 -0.149 25913
2800 1 13 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.670 -0.611 25913
2801 1 13 . 1 1 22 22 PRO C C 22 175.352 175.352 176.097 -0.745 25913
2802 1 13 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.683 -0.022 25913
2803 1 13 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.277 -0.263 25913
2804 1 13 . 1 1 23 23 ARG N N 23 121.370 121.370 122.843 -1.473 25913
2805 1 13 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.184 0.071 25913
2806 1 13 . 1 1 23 23 ARG C C 23 175.759 175.759 176.788 -1.029 25913
2807 1 13 . 1 1 23 23 ARG CA C 23 56.052 56.052 56.144 -0.092 25913
2808 1 13 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.184 1.702 25913
2809 1 13 . 1 1 23 23 ARG H H 23 8.635 8.635 8.152 0.483 25913
2810 1 13 . 1 1 24 24 LEU N N 24 127.914 127.914 127.258 0.656 25913
2811 1 13 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.677 0.496 25913
2812 1 13 . 1 1 24 24 LEU C C 24 175.774 175.774 175.943 -0.169 25913
2813 1 13 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.542 -5.604 25913
2814 1 13 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.154 2.266 25913
2815 1 13 . 1 1 24 24 LEU H H 24 8.521 8.521 8.563 -0.042 25913
2816 1 13 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.177 0.163 25913
2817 1 13 . 1 1 25 25 PRO C C 25 176.386 176.386 176.840 -0.454 25913
2818 1 13 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.529 -0.862 25913
2819 1 13 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.820 2.856 25913
2820 1 13 . 1 1 26 26 ASP N N 26 122.078 122.078 115.017 7.061 25913
2821 1 13 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.736 -0.349 25913
2822 1 13 . 1 1 26 26 ASP C C 26 175.321 175.321 175.565 -0.244 25913
2823 1 13 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.138 2.217 25913
2824 1 13 . 1 1 26 26 ASP CB C 26 41.066 41.066 42.828 -1.762 25913
2825 1 13 . 1 1 26 26 ASP H H 26 8.752 8.752 7.697 1.055 25913
2826 1 13 . 1 1 27 27 TYR N N 27 117.607 117.607 116.757 0.850 25913
2827 1 13 . 1 1 27 27 TYR HA H 27 3.449 3.449 3.983 -0.534 25913
2828 1 13 . 1 1 27 27 TYR C C 27 173.074 173.074 174.427 -1.353 25913
2829 1 13 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.364 1.073 25913
2830 1 13 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.731 -0.671 25913
2831 1 13 . 1 1 27 27 TYR H H 27 8.666 8.666 8.039 0.627 25913
2832 1 13 . 1 1 28 28 ILE N N 28 111.804 111.804 113.019 -1.215 25913
2833 1 13 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.427 0.348 25913
2834 1 13 . 1 1 28 28 ILE C C 28 175.083 175.083 174.809 0.274 25913
2835 1 13 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.251 -0.682 25913
2836 1 13 . 1 1 28 28 ILE CB C 28 42.107 42.107 40.944 1.163 25913
2837 1 13 . 1 1 28 28 ILE H H 28 6.761 6.761 7.279 -0.518 25913
2838 1 13 . 1 1 29 29 CYS N N 29 126.875 126.875 118.837 8.038 25913
2839 1 13 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.750 -0.342 25913
2840 1 13 . 1 1 29 29 CYS C C 29 175.932 175.932 174.979 0.953 25913
2841 1 13 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.931 0.471 25913
2842 1 13 . 1 1 29 29 CYS CB C 29 32.214 32.214 28.024 4.190 25913
2843 1 13 . 1 1 29 29 CYS H H 29 8.783 8.783 8.717 0.066 25913
2844 1 13 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.499 -0.117 25913
2845 1 13 . 1 1 30 30 PRO C C 30 176.824 176.824 177.038 -0.214 25913
2846 1 13 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.216 -0.176 25913
2847 1 13 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.835 0.509 25913
2848 1 13 . 1 1 31 31 ARG N N 31 124.131 124.131 117.483 6.648 25913
2849 1 13 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.445 -0.144 25913
2850 1 13 . 1 1 31 31 ARG C C 31 177.721 177.721 176.996 0.725 25913
2851 1 13 . 1 1 31 31 ARG CA C 31 58.190 58.190 57.761 0.429 25913
2852 1 13 . 1 1 31 31 ARG CB C 31 31.682 31.682 31.010 0.672 25913
2853 1 13 . 1 1 31 31 ARG H H 31 9.604 9.604 7.880 1.724 25913
2854 1 13 . 1 1 32 32 CYS N N 32 119.758 119.758 112.472 7.286 25913
2855 1 13 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.900 -0.061 25913
2856 1 13 . 1 1 32 32 CYS C C 32 176.450 176.450 174.004 2.446 25913
2857 1 13 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.320 1.390 25913
2858 1 13 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.582 3.648 25913
2859 1 13 . 1 1 32 32 CYS H H 32 8.549 8.549 7.582 0.967 25913
2860 1 13 . 1 1 33 33 GLU N N 33 118.109 118.109 119.897 -1.788 25913
2861 1 13 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.056 0.022 25913
2862 1 13 . 1 1 33 33 GLU C C 33 174.739 174.739 176.039 -1.300 25913
2863 1 13 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.585 0.933 25913
2864 1 13 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.302 -0.610 25913
2865 1 13 . 1 1 33 33 GLU H H 33 7.868 7.868 8.259 -0.391 25913
2866 1 13 . 1 1 34 34 SER N N 34 117.224 117.224 114.925 2.299 25913
2867 1 13 . 1 1 34 34 SER HA H 34 4.437 4.437 4.521 -0.084 25913
2868 1 13 . 1 1 34 34 SER C C 34 175.392 175.392 175.529 -0.137 25913
2869 1 13 . 1 1 34 34 SER CA C 34 59.277 59.277 59.651 -0.374 25913
2870 1 13 . 1 1 34 34 SER CB C 34 65.429 65.429 64.525 0.904 25913
2871 1 13 . 1 1 34 34 SER H H 34 8.786 8.786 7.944 0.842 25913
2872 1 13 . 1 1 35 35 GLY N N 35 111.095 111.095 107.700 3.395 25913
2873 1 13 . 1 1 35 35 GLY C C 35 175.730 175.730 174.352 1.378 25913
2874 1 13 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.636 0.605 25913
2875 1 13 . 1 1 35 35 GLY H H 35 8.511 8.511 8.489 0.022 25913
2876 1 13 . 1 1 36 36 PHE N N 36 126.409 126.409 124.982 1.427 25913
2877 1 13 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.440 0.711 25913
2878 1 13 . 1 1 36 36 PHE C C 36 174.098 174.098 174.657 -0.559 25913
2879 1 13 . 1 1 36 36 PHE CA C 36 55.269 55.269 58.952 -3.683 25913
2880 1 13 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.528 -1.501 25913
2881 1 13 . 1 1 36 36 PHE H H 36 8.850 8.850 7.646 1.204 25913
2882 1 13 . 1 1 37 37 ILE N N 37 117.377 117.377 115.760 1.617 25913
2883 1 13 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.436 -0.080 25913
2884 1 13 . 1 1 37 37 ILE C C 37 175.508 175.508 174.881 0.627 25913
2885 1 13 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.675 0.012 25913
2886 1 13 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.550 -1.402 25913
2887 1 13 . 1 1 37 37 ILE H H 37 7.972 7.972 7.939 0.034 25913
2888 1 13 . 1 1 38 38 GLU N N 38 124.869 124.869 123.201 1.668 25913
2889 1 13 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.615 0.270 25913
2890 1 13 . 1 1 38 38 GLU C C 38 174.300 174.300 175.372 -1.072 25913
2891 1 13 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.906 -0.250 25913
2892 1 13 . 1 1 38 38 GLU CB C 38 34.589 34.589 32.392 2.197 25913
2893 1 13 . 1 1 38 38 GLU H H 38 9.131 9.131 8.937 0.194 25913
2894 1 13 . 1 1 39 39 GLU N N 39 127.840 127.840 126.889 0.951 25913
2895 1 13 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.196 0.652 25913
2896 1 13 . 1 1 39 39 GLU C C 39 175.507 175.507 175.621 -0.114 25913
2897 1 13 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.803 0.702 25913
2898 1 13 . 1 1 39 39 GLU CB C 39 30.249 30.249 28.966 1.282 25913
2899 1 13 . 1 1 39 39 GLU H H 39 8.844 8.844 8.652 0.192 25913
2900 1 14 . 1 1 0 0 SER HA H 0 4.525 4.525 4.308 0.217 25913
2901 1 14 . 1 1 0 0 SER C C 0 174.776 174.776 175.346 -0.570 25913
2902 1 14 . 1 1 0 0 SER CA C 0 58.364 58.364 58.524 -0.160 25913
2903 1 14 . 1 1 0 0 SER CB C 0 64.049 64.049 63.114 0.935 25913
2904 1 14 . 1 1 1 1 MET N N 1 123.174 123.174 119.595 3.579 25913
2905 1 14 . 1 1 1 1 MET HA H 1 4.486 4.486 4.429 0.057 25913
2906 1 14 . 1 1 1 1 MET C C 1 176.177 176.177 176.570 -0.393 25913
2907 1 14 . 1 1 1 1 MET CA C 1 55.804 55.804 56.867 -1.063 25913
2908 1 14 . 1 1 1 1 MET CB C 1 32.941 32.941 32.839 0.103 25913
2909 1 14 . 1 1 1 1 MET H H 1 8.592 8.592 7.930 0.662 25913
2910 1 14 . 1 1 2 2 ALA N N 2 125.785 125.785 121.329 4.456 25913
2911 1 14 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.342 -0.049 25913
2912 1 14 . 1 1 2 2 ALA C C 2 177.812 177.812 177.131 0.681 25913
2913 1 14 . 1 1 2 2 ALA CA C 2 52.809 52.809 52.600 0.209 25913
2914 1 14 . 1 1 2 2 ALA CB C 2 19.224 19.224 18.889 0.336 25913
2915 1 14 . 1 1 2 2 ALA H H 2 8.337 8.337 7.758 0.579 25913
2916 1 14 . 1 1 3 3 GLU N N 3 120.731 120.731 117.803 2.928 25913
2917 1 14 . 1 1 3 3 GLU HA H 3 4.256 4.256 4.051 0.205 25913
2918 1 14 . 1 1 3 3 GLU C C 3 176.186 176.186 175.303 0.883 25913
2919 1 14 . 1 1 3 3 GLU CA C 3 56.377 56.377 56.242 0.135 25913
2920 1 14 . 1 1 3 3 GLU CB C 3 30.549 30.549 27.796 2.753 25913
2921 1 14 . 1 1 3 3 GLU H H 3 8.274 8.274 8.253 0.021 25913
2922 1 14 . 1 1 4 4 ALA N N 4 125.716 125.716 121.898 3.818 25913
2923 1 14 . 1 1 4 4 ALA HA H 4 4.345 4.345 4.098 0.247 25913
2924 1 14 . 1 1 4 4 ALA C C 4 177.530 177.530 175.859 1.671 25913
2925 1 14 . 1 1 4 4 ALA CA C 4 52.413 52.413 52.525 -0.112 25913
2926 1 14 . 1 1 4 4 ALA CB C 4 19.466 19.466 18.875 0.591 25913
2927 1 14 . 1 1 4 4 ALA H H 4 8.271 8.271 7.896 0.375 25913
2928 1 14 . 1 1 5 5 SER N N 5 117.161 117.161 115.363 1.798 25913
2929 1 14 . 1 1 5 5 SER HA H 5 4.724 4.724 4.690 0.034 25913
2930 1 14 . 1 1 5 5 SER C C 5 172.661 172.661 172.844 -0.183 25913
2931 1 14 . 1 1 5 5 SER CA C 5 56.354 56.354 57.172 -0.818 25913
2932 1 14 . 1 1 5 5 SER CB C 5 63.442 63.442 63.739 -0.297 25913
2933 1 14 . 1 1 5 5 SER H H 5 8.259 8.259 8.431 -0.172 25913
2934 1 14 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.585 -0.171 25913
2935 1 14 . 1 1 6 6 PRO C C 6 176.523 176.523 175.326 1.197 25913
2936 1 14 . 1 1 6 6 PRO CA C 6 63.385 63.385 63.568 -0.183 25913
2937 1 14 . 1 1 6 6 PRO CB C 6 32.187 32.187 32.211 -0.024 25913
2938 1 14 . 1 1 7 7 HIS N N 7 120.170 120.170 111.135 9.035 25913
2939 1 14 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.970 0.010 25913
2940 1 14 . 1 1 7 7 HIS C C 7 172.577 172.577 173.199 -0.622 25913
2941 1 14 . 1 1 7 7 HIS CA C 7 53.492 53.492 54.652 -1.160 25913
2942 1 14 . 1 1 7 7 HIS CB C 7 29.133 29.133 29.853 -0.720 25913
2943 1 14 . 1 1 7 7 HIS H H 7 8.489 8.489 7.132 1.357 25913
2944 1 14 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.624 -0.078 25913
2945 1 14 . 1 1 8 8 PRO C C 8 177.382 177.382 177.089 0.293 25913
2946 1 14 . 1 1 8 8 PRO CA C 8 63.443 63.443 63.401 0.042 25913
2947 1 14 . 1 1 8 8 PRO CB C 8 32.377 32.377 33.212 -0.835 25913
2948 1 14 . 1 1 9 9 GLY N N 9 110.263 110.263 105.599 4.664 25913
2949 1 14 . 1 1 9 9 GLY C C 9 172.859 172.859 173.280 -0.421 25913
2950 1 14 . 1 1 9 9 GLY CA C 9 45.211 45.211 45.036 0.175 25913
2951 1 14 . 1 1 9 9 GLY H H 9 8.635 8.635 8.276 0.359 25913
2952 1 14 . 1 1 10 10 ARG N N 10 121.025 121.025 123.191 -2.166 25913
2953 1 14 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.594 0.188 25913
2954 1 14 . 1 1 10 10 ARG C C 10 175.125 175.125 174.895 0.230 25913
2955 1 14 . 1 1 10 10 ARG CA C 10 55.356 55.356 56.522 -1.166 25913
2956 1 14 . 1 1 10 10 ARG CB C 10 32.982 32.982 29.826 3.156 25913
2957 1 14 . 1 1 10 10 ARG H H 10 8.229 8.229 8.029 0.200 25913
2958 1 14 . 1 1 11 11 TYR N N 11 121.353 121.353 123.496 -2.143 25913
2959 1 14 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.714 -0.386 25913
2960 1 14 . 1 1 11 11 TYR C C 11 174.229 174.229 174.598 -0.369 25913
2961 1 14 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.154 0.895 25913
2962 1 14 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.809 -0.758 25913
2963 1 14 . 1 1 11 11 TYR H H 11 8.692 8.692 9.327 -0.635 25913
2964 1 14 . 1 1 12 12 PHE N N 12 122.456 122.456 122.153 0.303 25913
2965 1 14 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.336 -0.452 25913
2966 1 14 . 1 1 12 12 PHE C C 12 174.224 174.224 174.713 -0.489 25913
2967 1 14 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.420 0.599 25913
2968 1 14 . 1 1 12 12 PHE CB C 12 44.078 44.078 42.047 2.031 25913
2969 1 14 . 1 1 12 12 PHE H H 12 9.415 9.415 8.975 0.440 25913
2970 1 14 . 1 1 13 13 CYS N N 13 128.438 128.438 128.340 0.098 25913
2971 1 14 . 1 1 13 13 CYS HA H 13 4.653 4.653 5.070 -0.417 25913
2972 1 14 . 1 1 13 13 CYS C C 13 176.686 176.686 175.166 1.520 25913
2973 1 14 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.512 0.816 25913
2974 1 14 . 1 1 13 13 CYS CB C 13 31.220 31.220 28.557 2.663 25913
2975 1 14 . 1 1 13 13 CYS H H 13 7.942 7.942 8.886 -0.944 25913
2976 1 14 . 1 1 14 14 HIS N N 14 126.467 126.467 125.760 0.707 25913
2977 1 14 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.661 -0.338 25913
2978 1 14 . 1 1 14 14 HIS C C 14 175.452 175.452 176.121 -0.669 25913
2979 1 14 . 1 1 14 14 HIS CA C 14 58.736 58.736 58.192 0.544 25913
2980 1 14 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.831 -1.640 25913
2981 1 14 . 1 1 14 14 HIS H H 14 8.971 8.971 9.513 -0.542 25913
2982 1 14 . 1 1 15 15 CYS N N 15 123.882 123.882 118.323 5.559 25913
2983 1 14 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.339 0.103 25913
2984 1 14 . 1 1 15 15 CYS C C 15 176.939 176.939 175.953 0.986 25913
2985 1 14 . 1 1 15 15 CYS CA C 15 61.704 61.704 61.445 0.259 25913
2986 1 14 . 1 1 15 15 CYS CB C 15 28.341 28.341 29.125 -0.784 25913
2987 1 14 . 1 1 15 15 CYS H H 15 9.195 9.195 8.125 1.070 25913
2988 1 14 . 1 1 16 16 CYS N N 16 124.898 124.898 121.026 3.872 25913
2989 1 14 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.569 -0.571 25913
2990 1 14 . 1 1 16 16 CYS C C 16 175.557 175.557 174.528 1.029 25913
2991 1 14 . 1 1 16 16 CYS CB C 16 30.961 30.961 27.359 3.602 25913
2992 1 14 . 1 1 16 16 CYS H H 16 9.794 9.794 8.002 1.792 25913
2993 1 14 . 1 1 17 17 SER N N 17 114.055 114.055 113.895 0.160 25913
2994 1 14 . 1 1 17 17 SER HA H 17 3.755 3.755 4.006 -0.251 25913
2995 1 14 . 1 1 17 17 SER C C 17 173.790 173.790 173.221 0.569 25913
2996 1 14 . 1 1 17 17 SER CA C 17 58.868 58.868 59.511 -0.643 25913
2997 1 14 . 1 1 17 17 SER CB C 17 61.703 61.703 60.409 1.294 25913
2998 1 14 . 1 1 17 17 SER H H 17 7.950 7.950 8.107 -0.157 25913
2999 1 14 . 1 1 18 18 VAL N N 18 111.916 111.916 111.918 -0.002 25913
3000 1 14 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.301 0.157 25913
3001 1 14 . 1 1 18 18 VAL C C 18 173.765 173.765 173.628 0.137 25913
3002 1 14 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.060 -0.028 25913
3003 1 14 . 1 1 18 18 VAL CB C 18 36.667 36.667 35.422 1.245 25913
3004 1 14 . 1 1 18 18 VAL H H 18 6.438 6.438 6.948 -0.510 25913
3005 1 14 . 1 1 19 19 GLU N N 19 123.431 123.431 121.991 1.440 25913
3006 1 14 . 1 1 19 19 GLU HA H 19 5.023 5.023 5.048 -0.025 25913
3007 1 14 . 1 1 19 19 GLU C C 19 176.506 176.506 176.228 0.278 25913
3008 1 14 . 1 1 19 19 GLU CA C 19 56.818 56.818 56.349 0.469 25913
3009 1 14 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.483 -0.318 25913
3010 1 14 . 1 1 19 19 GLU H H 19 8.346 8.346 8.449 -0.103 25913
3011 1 14 . 1 1 20 20 ILE N N 20 117.751 117.751 121.193 -3.442 25913
3012 1 14 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.774 -0.033 25913
3013 1 14 . 1 1 20 20 ILE C C 20 175.511 175.511 173.828 1.683 25913
3014 1 14 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.389 -0.444 25913
3015 1 14 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.738 2.929 25913
3016 1 14 . 1 1 20 20 ILE H H 20 8.537 8.537 8.841 -0.304 25913
3017 1 14 . 1 1 21 21 VAL N N 21 124.220 124.220 121.575 2.645 25913
3018 1 14 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.221 -0.635 25913
3019 1 14 . 1 1 21 21 VAL C C 21 174.640 174.640 174.158 0.482 25913
3020 1 14 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.970 1.748 25913
3021 1 14 . 1 1 21 21 VAL CB C 21 32.503 32.503 34.177 -1.674 25913
3022 1 14 . 1 1 21 21 VAL H H 21 8.203 8.203 8.311 -0.108 25913
3023 1 14 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.606 -0.547 25913
3024 1 14 . 1 1 22 22 PRO C C 22 175.352 175.352 176.130 -0.778 25913
3025 1 14 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.587 0.074 25913
3026 1 14 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.358 -0.344 25913
3027 1 14 . 1 1 23 23 ARG N N 23 121.370 121.370 123.440 -2.070 25913
3028 1 14 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.122 0.133 25913
3029 1 14 . 1 1 23 23 ARG C C 23 175.759 175.759 176.703 -0.944 25913
3030 1 14 . 1 1 23 23 ARG CA C 23 56.052 56.052 56.271 -0.219 25913
3031 1 14 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.184 1.702 25913
3032 1 14 . 1 1 23 23 ARG H H 23 8.635 8.635 8.095 0.540 25913
3033 1 14 . 1 1 24 24 LEU N N 24 127.914 127.914 128.475 -0.561 25913
3034 1 14 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.741 0.432 25913
3035 1 14 . 1 1 24 24 LEU C C 24 175.774 175.774 175.824 -0.050 25913
3036 1 14 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.233 -5.295 25913
3037 1 14 . 1 1 24 24 LEU CB C 24 41.420 41.420 38.871 2.549 25913
3038 1 14 . 1 1 24 24 LEU H H 24 8.521 8.521 8.668 -0.147 25913
3039 1 14 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.128 0.212 25913
3040 1 14 . 1 1 25 25 PRO C C 25 176.386 176.386 176.763 -0.377 25913
3041 1 14 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.445 -0.778 25913
3042 1 14 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.775 2.901 25913
3043 1 14 . 1 1 26 26 ASP N N 26 122.078 122.078 115.315 6.763 25913
3044 1 14 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.689 -0.302 25913
3045 1 14 . 1 1 26 26 ASP C C 26 175.321 175.321 175.598 -0.277 25913
3046 1 14 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.184 2.171 25913
3047 1 14 . 1 1 26 26 ASP CB C 26 41.066 41.066 42.610 -1.544 25913
3048 1 14 . 1 1 26 26 ASP H H 26 8.752 8.752 7.562 1.190 25913
3049 1 14 . 1 1 27 27 TYR N N 27 117.607 117.607 116.859 0.748 25913
3050 1 14 . 1 1 27 27 TYR HA H 27 3.449 3.449 3.967 -0.518 25913
3051 1 14 . 1 1 27 27 TYR C C 27 173.074 173.074 174.335 -1.261 25913
3052 1 14 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.273 1.164 25913
3053 1 14 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.652 -0.592 25913
3054 1 14 . 1 1 27 27 TYR H H 27 8.666 8.666 7.965 0.701 25913
3055 1 14 . 1 1 28 28 ILE N N 28 111.804 111.804 112.597 -0.793 25913
3056 1 14 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.475 0.300 25913
3057 1 14 . 1 1 28 28 ILE C C 28 175.083 175.083 174.418 0.665 25913
3058 1 14 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.057 -0.488 25913
3059 1 14 . 1 1 28 28 ILE CB C 28 42.107 42.107 41.357 0.750 25913
3060 1 14 . 1 1 28 28 ILE H H 28 6.761 6.761 7.294 -0.533 25913
3061 1 14 . 1 1 29 29 CYS N N 29 126.875 126.875 118.670 8.205 25913
3062 1 14 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.775 -0.367 25913
3063 1 14 . 1 1 29 29 CYS C C 29 175.932 175.932 175.149 0.783 25913
3064 1 14 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.749 0.653 25913
3065 1 14 . 1 1 29 29 CYS CB C 29 32.214 32.214 28.047 4.167 25913
3066 1 14 . 1 1 29 29 CYS H H 29 8.783 8.783 8.685 0.098 25913
3067 1 14 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.422 -0.040 25913
3068 1 14 . 1 1 30 30 PRO C C 30 176.824 176.824 177.514 -0.690 25913
3069 1 14 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.549 -0.509 25913
3070 1 14 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.941 0.403 25913
3071 1 14 . 1 1 31 31 ARG N N 31 124.131 124.131 117.034 7.097 25913
3072 1 14 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.427 -0.126 25913
3073 1 14 . 1 1 31 31 ARG C C 31 177.721 177.721 177.120 0.601 25913
3074 1 14 . 1 1 31 31 ARG CA C 31 58.190 58.190 57.802 0.388 25913
3075 1 14 . 1 1 31 31 ARG CB C 31 31.682 31.682 30.910 0.772 25913
3076 1 14 . 1 1 31 31 ARG H H 31 9.604 9.604 7.700 1.904 25913
3077 1 14 . 1 1 32 32 CYS N N 32 119.758 119.758 113.760 5.998 25913
3078 1 14 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.842 -0.003 25913
3079 1 14 . 1 1 32 32 CYS C C 32 176.450 176.450 174.486 1.964 25913
3080 1 14 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.567 1.143 25913
3081 1 14 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.437 3.793 25913
3082 1 14 . 1 1 32 32 CYS H H 32 8.549 8.549 7.740 0.809 25913
3083 1 14 . 1 1 33 33 GLU N N 33 118.109 118.109 120.137 -2.028 25913
3084 1 14 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.026 0.052 25913
3085 1 14 . 1 1 33 33 GLU C C 33 174.739 174.739 176.031 -1.292 25913
3086 1 14 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.529 0.989 25913
3087 1 14 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.269 -0.577 25913
3088 1 14 . 1 1 33 33 GLU H H 33 7.868 7.868 8.237 -0.369 25913
3089 1 14 . 1 1 34 34 SER N N 34 117.224 117.224 114.968 2.256 25913
3090 1 14 . 1 1 34 34 SER HA H 34 4.437 4.437 4.490 -0.053 25913
3091 1 14 . 1 1 34 34 SER C C 34 175.392 175.392 175.631 -0.239 25913
3092 1 14 . 1 1 34 34 SER CA C 34 59.277 59.277 60.062 -0.785 25913
3093 1 14 . 1 1 34 34 SER CB C 34 65.429 65.429 64.372 1.057 25913
3094 1 14 . 1 1 34 34 SER H H 34 8.786 8.786 8.061 0.725 25913
3095 1 14 . 1 1 35 35 GLY N N 35 111.095 111.095 107.861 3.234 25913
3096 1 14 . 1 1 35 35 GLY C C 35 175.730 175.730 174.629 1.101 25913
3097 1 14 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.659 0.582 25913
3098 1 14 . 1 1 35 35 GLY H H 35 8.511 8.511 8.421 0.090 25913
3099 1 14 . 1 1 36 36 PHE N N 36 126.409 126.409 125.229 1.180 25913
3100 1 14 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.472 0.679 25913
3101 1 14 . 1 1 36 36 PHE C C 36 174.098 174.098 174.706 -0.608 25913
3102 1 14 . 1 1 36 36 PHE CA C 36 55.269 55.269 58.972 -3.704 25913
3103 1 14 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.486 -1.459 25913
3104 1 14 . 1 1 36 36 PHE H H 36 8.850 8.850 7.774 1.076 25913
3105 1 14 . 1 1 37 37 ILE N N 37 117.377 117.377 115.727 1.650 25913
3106 1 14 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.478 -0.122 25913
3107 1 14 . 1 1 37 37 ILE C C 37 175.508 175.508 174.936 0.572 25913
3108 1 14 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.629 0.058 25913
3109 1 14 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.553 -1.405 25913
3110 1 14 . 1 1 37 37 ILE H H 37 7.972 7.972 7.923 0.049 25913
3111 1 14 . 1 1 38 38 GLU N N 38 124.869 124.869 123.051 1.818 25913
3112 1 14 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.601 0.284 25913
3113 1 14 . 1 1 38 38 GLU C C 38 174.300 174.300 175.290 -0.990 25913
3114 1 14 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.930 -0.274 25913
3115 1 14 . 1 1 38 38 GLU CB C 38 34.589 34.589 32.308 2.281 25913
3116 1 14 . 1 1 38 38 GLU H H 38 9.131 9.131 8.855 0.276 25913
3117 1 14 . 1 1 39 39 GLU N N 39 127.840 127.840 127.113 0.727 25913
3118 1 14 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.408 0.440 25913
3119 1 14 . 1 1 39 39 GLU C C 39 175.507 175.507 175.684 -0.177 25913
3120 1 14 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.577 0.928 25913
3121 1 14 . 1 1 39 39 GLU CB C 39 30.249 30.249 28.984 1.265 25913
3122 1 14 . 1 1 39 39 GLU H H 39 8.844 8.844 8.614 0.230 25913
3123 1 15 . 1 1 0 0 SER HA H 0 4.525 4.525 4.471 0.054 25913
3124 1 15 . 1 1 0 0 SER C C 0 174.776 174.776 174.664 0.112 25913
3125 1 15 . 1 1 0 0 SER CA C 0 58.364 58.364 58.417 -0.053 25913
3126 1 15 . 1 1 0 0 SER CB C 0 64.049 64.049 63.590 0.459 25913
3127 1 15 . 1 1 1 1 MET N N 1 123.174 123.174 123.390 -0.216 25913
3128 1 15 . 1 1 1 1 MET HA H 1 4.486 4.486 4.259 0.227 25913
3129 1 15 . 1 1 1 1 MET C C 1 176.177 176.177 175.045 1.132 25913
3130 1 15 . 1 1 1 1 MET CA C 1 55.804 55.804 55.411 0.393 25913
3131 1 15 . 1 1 1 1 MET CB C 1 32.941 32.941 32.197 0.744 25913
3132 1 15 . 1 1 1 1 MET H H 1 8.592 8.592 8.782 -0.190 25913
3133 1 15 . 1 1 2 2 ALA N N 2 125.785 125.785 126.613 -0.828 25913
3134 1 15 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.449 -0.156 25913
3135 1 15 . 1 1 2 2 ALA C C 2 177.812 177.812 176.435 1.377 25913
3136 1 15 . 1 1 2 2 ALA CA C 2 52.809 52.809 51.749 1.060 25913
3137 1 15 . 1 1 2 2 ALA CB C 2 19.224 19.224 19.192 0.032 25913
3138 1 15 . 1 1 2 2 ALA H H 2 8.337 8.337 8.452 -0.115 25913
3139 1 15 . 1 1 3 3 GLU N N 3 120.731 120.731 116.738 3.993 25913
3140 1 15 . 1 1 3 3 GLU HA H 3 4.256 4.256 3.997 0.259 25913
3141 1 15 . 1 1 3 3 GLU C C 3 176.186 176.186 176.137 0.049 25913
3142 1 15 . 1 1 3 3 GLU CA C 3 56.377 56.377 56.981 -0.604 25913
3143 1 15 . 1 1 3 3 GLU CB C 3 30.549 30.549 27.513 3.036 25913
3144 1 15 . 1 1 3 3 GLU H H 3 8.274 8.274 8.367 -0.093 25913
3145 1 15 . 1 1 4 4 ALA N N 4 125.716 125.716 119.445 6.271 25913
3146 1 15 . 1 1 4 4 ALA HA H 4 4.345 4.345 4.160 0.185 25913
3147 1 15 . 1 1 4 4 ALA C C 4 177.530 177.530 178.108 -0.578 25913
3148 1 15 . 1 1 4 4 ALA CA C 4 52.413 52.413 53.460 -1.047 25913
3149 1 15 . 1 1 4 4 ALA CB C 4 19.466 19.466 19.386 0.080 25913
3150 1 15 . 1 1 4 4 ALA H H 4 8.271 8.271 8.523 -0.252 25913
3151 1 15 . 1 1 5 5 SER N N 5 117.161 117.161 113.597 3.564 25913
3152 1 15 . 1 1 5 5 SER HA H 5 4.724 4.724 4.786 -0.062 25913
3153 1 15 . 1 1 5 5 SER C C 5 172.661 172.661 172.765 -0.104 25913
3154 1 15 . 1 1 5 5 SER CA C 5 56.354 56.354 59.251 -2.897 25913
3155 1 15 . 1 1 5 5 SER CB C 5 63.442 63.442 62.160 1.282 25913
3156 1 15 . 1 1 5 5 SER H H 5 8.259 8.259 8.441 -0.182 25913
3157 1 15 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.547 -0.133 25913
3158 1 15 . 1 1 6 6 PRO C C 6 176.523 176.523 175.598 0.925 25913
3159 1 15 . 1 1 6 6 PRO CA C 6 63.385 63.385 63.452 -0.067 25913
3160 1 15 . 1 1 6 6 PRO CB C 6 32.187 32.187 30.463 1.724 25913
3161 1 15 . 1 1 7 7 HIS N N 7 120.170 120.170 120.679 -0.509 25913
3162 1 15 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.827 0.153 25913
3163 1 15 . 1 1 7 7 HIS C C 7 172.577 172.577 172.367 0.210 25913
3164 1 15 . 1 1 7 7 HIS CA C 7 53.492 53.492 53.985 -0.493 25913
3165 1 15 . 1 1 7 7 HIS CB C 7 29.133 29.133 29.741 -0.608 25913
3166 1 15 . 1 1 7 7 HIS H H 7 8.489 8.489 7.805 0.684 25913
3167 1 15 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.411 0.135 25913
3168 1 15 . 1 1 8 8 PRO C C 8 177.382 177.382 176.441 0.941 25913
3169 1 15 . 1 1 8 8 PRO CA C 8 63.443 63.443 63.183 0.260 25913
3170 1 15 . 1 1 8 8 PRO CB C 8 32.377 32.377 32.268 0.109 25913
3171 1 15 . 1 1 9 9 GLY N N 9 110.263 110.263 109.222 1.041 25913
3172 1 15 . 1 1 9 9 GLY C C 9 172.859 172.859 173.139 -0.280 25913
3173 1 15 . 1 1 9 9 GLY CA C 9 45.211 45.211 46.022 -0.811 25913
3174 1 15 . 1 1 9 9 GLY H H 9 8.635 8.635 8.772 -0.137 25913
3175 1 15 . 1 1 10 10 ARG N N 10 121.025 121.025 122.759 -1.734 25913
3176 1 15 . 1 1 10 10 ARG HA H 10 4.782 4.782 5.043 -0.261 25913
3177 1 15 . 1 1 10 10 ARG C C 10 175.125 175.125 174.846 0.279 25913
3178 1 15 . 1 1 10 10 ARG CA C 10 55.356 55.356 55.459 -0.103 25913
3179 1 15 . 1 1 10 10 ARG CB C 10 32.982 32.982 29.386 3.596 25913
3180 1 15 . 1 1 10 10 ARG H H 10 8.229 8.229 7.985 0.244 25913
3181 1 15 . 1 1 11 11 TYR N N 11 121.353 121.353 123.646 -2.293 25913
3182 1 15 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.633 -0.305 25913
3183 1 15 . 1 1 11 11 TYR C C 11 174.229 174.229 174.836 -0.607 25913
3184 1 15 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.198 0.851 25913
3185 1 15 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.268 -0.217 25913
3186 1 15 . 1 1 11 11 TYR H H 11 8.692 8.692 9.360 -0.668 25913
3187 1 15 . 1 1 12 12 PHE N N 12 122.456 122.456 121.790 0.666 25913
3188 1 15 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.387 -0.503 25913
3189 1 15 . 1 1 12 12 PHE C C 12 174.224 174.224 174.722 -0.498 25913
3190 1 15 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.373 0.645 25913
3191 1 15 . 1 1 12 12 PHE CB C 12 44.078 44.078 42.155 1.923 25913
3192 1 15 . 1 1 12 12 PHE H H 12 9.415 9.415 8.862 0.553 25913
3193 1 15 . 1 1 13 13 CYS N N 13 128.438 128.438 128.457 -0.019 25913
3194 1 15 . 1 1 13 13 CYS HA H 13 4.653 4.653 5.021 -0.368 25913
3195 1 15 . 1 1 13 13 CYS C C 13 176.686 176.686 175.399 1.287 25913
3196 1 15 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.402 0.926 25913
3197 1 15 . 1 1 13 13 CYS CB C 13 31.220 31.220 28.089 3.131 25913
3198 1 15 . 1 1 13 13 CYS H H 13 7.942 7.942 8.831 -0.889 25913
3199 1 15 . 1 1 14 14 HIS N N 14 126.467 126.467 126.283 0.184 25913
3200 1 15 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.505 -0.182 25913
3201 1 15 . 1 1 14 14 HIS C C 14 175.452 175.452 176.544 -1.092 25913
3202 1 15 . 1 1 14 14 HIS CA C 14 58.736 58.736 58.354 0.382 25913
3203 1 15 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.376 -1.185 25913
3204 1 15 . 1 1 14 14 HIS H H 14 8.971 8.971 9.627 -0.656 25913
3205 1 15 . 1 1 15 15 CYS N N 15 123.882 123.882 118.412 5.470 25913
3206 1 15 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.341 0.101 25913
3207 1 15 . 1 1 15 15 CYS C C 15 176.939 176.939 176.036 0.903 25913
3208 1 15 . 1 1 15 15 CYS CA C 15 61.704 61.704 61.252 0.452 25913
3209 1 15 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.874 -0.533 25913
3210 1 15 . 1 1 15 15 CYS H H 15 9.195 9.195 8.135 1.060 25913
3211 1 15 . 1 1 16 16 CYS N N 16 124.898 124.898 119.055 5.843 25913
3212 1 15 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.528 -0.530 25913
3213 1 15 . 1 1 16 16 CYS C C 16 175.557 175.557 174.336 1.221 25913
3214 1 15 . 1 1 16 16 CYS CB C 16 30.961 30.961 28.264 2.697 25913
3215 1 15 . 1 1 16 16 CYS H H 16 9.794 9.794 7.803 1.991 25913
3216 1 15 . 1 1 17 17 SER N N 17 114.055 114.055 114.507 -0.452 25913
3217 1 15 . 1 1 17 17 SER HA H 17 3.755 3.755 4.122 -0.367 25913
3218 1 15 . 1 1 17 17 SER C C 17 173.790 173.790 173.087 0.703 25913
3219 1 15 . 1 1 17 17 SER CA C 17 58.868 58.868 59.271 -0.403 25913
3220 1 15 . 1 1 17 17 SER CB C 17 61.703 61.703 60.985 0.718 25913
3221 1 15 . 1 1 17 17 SER H H 17 7.950 7.950 8.196 -0.246 25913
3222 1 15 . 1 1 18 18 VAL N N 18 111.916 111.916 113.026 -1.110 25913
3223 1 15 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.241 0.217 25913
3224 1 15 . 1 1 18 18 VAL C C 18 173.765 173.765 173.668 0.097 25913
3225 1 15 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.325 -0.293 25913
3226 1 15 . 1 1 18 18 VAL CB C 18 36.667 36.667 35.179 1.488 25913
3227 1 15 . 1 1 18 18 VAL H H 18 6.438 6.438 6.661 -0.223 25913
3228 1 15 . 1 1 19 19 GLU N N 19 123.431 123.431 121.853 1.578 25913
3229 1 15 . 1 1 19 19 GLU HA H 19 5.023 5.023 5.113 -0.090 25913
3230 1 15 . 1 1 19 19 GLU C C 19 176.506 176.506 176.385 0.121 25913
3231 1 15 . 1 1 19 19 GLU CA C 19 56.818 56.818 56.007 0.811 25913
3232 1 15 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.317 -0.152 25913
3233 1 15 . 1 1 19 19 GLU H H 19 8.346 8.346 8.398 -0.052 25913
3234 1 15 . 1 1 20 20 ILE N N 20 117.751 117.751 120.655 -2.904 25913
3235 1 15 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.744 -0.003 25913
3236 1 15 . 1 1 20 20 ILE C C 20 175.511 175.511 173.909 1.602 25913
3237 1 15 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.312 -0.367 25913
3238 1 15 . 1 1 20 20 ILE CB C 20 44.667 44.667 42.013 2.654 25913
3239 1 15 . 1 1 20 20 ILE H H 20 8.537 8.537 9.111 -0.574 25913
3240 1 15 . 1 1 21 21 VAL N N 21 124.220 124.220 122.518 1.702 25913
3241 1 15 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.165 -0.579 25913
3242 1 15 . 1 1 21 21 VAL C C 21 174.640 174.640 174.071 0.569 25913
3243 1 15 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.656 2.062 25913
3244 1 15 . 1 1 21 21 VAL CB C 21 32.503 32.503 33.123 -0.621 25913
3245 1 15 . 1 1 21 21 VAL H H 21 8.203 8.203 8.435 -0.232 25913
3246 1 15 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.706 -0.647 25913
3247 1 15 . 1 1 22 22 PRO C C 22 175.352 175.352 176.138 -0.786 25913
3248 1 15 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.532 0.129 25913
3249 1 15 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.394 -0.380 25913
3250 1 15 . 1 1 23 23 ARG N N 23 121.370 121.370 122.124 -0.754 25913
3251 1 15 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.243 0.012 25913
3252 1 15 . 1 1 23 23 ARG C C 23 175.759 175.759 176.653 -0.894 25913
3253 1 15 . 1 1 23 23 ARG CA C 23 56.052 56.052 56.003 0.049 25913
3254 1 15 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.125 1.761 25913
3255 1 15 . 1 1 23 23 ARG H H 23 8.635 8.635 8.089 0.546 25913
3256 1 15 . 1 1 24 24 LEU N N 24 127.914 127.914 126.928 0.986 25913
3257 1 15 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.718 0.455 25913
3258 1 15 . 1 1 24 24 LEU C C 24 175.774 175.774 175.988 -0.214 25913
3259 1 15 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.636 -5.698 25913
3260 1 15 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.107 2.313 25913
3261 1 15 . 1 1 24 24 LEU H H 24 8.521 8.521 8.711 -0.190 25913
3262 1 15 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.139 0.201 25913
3263 1 15 . 1 1 25 25 PRO C C 25 176.386 176.386 177.195 -0.809 25913
3264 1 15 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.608 -0.941 25913
3265 1 15 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.718 2.958 25913
3266 1 15 . 1 1 26 26 ASP N N 26 122.078 122.078 114.242 7.836 25913
3267 1 15 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.675 -0.288 25913
3268 1 15 . 1 1 26 26 ASP C C 26 175.321 175.321 175.860 -0.539 25913
3269 1 15 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.328 2.026 25913
3270 1 15 . 1 1 26 26 ASP CB C 26 41.066 41.066 42.700 -1.634 25913
3271 1 15 . 1 1 26 26 ASP H H 26 8.752 8.752 7.651 1.101 25913
3272 1 15 . 1 1 27 27 TYR N N 27 117.607 117.607 117.953 -0.346 25913
3273 1 15 . 1 1 27 27 TYR HA H 27 3.449 3.449 3.979 -0.530 25913
3274 1 15 . 1 1 27 27 TYR C C 27 173.074 173.074 174.361 -1.287 25913
3275 1 15 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.356 1.081 25913
3276 1 15 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.517 -0.457 25913
3277 1 15 . 1 1 27 27 TYR H H 27 8.666 8.666 8.121 0.545 25913
3278 1 15 . 1 1 28 28 ILE N N 28 111.804 111.804 112.593 -0.789 25913
3279 1 15 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.554 0.221 25913
3280 1 15 . 1 1 28 28 ILE C C 28 175.083 175.083 174.753 0.330 25913
3281 1 15 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.545 -0.976 25913
3282 1 15 . 1 1 28 28 ILE CB C 28 42.107 42.107 41.115 0.992 25913
3283 1 15 . 1 1 28 28 ILE H H 28 6.761 6.761 7.277 -0.516 25913
3284 1 15 . 1 1 29 29 CYS N N 29 126.875 126.875 119.006 7.869 25913
3285 1 15 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.762 -0.354 25913
3286 1 15 . 1 1 29 29 CYS C C 29 175.932 175.932 175.094 0.838 25913
3287 1 15 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.854 0.548 25913
3288 1 15 . 1 1 29 29 CYS CB C 29 32.214 32.214 27.964 4.250 25913
3289 1 15 . 1 1 29 29 CYS H H 29 8.783 8.783 8.779 0.004 25913
3290 1 15 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.448 -0.066 25913
3291 1 15 . 1 1 30 30 PRO C C 30 176.824 176.824 177.645 -0.821 25913
3292 1 15 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.493 -0.453 25913
3293 1 15 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.900 0.444 25913
3294 1 15 . 1 1 31 31 ARG N N 31 124.131 124.131 117.783 6.348 25913
3295 1 15 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.430 -0.129 25913
3296 1 15 . 1 1 31 31 ARG C C 31 177.721 177.721 177.110 0.611 25913
3297 1 15 . 1 1 31 31 ARG CA C 31 58.190 58.190 57.892 0.298 25913
3298 1 15 . 1 1 31 31 ARG CB C 31 31.682 31.682 30.957 0.725 25913
3299 1 15 . 1 1 31 31 ARG H H 31 9.604 9.604 7.728 1.876 25913
3300 1 15 . 1 1 32 32 CYS N N 32 119.758 119.758 113.838 5.920 25913
3301 1 15 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.838 0.001 25913
3302 1 15 . 1 1 32 32 CYS C C 32 176.450 176.450 174.210 2.240 25913
3303 1 15 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.544 1.166 25913
3304 1 15 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.454 3.776 25913
3305 1 15 . 1 1 32 32 CYS H H 32 8.549 8.549 7.738 0.811 25913
3306 1 15 . 1 1 33 33 GLU N N 33 118.109 118.109 120.106 -1.997 25913
3307 1 15 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.092 -0.014 25913
3308 1 15 . 1 1 33 33 GLU C C 33 174.739 174.739 176.010 -1.271 25913
3309 1 15 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.475 1.043 25913
3310 1 15 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.109 -0.417 25913
3311 1 15 . 1 1 33 33 GLU H H 33 7.868 7.868 8.254 -0.386 25913
3312 1 15 . 1 1 34 34 SER N N 34 117.224 117.224 115.057 2.167 25913
3313 1 15 . 1 1 34 34 SER HA H 34 4.437 4.437 4.447 -0.010 25913
3314 1 15 . 1 1 34 34 SER C C 34 175.392 175.392 175.698 -0.306 25913
3315 1 15 . 1 1 34 34 SER CA C 34 59.277 59.277 60.001 -0.724 25913
3316 1 15 . 1 1 34 34 SER CB C 34 65.429 65.429 64.249 1.180 25913
3317 1 15 . 1 1 34 34 SER H H 34 8.786 8.786 8.117 0.669 25913
3318 1 15 . 1 1 35 35 GLY N N 35 111.095 111.095 107.868 3.227 25913
3319 1 15 . 1 1 35 35 GLY C C 35 175.730 175.730 174.852 0.878 25913
3320 1 15 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.774 0.467 25913
3321 1 15 . 1 1 35 35 GLY H H 35 8.511 8.511 8.452 0.059 25913
3322 1 15 . 1 1 36 36 PHE N N 36 126.409 126.409 125.154 1.255 25913
3323 1 15 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.441 0.710 25913
3324 1 15 . 1 1 36 36 PHE C C 36 174.098 174.098 174.146 -0.048 25913
3325 1 15 . 1 1 36 36 PHE CA C 36 55.269 55.269 58.679 -3.410 25913
3326 1 15 . 1 1 36 36 PHE CB C 36 36.027 36.027 36.977 -0.950 25913
3327 1 15 . 1 1 36 36 PHE H H 36 8.850 8.850 7.884 0.966 25913
3328 1 15 . 1 1 37 37 ILE N N 37 117.377 117.377 115.143 2.234 25913
3329 1 15 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.402 -0.046 25913
3330 1 15 . 1 1 37 37 ILE C C 37 175.508 175.508 174.973 0.535 25913
3331 1 15 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.333 0.354 25913
3332 1 15 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.636 -1.488 25913
3333 1 15 . 1 1 37 37 ILE H H 37 7.972 7.972 7.864 0.108 25913
3334 1 15 . 1 1 38 38 GLU N N 38 124.869 124.869 122.351 2.518 25913
3335 1 15 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.583 0.302 25913
3336 1 15 . 1 1 38 38 GLU C C 38 174.300 174.300 175.371 -1.071 25913
3337 1 15 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.101 0.555 25913
3338 1 15 . 1 1 38 38 GLU CB C 38 34.589 34.589 31.801 2.788 25913
3339 1 15 . 1 1 38 38 GLU H H 38 9.131 9.131 8.793 0.338 25913
3340 1 15 . 1 1 39 39 GLU N N 39 127.840 127.840 126.844 0.996 25913
3341 1 15 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.098 0.750 25913
3342 1 15 . 1 1 39 39 GLU C C 39 175.507 175.507 175.612 -0.105 25913
3343 1 15 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.507 0.998 25913
3344 1 15 . 1 1 39 39 GLU CB C 39 30.249 30.249 28.604 1.645 25913
3345 1 15 . 1 1 39 39 GLU H H 39 8.844 8.844 8.673 0.171 25913
3346 1 16 . 1 1 0 0 SER HA H 0 4.525 4.525 4.341 0.184 25913
3347 1 16 . 1 1 0 0 SER C C 0 174.776 174.776 175.276 -0.500 25913
3348 1 16 . 1 1 0 0 SER CA C 0 58.364 58.364 60.747 -2.383 25913
3349 1 16 . 1 1 0 0 SER CB C 0 64.049 64.049 63.472 0.577 25913
3350 1 16 . 1 1 1 1 MET N N 1 123.174 123.174 120.482 2.692 25913
3351 1 16 . 1 1 1 1 MET HA H 1 4.486 4.486 4.587 -0.101 25913
3352 1 16 . 1 1 1 1 MET C C 1 176.177 176.177 175.356 0.821 25913
3353 1 16 . 1 1 1 1 MET CA C 1 55.804 55.804 54.615 1.189 25913
3354 1 16 . 1 1 1 1 MET CB C 1 32.941 32.941 32.113 0.828 25913
3355 1 16 . 1 1 1 1 MET H H 1 8.592 8.592 7.802 0.790 25913
3356 1 16 . 1 1 2 2 ALA N N 2 125.785 125.785 125.864 -0.079 25913
3357 1 16 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.516 -0.223 25913
3358 1 16 . 1 1 2 2 ALA C C 2 177.812 177.812 177.121 0.691 25913
3359 1 16 . 1 1 2 2 ALA CA C 2 52.809 52.809 52.475 0.334 25913
3360 1 16 . 1 1 2 2 ALA CB C 2 19.224 19.224 19.439 -0.215 25913
3361 1 16 . 1 1 2 2 ALA H H 2 8.337 8.337 8.623 -0.286 25913
3362 1 16 . 1 1 3 3 GLU N N 3 120.731 120.731 119.696 1.035 25913
3363 1 16 . 1 1 3 3 GLU HA H 3 4.256 4.256 3.967 0.289 25913
3364 1 16 . 1 1 3 3 GLU C C 3 176.186 176.186 175.755 0.431 25913
3365 1 16 . 1 1 3 3 GLU CA C 3 56.377 56.377 57.953 -1.576 25913
3366 1 16 . 1 1 3 3 GLU CB C 3 30.549 30.549 28.781 1.768 25913
3367 1 16 . 1 1 3 3 GLU H H 3 8.274 8.274 8.979 -0.705 25913
3368 1 16 . 1 1 4 4 ALA N N 4 125.716 125.716 121.809 3.907 25913
3369 1 16 . 1 1 4 4 ALA HA H 4 4.345 4.345 4.503 -0.158 25913
3370 1 16 . 1 1 4 4 ALA C C 4 177.530 177.530 176.123 1.407 25913
3371 1 16 . 1 1 4 4 ALA CA C 4 52.413 52.413 52.060 0.353 25913
3372 1 16 . 1 1 4 4 ALA CB C 4 19.466 19.466 19.767 -0.301 25913
3373 1 16 . 1 1 4 4 ALA H H 4 8.271 8.271 7.932 0.339 25913
3374 1 16 . 1 1 5 5 SER N N 5 117.161 117.161 112.652 4.509 25913
3375 1 16 . 1 1 5 5 SER HA H 5 4.724 4.724 4.272 0.452 25913
3376 1 16 . 1 1 5 5 SER C C 5 172.661 172.661 172.321 0.340 25913
3377 1 16 . 1 1 5 5 SER CA C 5 56.354 56.354 57.818 -1.464 25913
3378 1 16 . 1 1 5 5 SER CB C 5 63.442 63.442 62.094 1.348 25913
3379 1 16 . 1 1 5 5 SER H H 5 8.259 8.259 8.517 -0.258 25913
3380 1 16 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.483 -0.069 25913
3381 1 16 . 1 1 6 6 PRO C C 6 176.523 176.523 175.799 0.724 25913
3382 1 16 . 1 1 6 6 PRO CA C 6 63.385 63.385 62.548 0.837 25913
3383 1 16 . 1 1 6 6 PRO CB C 6 32.187 32.187 32.166 0.021 25913
3384 1 16 . 1 1 7 7 HIS N N 7 120.170 120.170 116.838 3.332 25913
3385 1 16 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.521 0.459 25913
3386 1 16 . 1 1 7 7 HIS C C 7 172.577 172.577 173.733 -1.156 25913
3387 1 16 . 1 1 7 7 HIS CA C 7 53.492 53.492 54.486 -0.994 25913
3388 1 16 . 1 1 7 7 HIS CB C 7 29.133 29.133 28.596 0.537 25913
3389 1 16 . 1 1 7 7 HIS H H 7 8.489 8.489 8.371 0.118 25913
3390 1 16 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.563 -0.017 25913
3391 1 16 . 1 1 8 8 PRO C C 8 177.382 177.382 176.633 0.749 25913
3392 1 16 . 1 1 8 8 PRO CA C 8 63.443 63.443 63.381 0.062 25913
3393 1 16 . 1 1 8 8 PRO CB C 8 32.377 32.377 32.566 -0.189 25913
3394 1 16 . 1 1 9 9 GLY N N 9 110.263 110.263 110.592 -0.329 25913
3395 1 16 . 1 1 9 9 GLY C C 9 172.859 172.859 173.345 -0.486 25913
3396 1 16 . 1 1 9 9 GLY CA C 9 45.211 45.211 46.181 -0.971 25913
3397 1 16 . 1 1 9 9 GLY H H 9 8.635 8.635 9.016 -0.381 25913
3398 1 16 . 1 1 10 10 ARG N N 10 121.025 121.025 123.524 -2.499 25913
3399 1 16 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.650 0.132 25913
3400 1 16 . 1 1 10 10 ARG C C 10 175.125 175.125 174.957 0.168 25913
3401 1 16 . 1 1 10 10 ARG CA C 10 55.356 55.356 56.411 -1.055 25913
3402 1 16 . 1 1 10 10 ARG CB C 10 32.982 32.982 29.034 3.948 25913
3403 1 16 . 1 1 10 10 ARG H H 10 8.229 8.229 8.042 0.187 25913
3404 1 16 . 1 1 11 11 TYR N N 11 121.353 121.353 123.723 -2.370 25913
3405 1 16 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.598 -0.270 25913
3406 1 16 . 1 1 11 11 TYR C C 11 174.229 174.229 174.736 -0.507 25913
3407 1 16 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.225 0.824 25913
3408 1 16 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.589 -0.538 25913
3409 1 16 . 1 1 11 11 TYR H H 11 8.692 8.692 9.405 -0.713 25913
3410 1 16 . 1 1 12 12 PHE N N 12 122.456 122.456 121.850 0.606 25913
3411 1 16 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.285 -0.401 25913
3412 1 16 . 1 1 12 12 PHE C C 12 174.224 174.224 174.674 -0.450 25913
3413 1 16 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.481 0.538 25913
3414 1 16 . 1 1 12 12 PHE CB C 12 44.078 44.078 42.020 2.058 25913
3415 1 16 . 1 1 12 12 PHE H H 12 9.415 9.415 9.077 0.338 25913
3416 1 16 . 1 1 13 13 CYS N N 13 128.438 128.438 128.294 0.144 25913
3417 1 16 . 1 1 13 13 CYS HA H 13 4.653 4.653 5.052 -0.399 25913
3418 1 16 . 1 1 13 13 CYS C C 13 176.686 176.686 175.266 1.420 25913
3419 1 16 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.642 0.686 25913
3420 1 16 . 1 1 13 13 CYS CB C 13 31.220 31.220 28.511 2.709 25913
3421 1 16 . 1 1 13 13 CYS H H 13 7.942 7.942 8.949 -1.007 25913
3422 1 16 . 1 1 14 14 HIS N N 14 126.467 126.467 125.759 0.708 25913
3423 1 16 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.621 -0.298 25913
3424 1 16 . 1 1 14 14 HIS C C 14 175.452 175.452 176.345 -0.893 25913
3425 1 16 . 1 1 14 14 HIS CA C 14 58.736 58.736 58.572 0.164 25913
3426 1 16 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.882 -1.691 25913
3427 1 16 . 1 1 14 14 HIS H H 14 8.971 8.971 9.527 -0.556 25913
3428 1 16 . 1 1 15 15 CYS N N 15 123.882 123.882 118.594 5.288 25913
3429 1 16 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.298 0.144 25913
3430 1 16 . 1 1 15 15 CYS C C 15 176.939 176.939 176.052 0.887 25913
3431 1 16 . 1 1 15 15 CYS CA C 15 61.704 61.704 61.248 0.456 25913
3432 1 16 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.578 -0.236 25913
3433 1 16 . 1 1 15 15 CYS H H 15 9.195 9.195 8.297 0.898 25913
3434 1 16 . 1 1 16 16 CYS N N 16 124.898 124.898 121.062 3.836 25913
3435 1 16 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.550 -0.552 25913
3436 1 16 . 1 1 16 16 CYS C C 16 175.557 175.557 174.535 1.022 25913
3437 1 16 . 1 1 16 16 CYS CB C 16 30.961 30.961 27.323 3.638 25913
3438 1 16 . 1 1 16 16 CYS H H 16 9.794 9.794 7.923 1.871 25913
3439 1 16 . 1 1 17 17 SER N N 17 114.055 114.055 113.372 0.683 25913
3440 1 16 . 1 1 17 17 SER HA H 17 3.755 3.755 4.128 -0.373 25913
3441 1 16 . 1 1 17 17 SER C C 17 173.790 173.790 173.299 0.491 25913
3442 1 16 . 1 1 17 17 SER CA C 17 58.868 58.868 59.322 -0.454 25913
3443 1 16 . 1 1 17 17 SER CB C 17 61.703 61.703 60.608 1.095 25913
3444 1 16 . 1 1 17 17 SER H H 17 7.950 7.950 7.893 0.057 25913
3445 1 16 . 1 1 18 18 VAL N N 18 111.916 111.916 112.652 -0.736 25913
3446 1 16 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.218 0.240 25913
3447 1 16 . 1 1 18 18 VAL C C 18 173.765 173.765 173.472 0.293 25913
3448 1 16 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.305 -0.273 25913
3449 1 16 . 1 1 18 18 VAL CB C 18 36.667 36.667 35.438 1.229 25913
3450 1 16 . 1 1 18 18 VAL H H 18 6.438 6.438 7.068 -0.630 25913
3451 1 16 . 1 1 19 19 GLU N N 19 123.431 123.431 121.579 1.852 25913
3452 1 16 . 1 1 19 19 GLU HA H 19 5.023 5.023 5.064 -0.041 25913
3453 1 16 . 1 1 19 19 GLU C C 19 176.506 176.506 176.186 0.320 25913
3454 1 16 . 1 1 19 19 GLU CA C 19 56.818 56.818 56.217 0.601 25913
3455 1 16 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.546 -0.381 25913
3456 1 16 . 1 1 19 19 GLU H H 19 8.346 8.346 8.347 -0.001 25913
3457 1 16 . 1 1 20 20 ILE N N 20 117.751 117.751 121.131 -3.380 25913
3458 1 16 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.751 -0.010 25913
3459 1 16 . 1 1 20 20 ILE C C 20 175.511 175.511 173.760 1.751 25913
3460 1 16 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.499 -0.554 25913
3461 1 16 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.656 3.011 25913
3462 1 16 . 1 1 20 20 ILE H H 20 8.537 8.537 8.800 -0.263 25913
3463 1 16 . 1 1 21 21 VAL N N 21 124.220 124.220 121.942 2.278 25913
3464 1 16 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.239 -0.653 25913
3465 1 16 . 1 1 21 21 VAL C C 21 174.640 174.640 174.010 0.630 25913
3466 1 16 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.848 1.870 25913
3467 1 16 . 1 1 21 21 VAL CB C 21 32.503 32.503 33.520 -1.017 25913
3468 1 16 . 1 1 21 21 VAL H H 21 8.203 8.203 8.387 -0.184 25913
3469 1 16 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.744 -0.685 25913
3470 1 16 . 1 1 22 22 PRO C C 22 175.352 175.352 176.130 -0.778 25913
3471 1 16 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.580 0.081 25913
3472 1 16 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.348 -0.334 25913
3473 1 16 . 1 1 23 23 ARG N N 23 121.370 121.370 123.200 -1.830 25913
3474 1 16 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.255 -0.000 25913
3475 1 16 . 1 1 23 23 ARG C C 23 175.759 175.759 176.663 -0.904 25913
3476 1 16 . 1 1 23 23 ARG CA C 23 56.052 56.052 56.051 0.001 25913
3477 1 16 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.319 1.567 25913
3478 1 16 . 1 1 23 23 ARG H H 23 8.635 8.635 8.178 0.457 25913
3479 1 16 . 1 1 24 24 LEU N N 24 127.914 127.914 127.185 0.729 25913
3480 1 16 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.861 0.312 25913
3481 1 16 . 1 1 24 24 LEU C C 24 175.774 175.774 176.167 -0.393 25913
3482 1 16 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.508 -5.569 25913
3483 1 16 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.129 2.291 25913
3484 1 16 . 1 1 24 24 LEU H H 24 8.521 8.521 8.737 -0.216 25913
3485 1 16 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.197 0.143 25913
3486 1 16 . 1 1 25 25 PRO C C 25 176.386 176.386 177.290 -0.904 25913
3487 1 16 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.647 -0.980 25913
3488 1 16 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.747 2.929 25913
3489 1 16 . 1 1 26 26 ASP N N 26 122.078 122.078 115.299 6.779 25913
3490 1 16 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.659 -0.272 25913
3491 1 16 . 1 1 26 26 ASP C C 26 175.321 175.321 176.031 -0.710 25913
3492 1 16 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.320 2.035 25913
3493 1 16 . 1 1 26 26 ASP CB C 26 41.066 41.066 42.896 -1.830 25913
3494 1 16 . 1 1 26 26 ASP H H 26 8.752 8.752 7.732 1.020 25913
3495 1 16 . 1 1 27 27 TYR N N 27 117.607 117.607 118.366 -0.759 25913
3496 1 16 . 1 1 27 27 TYR HA H 27 3.449 3.449 4.056 -0.607 25913
3497 1 16 . 1 1 27 27 TYR C C 27 173.074 173.074 174.106 -1.032 25913
3498 1 16 . 1 1 27 27 TYR CA C 27 60.437 60.437 58.934 1.503 25913
3499 1 16 . 1 1 27 27 TYR CB C 27 35.060 35.060 36.128 -1.068 25913
3500 1 16 . 1 1 27 27 TYR H H 27 8.666 8.666 8.059 0.607 25913
3501 1 16 . 1 1 28 28 ILE N N 28 111.804 111.804 112.922 -1.118 25913
3502 1 16 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.479 0.296 25913
3503 1 16 . 1 1 28 28 ILE C C 28 175.083 175.083 174.544 0.539 25913
3504 1 16 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.124 -0.555 25913
3505 1 16 . 1 1 28 28 ILE CB C 28 42.107 42.107 41.197 0.910 25913
3506 1 16 . 1 1 28 28 ILE H H 28 6.761 6.761 7.431 -0.670 25913
3507 1 16 . 1 1 29 29 CYS N N 29 126.875 126.875 118.767 8.108 25913
3508 1 16 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.772 -0.364 25913
3509 1 16 . 1 1 29 29 CYS C C 29 175.932 175.932 175.069 0.863 25913
3510 1 16 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.872 0.530 25913
3511 1 16 . 1 1 29 29 CYS CB C 29 32.214 32.214 27.983 4.231 25913
3512 1 16 . 1 1 29 29 CYS H H 29 8.783 8.783 8.701 0.082 25913
3513 1 16 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.509 -0.127 25913
3514 1 16 . 1 1 30 30 PRO C C 30 176.824 176.824 176.761 0.063 25913
3515 1 16 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.214 -0.174 25913
3516 1 16 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.803 0.541 25913
3517 1 16 . 1 1 31 31 ARG N N 31 124.131 124.131 116.371 7.760 25913
3518 1 16 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.467 -0.166 25913
3519 1 16 . 1 1 31 31 ARG C C 31 177.721 177.721 177.141 0.580 25913
3520 1 16 . 1 1 31 31 ARG CA C 31 58.190 58.190 57.517 0.673 25913
3521 1 16 . 1 1 31 31 ARG CB C 31 31.682 31.682 31.213 0.469 25913
3522 1 16 . 1 1 31 31 ARG H H 31 9.604 9.604 7.663 1.941 25913
3523 1 16 . 1 1 32 32 CYS N N 32 119.758 119.758 114.051 5.707 25913
3524 1 16 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.856 -0.017 25913
3525 1 16 . 1 1 32 32 CYS C C 32 176.450 176.450 174.463 1.987 25913
3526 1 16 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.585 1.125 25913
3527 1 16 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.447 3.783 25913
3528 1 16 . 1 1 32 32 CYS H H 32 8.549 8.549 7.758 0.791 25913
3529 1 16 . 1 1 33 33 GLU N N 33 118.109 118.109 120.068 -1.959 25913
3530 1 16 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.044 0.034 25913
3531 1 16 . 1 1 33 33 GLU C C 33 174.739 174.739 176.063 -1.324 25913
3532 1 16 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.504 1.014 25913
3533 1 16 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.334 -0.642 25913
3534 1 16 . 1 1 33 33 GLU H H 33 7.868 7.868 8.215 -0.347 25913
3535 1 16 . 1 1 34 34 SER N N 34 117.224 117.224 115.064 2.160 25913
3536 1 16 . 1 1 34 34 SER HA H 34 4.437 4.437 4.493 -0.056 25913
3537 1 16 . 1 1 34 34 SER C C 34 175.392 175.392 175.650 -0.258 25913
3538 1 16 . 1 1 34 34 SER CA C 34 59.277 59.277 60.115 -0.838 25913
3539 1 16 . 1 1 34 34 SER CB C 34 65.429 65.429 64.381 1.048 25913
3540 1 16 . 1 1 34 34 SER H H 34 8.786 8.786 7.987 0.799 25913
3541 1 16 . 1 1 35 35 GLY N N 35 111.095 111.095 107.697 3.398 25913
3542 1 16 . 1 1 35 35 GLY C C 35 175.730 175.730 174.559 1.171 25913
3543 1 16 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.607 0.634 25913
3544 1 16 . 1 1 35 35 GLY H H 35 8.511 8.511 8.428 0.083 25913
3545 1 16 . 1 1 36 36 PHE N N 36 126.409 126.409 125.112 1.297 25913
3546 1 16 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.454 0.697 25913
3547 1 16 . 1 1 36 36 PHE C C 36 174.098 174.098 174.690 -0.592 25913
3548 1 16 . 1 1 36 36 PHE CA C 36 55.269 55.269 58.892 -3.623 25913
3549 1 16 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.504 -1.477 25913
3550 1 16 . 1 1 36 36 PHE H H 36 8.850 8.850 7.748 1.102 25913
3551 1 16 . 1 1 37 37 ILE N N 37 117.377 117.377 115.750 1.627 25913
3552 1 16 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.444 -0.088 25913
3553 1 16 . 1 1 37 37 ILE C C 37 175.508 175.508 174.894 0.614 25913
3554 1 16 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.639 0.048 25913
3555 1 16 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.531 -1.383 25913
3556 1 16 . 1 1 37 37 ILE H H 37 7.972 7.972 7.855 0.117 25913
3557 1 16 . 1 1 38 38 GLU N N 38 124.869 124.869 123.010 1.859 25913
3558 1 16 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.610 0.275 25913
3559 1 16 . 1 1 38 38 GLU C C 38 174.300 174.300 175.328 -1.028 25913
3560 1 16 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.902 -0.246 25913
3561 1 16 . 1 1 38 38 GLU CB C 38 34.589 34.589 32.319 2.271 25913
3562 1 16 . 1 1 38 38 GLU H H 38 9.131 9.131 8.950 0.181 25913
3563 1 16 . 1 1 39 39 GLU N N 39 127.840 127.840 126.738 1.102 25913
3564 1 16 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.182 0.666 25913
3565 1 16 . 1 1 39 39 GLU C C 39 175.507 175.507 175.555 -0.048 25913
3566 1 16 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.728 0.777 25913
3567 1 16 . 1 1 39 39 GLU CB C 39 30.249 30.249 29.109 1.140 25913
3568 1 16 . 1 1 39 39 GLU H H 39 8.844 8.844 8.621 0.223 25913
3569 1 17 . 1 1 0 0 SER HA H 0 4.525 4.525 4.696 -0.171 25913
3570 1 17 . 1 1 0 0 SER C C 0 174.776 174.776 173.727 1.049 25913
3571 1 17 . 1 1 0 0 SER CA C 0 58.364 58.364 58.546 -0.182 25913
3572 1 17 . 1 1 0 0 SER CB C 0 64.049 64.049 63.612 0.437 25913
3573 1 17 . 1 1 1 1 MET N N 1 123.174 123.174 123.098 0.076 25913
3574 1 17 . 1 1 1 1 MET HA H 1 4.486 4.486 4.717 -0.231 25913
3575 1 17 . 1 1 1 1 MET C C 1 176.177 176.177 175.369 0.808 25913
3576 1 17 . 1 1 1 1 MET CA C 1 55.804 55.804 55.461 0.343 25913
3577 1 17 . 1 1 1 1 MET CB C 1 32.941 32.941 34.715 -1.774 25913
3578 1 17 . 1 1 1 1 MET H H 1 8.592 8.592 8.479 0.113 25913
3579 1 17 . 1 1 2 2 ALA N N 2 125.785 125.785 126.067 -0.282 25913
3580 1 17 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.553 -0.260 25913
3581 1 17 . 1 1 2 2 ALA C C 2 177.812 177.812 177.523 0.289 25913
3582 1 17 . 1 1 2 2 ALA CA C 2 52.809 52.809 52.173 0.636 25913
3583 1 17 . 1 1 2 2 ALA CB C 2 19.224 19.224 19.002 0.222 25913
3584 1 17 . 1 1 2 2 ALA H H 2 8.337 8.337 8.425 -0.088 25913
3585 1 17 . 1 1 3 3 GLU N N 3 120.731 120.731 120.084 0.647 25913
3586 1 17 . 1 1 3 3 GLU HA H 3 4.256 4.256 4.678 -0.422 25913
3587 1 17 . 1 1 3 3 GLU C C 3 176.186 176.186 177.435 -1.249 25913
3588 1 17 . 1 1 3 3 GLU CA C 3 56.377 56.377 58.841 -2.464 25913
3589 1 17 . 1 1 3 3 GLU CB C 3 30.549 30.549 30.249 0.300 25913
3590 1 17 . 1 1 3 3 GLU H H 3 8.274 8.274 8.502 -0.228 25913
3591 1 17 . 1 1 4 4 ALA N N 4 125.716 125.716 120.048 5.668 25913
3592 1 17 . 1 1 4 4 ALA HA H 4 4.345 4.345 4.640 -0.295 25913
3593 1 17 . 1 1 4 4 ALA C C 4 177.530 177.530 176.738 0.792 25913
3594 1 17 . 1 1 4 4 ALA CA C 4 52.413 52.413 52.629 -0.216 25913
3595 1 17 . 1 1 4 4 ALA CB C 4 19.466 19.466 20.019 -0.553 25913
3596 1 17 . 1 1 4 4 ALA H H 4 8.271 8.271 8.204 0.067 25913
3597 1 17 . 1 1 5 5 SER N N 5 117.161 117.161 115.416 1.745 25913
3598 1 17 . 1 1 5 5 SER HA H 5 4.724 4.724 4.820 -0.096 25913
3599 1 17 . 1 1 5 5 SER C C 5 172.661 172.661 171.640 1.021 25913
3600 1 17 . 1 1 5 5 SER CA C 5 56.354 56.354 57.535 -1.181 25913
3601 1 17 . 1 1 5 5 SER CB C 5 63.442 63.442 63.231 0.211 25913
3602 1 17 . 1 1 5 5 SER H H 5 8.259 8.259 8.139 0.120 25913
3603 1 17 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.680 -0.266 25913
3604 1 17 . 1 1 6 6 PRO C C 6 176.523 176.523 175.367 1.156 25913
3605 1 17 . 1 1 6 6 PRO CA C 6 63.385 63.385 63.573 -0.188 25913
3606 1 17 . 1 1 6 6 PRO CB C 6 32.187 32.187 31.944 0.243 25913
3607 1 17 . 1 1 7 7 HIS N N 7 120.170 120.170 119.759 0.411 25913
3608 1 17 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.917 0.063 25913
3609 1 17 . 1 1 7 7 HIS C C 7 172.577 172.577 173.399 -0.822 25913
3610 1 17 . 1 1 7 7 HIS CA C 7 53.492 53.492 53.111 0.381 25913
3611 1 17 . 1 1 7 7 HIS CB C 7 29.133 29.133 30.723 -1.589 25913
3612 1 17 . 1 1 7 7 HIS H H 7 8.489 8.489 7.916 0.573 25913
3613 1 17 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.577 -0.031 25913
3614 1 17 . 1 1 8 8 PRO C C 8 177.382 177.382 176.738 0.644 25913
3615 1 17 . 1 1 8 8 PRO CA C 8 63.443 63.443 62.921 0.522 25913
3616 1 17 . 1 1 8 8 PRO CB C 8 32.377 32.377 32.504 -0.127 25913
3617 1 17 . 1 1 9 9 GLY N N 9 110.263 110.263 109.209 1.054 25913
3618 1 17 . 1 1 9 9 GLY C C 9 172.859 172.859 173.259 -0.400 25913
3619 1 17 . 1 1 9 9 GLY CA C 9 45.211 45.211 45.847 -0.637 25913
3620 1 17 . 1 1 9 9 GLY H H 9 8.635 8.635 8.911 -0.276 25913
3621 1 17 . 1 1 10 10 ARG N N 10 121.025 121.025 122.791 -1.766 25913
3622 1 17 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.879 -0.097 25913
3623 1 17 . 1 1 10 10 ARG C C 10 175.125 175.125 174.973 0.152 25913
3624 1 17 . 1 1 10 10 ARG CA C 10 55.356 55.356 56.205 -0.849 25913
3625 1 17 . 1 1 10 10 ARG CB C 10 32.982 32.982 29.441 3.541 25913
3626 1 17 . 1 1 10 10 ARG H H 10 8.229 8.229 7.914 0.315 25913
3627 1 17 . 1 1 11 11 TYR N N 11 121.353 121.353 123.533 -2.180 25913
3628 1 17 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.691 -0.363 25913
3629 1 17 . 1 1 11 11 TYR C C 11 174.229 174.229 174.691 -0.462 25913
3630 1 17 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.065 0.984 25913
3631 1 17 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.604 -0.553 25913
3632 1 17 . 1 1 11 11 TYR H H 11 8.692 8.692 9.383 -0.691 25913
3633 1 17 . 1 1 12 12 PHE N N 12 122.456 122.456 122.001 0.455 25913
3634 1 17 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.327 -0.443 25913
3635 1 17 . 1 1 12 12 PHE C C 12 174.224 174.224 174.869 -0.645 25913
3636 1 17 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.448 0.571 25913
3637 1 17 . 1 1 12 12 PHE CB C 12 44.078 44.078 41.958 2.120 25913
3638 1 17 . 1 1 12 12 PHE H H 12 9.415 9.415 9.099 0.316 25913
3639 1 17 . 1 1 13 13 CYS N N 13 128.438 128.438 128.482 -0.044 25913
3640 1 17 . 1 1 13 13 CYS HA H 13 4.653 4.653 4.921 -0.268 25913
3641 1 17 . 1 1 13 13 CYS C C 13 176.686 176.686 175.285 1.401 25913
3642 1 17 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.777 0.551 25913
3643 1 17 . 1 1 13 13 CYS CB C 13 31.220 31.220 28.009 3.211 25913
3644 1 17 . 1 1 13 13 CYS H H 13 7.942 7.942 8.881 -0.939 25913
3645 1 17 . 1 1 14 14 HIS N N 14 126.467 126.467 125.734 0.733 25913
3646 1 17 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.634 -0.311 25913
3647 1 17 . 1 1 14 14 HIS C C 14 175.452 175.452 176.311 -0.859 25913
3648 1 17 . 1 1 14 14 HIS CA C 14 58.736 58.736 57.779 0.957 25913
3649 1 17 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.566 -1.375 25913
3650 1 17 . 1 1 14 14 HIS H H 14 8.971 8.971 9.455 -0.484 25913
3651 1 17 . 1 1 15 15 CYS N N 15 123.882 123.882 117.629 6.253 25913
3652 1 17 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.359 0.083 25913
3653 1 17 . 1 1 15 15 CYS C C 15 176.939 176.939 175.728 1.211 25913
3654 1 17 . 1 1 15 15 CYS CA C 15 61.704 61.704 61.625 0.079 25913
3655 1 17 . 1 1 15 15 CYS CB C 15 28.341 28.341 29.167 -0.826 25913
3656 1 17 . 1 1 15 15 CYS H H 15 9.195 9.195 8.225 0.970 25913
3657 1 17 . 1 1 16 16 CYS N N 16 124.898 124.898 119.415 5.483 25913
3658 1 17 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.583 -0.585 25913
3659 1 17 . 1 1 16 16 CYS C C 16 175.557 175.557 174.695 0.862 25913
3660 1 17 . 1 1 16 16 CYS CB C 16 30.961 30.961 27.788 3.173 25913
3661 1 17 . 1 1 16 16 CYS H H 16 9.794 9.794 8.138 1.656 25913
3662 1 17 . 1 1 17 17 SER N N 17 114.055 114.055 114.102 -0.047 25913
3663 1 17 . 1 1 17 17 SER HA H 17 3.755 3.755 4.111 -0.356 25913
3664 1 17 . 1 1 17 17 SER C C 17 173.790 173.790 173.265 0.525 25913
3665 1 17 . 1 1 17 17 SER CA C 17 58.868 58.868 59.639 -0.771 25913
3666 1 17 . 1 1 17 17 SER CB C 17 61.703 61.703 60.374 1.329 25913
3667 1 17 . 1 1 17 17 SER H H 17 7.950 7.950 8.230 -0.280 25913
3668 1 17 . 1 1 18 18 VAL N N 18 111.916 111.916 112.066 -0.150 25913
3669 1 17 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.299 0.159 25913
3670 1 17 . 1 1 18 18 VAL C C 18 173.765 173.765 173.590 0.175 25913
3671 1 17 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.024 0.008 25913
3672 1 17 . 1 1 18 18 VAL CB C 18 36.667 36.667 35.353 1.314 25913
3673 1 17 . 1 1 18 18 VAL H H 18 6.438 6.438 6.959 -0.521 25913
3674 1 17 . 1 1 19 19 GLU N N 19 123.431 123.431 122.181 1.250 25913
3675 1 17 . 1 1 19 19 GLU HA H 19 5.023 5.023 4.977 0.046 25913
3676 1 17 . 1 1 19 19 GLU C C 19 176.506 176.506 175.964 0.542 25913
3677 1 17 . 1 1 19 19 GLU CA C 19 56.818 56.818 56.342 0.476 25913
3678 1 17 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.662 -0.497 25913
3679 1 17 . 1 1 19 19 GLU H H 19 8.346 8.346 8.406 -0.060 25913
3680 1 17 . 1 1 20 20 ILE N N 20 117.751 117.751 120.744 -2.993 25913
3681 1 17 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.647 0.094 25913
3682 1 17 . 1 1 20 20 ILE C C 20 175.511 175.511 173.995 1.516 25913
3683 1 17 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.418 -0.473 25913
3684 1 17 . 1 1 20 20 ILE CB C 20 44.667 44.667 42.006 2.661 25913
3685 1 17 . 1 1 20 20 ILE H H 20 8.537 8.537 9.172 -0.635 25913
3686 1 17 . 1 1 21 21 VAL N N 21 124.220 124.220 122.693 1.527 25913
3687 1 17 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.206 -0.620 25913
3688 1 17 . 1 1 21 21 VAL C C 21 174.640 174.640 173.893 0.747 25913
3689 1 17 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.710 2.008 25913
3690 1 17 . 1 1 21 21 VAL CB C 21 32.503 32.503 32.871 -0.368 25913
3691 1 17 . 1 1 21 21 VAL H H 21 8.203 8.203 8.454 -0.251 25913
3692 1 17 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.648 -0.589 25913
3693 1 17 . 1 1 22 22 PRO C C 22 175.352 175.352 176.101 -0.749 25913
3694 1 17 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.733 -0.072 25913
3695 1 17 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.298 -0.284 25913
3696 1 17 . 1 1 23 23 ARG N N 23 121.370 121.370 122.707 -1.337 25913
3697 1 17 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.222 0.033 25913
3698 1 17 . 1 1 23 23 ARG C C 23 175.759 175.759 176.650 -0.891 25913
3699 1 17 . 1 1 23 23 ARG CA C 23 56.052 56.052 56.089 -0.037 25913
3700 1 17 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.313 1.573 25913
3701 1 17 . 1 1 23 23 ARG H H 23 8.635 8.635 8.254 0.381 25913
3702 1 17 . 1 1 24 24 LEU N N 24 127.914 127.914 127.238 0.676 25913
3703 1 17 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.840 0.333 25913
3704 1 17 . 1 1 24 24 LEU C C 24 175.774 175.774 176.036 -0.262 25913
3705 1 17 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.482 -5.544 25913
3706 1 17 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.238 2.182 25913
3707 1 17 . 1 1 24 24 LEU H H 24 8.521 8.521 8.712 -0.191 25913
3708 1 17 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.176 0.164 25913
3709 1 17 . 1 1 25 25 PRO C C 25 176.386 176.386 177.019 -0.633 25913
3710 1 17 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.495 -0.828 25913
3711 1 17 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.749 2.927 25913
3712 1 17 . 1 1 26 26 ASP N N 26 122.078 122.078 115.475 6.603 25913
3713 1 17 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.683 -0.296 25913
3714 1 17 . 1 1 26 26 ASP C C 26 175.321 175.321 175.942 -0.621 25913
3715 1 17 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.307 2.048 25913
3716 1 17 . 1 1 26 26 ASP CB C 26 41.066 41.066 43.307 -2.241 25913
3717 1 17 . 1 1 26 26 ASP H H 26 8.752 8.752 7.722 1.030 25913
3718 1 17 . 1 1 27 27 TYR N N 27 117.607 117.607 117.516 0.091 25913
3719 1 17 . 1 1 27 27 TYR HA H 27 3.449 3.449 4.005 -0.556 25913
3720 1 17 . 1 1 27 27 TYR C C 27 173.074 173.074 174.354 -1.280 25913
3721 1 17 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.282 1.155 25913
3722 1 17 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.873 -0.813 25913
3723 1 17 . 1 1 27 27 TYR H H 27 8.666 8.666 8.081 0.586 25913
3724 1 17 . 1 1 28 28 ILE N N 28 111.804 111.804 112.927 -1.123 25913
3725 1 17 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.494 0.281 25913
3726 1 17 . 1 1 28 28 ILE C C 28 175.083 175.083 174.660 0.423 25913
3727 1 17 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.170 -0.601 25913
3728 1 17 . 1 1 28 28 ILE CB C 28 42.107 42.107 41.281 0.826 25913
3729 1 17 . 1 1 28 28 ILE H H 28 6.761 6.761 7.380 -0.619 25913
3730 1 17 . 1 1 29 29 CYS N N 29 126.875 126.875 119.087 7.788 25913
3731 1 17 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.765 -0.357 25913
3732 1 17 . 1 1 29 29 CYS C C 29 175.932 175.932 175.138 0.794 25913
3733 1 17 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.748 0.654 25913
3734 1 17 . 1 1 29 29 CYS CB C 29 32.214 32.214 28.001 4.213 25913
3735 1 17 . 1 1 29 29 CYS H H 29 8.783 8.783 8.749 0.034 25913
3736 1 17 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.427 -0.045 25913
3737 1 17 . 1 1 30 30 PRO C C 30 176.824 176.824 177.242 -0.418 25913
3738 1 17 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.546 -0.506 25913
3739 1 17 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.888 0.456 25913
3740 1 17 . 1 1 31 31 ARG N N 31 124.131 124.131 116.575 7.556 25913
3741 1 17 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.424 -0.123 25913
3742 1 17 . 1 1 31 31 ARG C C 31 177.721 177.721 177.138 0.583 25913
3743 1 17 . 1 1 31 31 ARG CA C 31 58.190 58.190 57.573 0.617 25913
3744 1 17 . 1 1 31 31 ARG CB C 31 31.682 31.682 31.018 0.664 25913
3745 1 17 . 1 1 31 31 ARG H H 31 9.604 9.604 7.703 1.901 25913
3746 1 17 . 1 1 32 32 CYS N N 32 119.758 119.758 113.822 5.936 25913
3747 1 17 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.828 0.011 25913
3748 1 17 . 1 1 32 32 CYS C C 32 176.450 176.450 174.416 2.034 25913
3749 1 17 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.685 1.025 25913
3750 1 17 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.534 3.696 25913
3751 1 17 . 1 1 32 32 CYS H H 32 8.549 8.549 7.743 0.806 25913
3752 1 17 . 1 1 33 33 GLU N N 33 118.109 118.109 119.761 -1.652 25913
3753 1 17 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.058 0.020 25913
3754 1 17 . 1 1 33 33 GLU C C 33 174.739 174.739 176.097 -1.358 25913
3755 1 17 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.559 0.959 25913
3756 1 17 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.463 -0.771 25913
3757 1 17 . 1 1 33 33 GLU H H 33 7.868 7.868 8.231 -0.363 25913
3758 1 17 . 1 1 34 34 SER N N 34 117.224 117.224 114.979 2.245 25913
3759 1 17 . 1 1 34 34 SER HA H 34 4.437 4.437 4.476 -0.039 25913
3760 1 17 . 1 1 34 34 SER C C 34 175.392 175.392 175.612 -0.220 25913
3761 1 17 . 1 1 34 34 SER CA C 34 59.277 59.277 59.604 -0.327 25913
3762 1 17 . 1 1 34 34 SER CB C 34 65.429 65.429 64.337 1.092 25913
3763 1 17 . 1 1 34 34 SER H H 34 8.786 8.786 7.864 0.922 25913
3764 1 17 . 1 1 35 35 GLY N N 35 111.095 111.095 107.492 3.603 25913
3765 1 17 . 1 1 35 35 GLY C C 35 175.730 175.730 174.277 1.453 25913
3766 1 17 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.765 0.476 25913
3767 1 17 . 1 1 35 35 GLY H H 35 8.511 8.511 8.594 -0.083 25913
3768 1 17 . 1 1 36 36 PHE N N 36 126.409 126.409 125.026 1.383 25913
3769 1 17 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.470 0.681 25913
3770 1 17 . 1 1 36 36 PHE C C 36 174.098 174.098 174.674 -0.576 25913
3771 1 17 . 1 1 36 36 PHE CA C 36 55.269 55.269 58.281 -3.012 25913
3772 1 17 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.457 -1.430 25913
3773 1 17 . 1 1 36 36 PHE H H 36 8.850 8.850 7.778 1.072 25913
3774 1 17 . 1 1 37 37 ILE N N 37 117.377 117.377 115.839 1.538 25913
3775 1 17 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.251 0.105 25913
3776 1 17 . 1 1 37 37 ILE C C 37 175.508 175.508 174.734 0.774 25913
3777 1 17 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.645 0.042 25913
3778 1 17 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.628 -1.480 25913
3779 1 17 . 1 1 37 37 ILE H H 37 7.972 7.972 7.803 0.169 25913
3780 1 17 . 1 1 38 38 GLU N N 38 124.869 124.869 122.595 2.274 25913
3781 1 17 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.541 0.344 25913
3782 1 17 . 1 1 38 38 GLU C C 38 174.300 174.300 175.353 -1.053 25913
3783 1 17 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.849 -0.193 25913
3784 1 17 . 1 1 38 38 GLU CB C 38 34.589 34.589 32.226 2.363 25913
3785 1 17 . 1 1 38 38 GLU H H 38 9.131 9.131 8.764 0.367 25913
3786 1 17 . 1 1 39 39 GLU N N 39 127.840 127.840 127.239 0.601 25913
3787 1 17 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.059 0.789 25913
3788 1 17 . 1 1 39 39 GLU C C 39 175.507 175.507 175.520 -0.013 25913
3789 1 17 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.950 0.555 25913
3790 1 17 . 1 1 39 39 GLU CB C 39 30.249 30.249 28.879 1.370 25913
3791 1 17 . 1 1 39 39 GLU H H 39 8.844 8.844 8.626 0.218 25913
3792 1 18 . 1 1 0 0 SER HA H 0 4.525 4.525 4.798 -0.273 25913
3793 1 18 . 1 1 0 0 SER C C 0 174.776 174.776 175.048 -0.272 25913
3794 1 18 . 1 1 0 0 SER CA C 0 58.364 58.364 58.450 -0.086 25913
3795 1 18 . 1 1 0 0 SER CB C 0 64.049 64.049 63.138 0.911 25913
3796 1 18 . 1 1 1 1 MET N N 1 123.174 123.174 122.969 0.205 25913
3797 1 18 . 1 1 1 1 MET HA H 1 4.486 4.486 4.788 -0.302 25913
3798 1 18 . 1 1 1 1 MET C C 1 176.177 176.177 176.163 0.014 25913
3799 1 18 . 1 1 1 1 MET CA C 1 55.804 55.804 55.636 0.168 25913
3800 1 18 . 1 1 1 1 MET CB C 1 32.941 32.941 32.774 0.167 25913
3801 1 18 . 1 1 1 1 MET H H 1 8.592 8.592 8.968 -0.376 25913
3802 1 18 . 1 1 2 2 ALA N N 2 125.785 125.785 121.627 4.158 25913
3803 1 18 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.348 -0.055 25913
3804 1 18 . 1 1 2 2 ALA C C 2 177.812 177.812 176.826 0.986 25913
3805 1 18 . 1 1 2 2 ALA CA C 2 52.809 52.809 52.356 0.453 25913
3806 1 18 . 1 1 2 2 ALA CB C 2 19.224 19.224 20.320 -1.096 25913
3807 1 18 . 1 1 2 2 ALA H H 2 8.337 8.337 7.891 0.446 25913
3808 1 18 . 1 1 3 3 GLU N N 3 120.731 120.731 118.086 2.645 25913
3809 1 18 . 1 1 3 3 GLU HA H 3 4.256 4.256 4.277 -0.021 25913
3810 1 18 . 1 1 3 3 GLU C C 3 176.186 176.186 175.252 0.934 25913
3811 1 18 . 1 1 3 3 GLU CA C 3 56.377 56.377 56.748 -0.372 25913
3812 1 18 . 1 1 3 3 GLU CB C 3 30.549 30.549 30.073 0.476 25913
3813 1 18 . 1 1 3 3 GLU H H 3 8.274 8.274 7.952 0.322 25913
3814 1 18 . 1 1 4 4 ALA N N 4 125.716 125.716 123.386 2.330 25913
3815 1 18 . 1 1 4 4 ALA HA H 4 4.345 4.345 4.082 0.263 25913
3816 1 18 . 1 1 4 4 ALA C C 4 177.530 177.530 176.171 1.359 25913
3817 1 18 . 1 1 4 4 ALA CA C 4 52.413 52.413 53.129 -0.716 25913
3818 1 18 . 1 1 4 4 ALA CB C 4 19.466 19.466 17.361 2.105 25913
3819 1 18 . 1 1 4 4 ALA H H 4 8.271 8.271 8.552 -0.281 25913
3820 1 18 . 1 1 5 5 SER N N 5 117.161 117.161 114.703 2.458 25913
3821 1 18 . 1 1 5 5 SER HA H 5 4.724 4.724 4.566 0.158 25913
3822 1 18 . 1 1 5 5 SER C C 5 172.661 172.661 173.601 -0.940 25913
3823 1 18 . 1 1 5 5 SER CA C 5 56.354 56.354 59.396 -3.042 25913
3824 1 18 . 1 1 5 5 SER CB C 5 63.442 63.442 63.045 0.397 25913
3825 1 18 . 1 1 5 5 SER H H 5 8.259 8.259 8.472 -0.213 25913
3826 1 18 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.436 -0.022 25913
3827 1 18 . 1 1 6 6 PRO C C 6 176.523 176.523 176.237 0.286 25913
3828 1 18 . 1 1 6 6 PRO CA C 6 63.385 63.385 64.233 -0.848 25913
3829 1 18 . 1 1 6 6 PRO CB C 6 32.187 32.187 31.909 0.278 25913
3830 1 18 . 1 1 7 7 HIS N N 7 120.170 120.170 113.869 6.301 25913
3831 1 18 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.772 0.208 25913
3832 1 18 . 1 1 7 7 HIS C C 7 172.577 172.577 172.335 0.242 25913
3833 1 18 . 1 1 7 7 HIS CA C 7 53.492 53.492 53.576 -0.084 25913
3834 1 18 . 1 1 7 7 HIS CB C 7 29.133 29.133 29.607 -0.474 25913
3835 1 18 . 1 1 7 7 HIS H H 7 8.489 8.489 7.467 1.022 25913
3836 1 18 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.704 -0.158 25913
3837 1 18 . 1 1 8 8 PRO C C 8 177.382 177.382 176.247 1.135 25913
3838 1 18 . 1 1 8 8 PRO CA C 8 63.443 63.443 63.267 0.176 25913
3839 1 18 . 1 1 8 8 PRO CB C 8 32.377 32.377 32.728 -0.351 25913
3840 1 18 . 1 1 9 9 GLY N N 9 110.263 110.263 110.838 -0.575 25913
3841 1 18 . 1 1 9 9 GLY C C 9 172.859 172.859 173.417 -0.558 25913
3842 1 18 . 1 1 9 9 GLY CA C 9 45.211 45.211 46.254 -1.043 25913
3843 1 18 . 1 1 9 9 GLY H H 9 8.635 8.635 9.003 -0.368 25913
3844 1 18 . 1 1 10 10 ARG N N 10 121.025 121.025 122.459 -1.434 25913
3845 1 18 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.881 -0.099 25913
3846 1 18 . 1 1 10 10 ARG C C 10 175.125 175.125 174.708 0.417 25913
3847 1 18 . 1 1 10 10 ARG CA C 10 55.356 55.356 55.840 -0.485 25913
3848 1 18 . 1 1 10 10 ARG CB C 10 32.982 32.982 29.711 3.271 25913
3849 1 18 . 1 1 10 10 ARG H H 10 8.229 8.229 8.030 0.199 25913
3850 1 18 . 1 1 11 11 TYR N N 11 121.353 121.353 123.390 -2.037 25913
3851 1 18 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.742 -0.414 25913
3852 1 18 . 1 1 11 11 TYR C C 11 174.229 174.229 174.787 -0.558 25913
3853 1 18 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.032 1.017 25913
3854 1 18 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.571 -0.520 25913
3855 1 18 . 1 1 11 11 TYR H H 11 8.692 8.692 9.376 -0.684 25913
3856 1 18 . 1 1 12 12 PHE N N 12 122.456 122.456 121.916 0.540 25913
3857 1 18 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.300 -0.416 25913
3858 1 18 . 1 1 12 12 PHE C C 12 174.224 174.224 174.684 -0.460 25913
3859 1 18 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.512 0.507 25913
3860 1 18 . 1 1 12 12 PHE CB C 12 44.078 44.078 42.077 2.001 25913
3861 1 18 . 1 1 12 12 PHE H H 12 9.415 9.415 8.966 0.449 25913
3862 1 18 . 1 1 13 13 CYS N N 13 128.438 128.438 128.392 0.046 25913
3863 1 18 . 1 1 13 13 CYS HA H 13 4.653 4.653 5.059 -0.406 25913
3864 1 18 . 1 1 13 13 CYS C C 13 176.686 176.686 175.327 1.359 25913
3865 1 18 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.532 0.796 25913
3866 1 18 . 1 1 13 13 CYS CB C 13 31.220 31.220 28.258 2.962 25913
3867 1 18 . 1 1 13 13 CYS H H 13 7.942 7.942 8.872 -0.930 25913
3868 1 18 . 1 1 14 14 HIS N N 14 126.467 126.467 125.483 0.984 25913
3869 1 18 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.602 -0.279 25913
3870 1 18 . 1 1 14 14 HIS C C 14 175.452 175.452 176.504 -1.052 25913
3871 1 18 . 1 1 14 14 HIS CA C 14 58.736 58.736 58.209 0.527 25913
3872 1 18 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.651 -1.460 25913
3873 1 18 . 1 1 14 14 HIS H H 14 8.971 8.971 9.633 -0.662 25913
3874 1 18 . 1 1 15 15 CYS N N 15 123.882 123.882 117.165 6.717 25913
3875 1 18 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.344 0.098 25913
3876 1 18 . 1 1 15 15 CYS C C 15 176.939 176.939 175.802 1.137 25913
3877 1 18 . 1 1 15 15 CYS CA C 15 61.704 61.704 62.132 -0.428 25913
3878 1 18 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.413 -0.072 25913
3879 1 18 . 1 1 15 15 CYS H H 15 9.195 9.195 8.120 1.075 25913
3880 1 18 . 1 1 16 16 CYS N N 16 124.898 124.898 117.237 7.661 25913
3881 1 18 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.557 -0.559 25913
3882 1 18 . 1 1 16 16 CYS C C 16 175.557 175.557 174.461 1.096 25913
3883 1 18 . 1 1 16 16 CYS CB C 16 30.961 30.961 28.583 2.378 25913
3884 1 18 . 1 1 16 16 CYS H H 16 9.794 9.794 7.857 1.937 25913
3885 1 18 . 1 1 17 17 SER N N 17 114.055 114.055 114.719 -0.664 25913
3886 1 18 . 1 1 17 17 SER HA H 17 3.755 3.755 4.132 -0.377 25913
3887 1 18 . 1 1 17 17 SER C C 17 173.790 173.790 173.198 0.592 25913
3888 1 18 . 1 1 17 17 SER CA C 17 58.868 58.868 59.451 -0.583 25913
3889 1 18 . 1 1 17 17 SER CB C 17 61.703 61.703 60.751 0.952 25913
3890 1 18 . 1 1 17 17 SER H H 17 7.950 7.950 8.017 -0.067 25913
3891 1 18 . 1 1 18 18 VAL N N 18 111.916 111.916 112.971 -1.055 25913
3892 1 18 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.296 0.162 25913
3893 1 18 . 1 1 18 18 VAL C C 18 173.765 173.765 173.428 0.337 25913
3894 1 18 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.448 -0.416 25913
3895 1 18 . 1 1 18 18 VAL CB C 18 36.667 36.667 35.356 1.311 25913
3896 1 18 . 1 1 18 18 VAL H H 18 6.438 6.438 7.083 -0.645 25913
3897 1 18 . 1 1 19 19 GLU N N 19 123.431 123.431 121.795 1.636 25913
3898 1 18 . 1 1 19 19 GLU HA H 19 5.023 5.023 4.916 0.107 25913
3899 1 18 . 1 1 19 19 GLU C C 19 176.506 176.506 176.129 0.377 25913
3900 1 18 . 1 1 19 19 GLU CA C 19 56.818 56.818 56.387 0.431 25913
3901 1 18 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.533 -0.368 25913
3902 1 18 . 1 1 19 19 GLU H H 19 8.346 8.346 8.368 -0.022 25913
3903 1 18 . 1 1 20 20 ILE N N 20 117.751 117.751 121.170 -3.419 25913
3904 1 18 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.665 0.076 25913
3905 1 18 . 1 1 20 20 ILE C C 20 175.511 175.511 173.995 1.516 25913
3906 1 18 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.491 -0.546 25913
3907 1 18 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.855 2.812 25913
3908 1 18 . 1 1 20 20 ILE H H 20 8.537 8.537 9.165 -0.628 25913
3909 1 18 . 1 1 21 21 VAL N N 21 124.220 124.220 122.543 1.677 25913
3910 1 18 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.102 -0.516 25913
3911 1 18 . 1 1 21 21 VAL C C 21 174.640 174.640 173.945 0.695 25913
3912 1 18 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.615 2.103 25913
3913 1 18 . 1 1 21 21 VAL CB C 21 32.503 32.503 33.148 -0.645 25913
3914 1 18 . 1 1 21 21 VAL H H 21 8.203 8.203 8.417 -0.214 25913
3915 1 18 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.674 -0.615 25913
3916 1 18 . 1 1 22 22 PRO C C 22 175.352 175.352 176.155 -0.803 25913
3917 1 18 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.685 -0.024 25913
3918 1 18 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.188 -0.173 25913
3919 1 18 . 1 1 23 23 ARG N N 23 121.370 121.370 123.312 -1.942 25913
3920 1 18 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.201 0.054 25913
3921 1 18 . 1 1 23 23 ARG C C 23 175.759 175.759 177.002 -1.243 25913
3922 1 18 . 1 1 23 23 ARG CA C 23 56.052 56.052 56.061 -0.009 25913
3923 1 18 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.205 1.681 25913
3924 1 18 . 1 1 23 23 ARG H H 23 8.635 8.635 8.169 0.466 25913
3925 1 18 . 1 1 24 24 LEU N N 24 127.914 127.914 127.165 0.749 25913
3926 1 18 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.650 0.523 25913
3927 1 18 . 1 1 24 24 LEU C C 24 175.774 175.774 176.259 -0.485 25913
3928 1 18 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.588 -5.650 25913
3929 1 18 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.099 2.321 25913
3930 1 18 . 1 1 24 24 LEU H H 24 8.521 8.521 8.589 -0.068 25913
3931 1 18 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.195 0.145 25913
3932 1 18 . 1 1 25 25 PRO C C 25 176.386 176.386 176.926 -0.540 25913
3933 1 18 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.939 -1.272 25913
3934 1 18 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.637 3.038 25913
3935 1 18 . 1 1 26 26 ASP N N 26 122.078 122.078 113.666 8.412 25913
3936 1 18 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.700 -0.313 25913
3937 1 18 . 1 1 26 26 ASP C C 26 175.321 175.321 175.413 -0.092 25913
3938 1 18 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.099 2.256 25913
3939 1 18 . 1 1 26 26 ASP CB C 26 41.066 41.066 43.832 -2.766 25913
3940 1 18 . 1 1 26 26 ASP H H 26 8.752 8.752 7.777 0.975 25913
3941 1 18 . 1 1 27 27 TYR N N 27 117.607 117.607 118.365 -0.758 25913
3942 1 18 . 1 1 27 27 TYR HA H 27 3.449 3.449 3.959 -0.510 25913
3943 1 18 . 1 1 27 27 TYR C C 27 173.074 173.074 174.319 -1.245 25913
3944 1 18 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.562 0.875 25913
3945 1 18 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.733 -0.673 25913
3946 1 18 . 1 1 27 27 TYR H H 27 8.666 8.666 7.950 0.716 25913
3947 1 18 . 1 1 28 28 ILE N N 28 111.804 111.804 112.484 -0.680 25913
3948 1 18 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.558 0.217 25913
3949 1 18 . 1 1 28 28 ILE C C 28 175.083 175.083 174.763 0.320 25913
3950 1 18 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.521 -0.952 25913
3951 1 18 . 1 1 28 28 ILE CB C 28 42.107 42.107 41.022 1.085 25913
3952 1 18 . 1 1 28 28 ILE H H 28 6.761 6.761 7.335 -0.574 25913
3953 1 18 . 1 1 29 29 CYS N N 29 126.875 126.875 118.837 8.038 25913
3954 1 18 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.755 -0.347 25913
3955 1 18 . 1 1 29 29 CYS C C 29 175.932 175.932 175.164 0.768 25913
3956 1 18 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.885 0.517 25913
3957 1 18 . 1 1 29 29 CYS CB C 29 32.214 32.214 27.906 4.308 25913
3958 1 18 . 1 1 29 29 CYS H H 29 8.783 8.783 8.698 0.085 25913
3959 1 18 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.439 -0.057 25913
3960 1 18 . 1 1 30 30 PRO C C 30 176.824 176.824 177.210 -0.386 25913
3961 1 18 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.452 -0.412 25913
3962 1 18 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.920 0.424 25913
3963 1 18 . 1 1 31 31 ARG N N 31 124.131 124.131 117.077 7.054 25913
3964 1 18 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.437 -0.136 25913
3965 1 18 . 1 1 31 31 ARG C C 31 177.721 177.721 177.165 0.556 25913
3966 1 18 . 1 1 31 31 ARG CA C 31 58.190 58.190 57.825 0.365 25913
3967 1 18 . 1 1 31 31 ARG CB C 31 31.682 31.682 30.885 0.797 25913
3968 1 18 . 1 1 31 31 ARG H H 31 9.604 9.604 7.657 1.947 25913
3969 1 18 . 1 1 32 32 CYS N N 32 119.758 119.758 114.151 5.607 25913
3970 1 18 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.842 -0.003 25913
3971 1 18 . 1 1 32 32 CYS C C 32 176.450 176.450 174.611 1.839 25913
3972 1 18 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.534 1.176 25913
3973 1 18 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.019 4.211 25913
3974 1 18 . 1 1 32 32 CYS H H 32 8.549 8.549 7.781 0.768 25913
3975 1 18 . 1 1 33 33 GLU N N 33 118.109 118.109 119.866 -1.757 25913
3976 1 18 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.098 -0.020 25913
3977 1 18 . 1 1 33 33 GLU C C 33 174.739 174.739 176.075 -1.336 25913
3978 1 18 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.546 0.972 25913
3979 1 18 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.186 -0.494 25913
3980 1 18 . 1 1 33 33 GLU H H 33 7.868 7.868 8.201 -0.333 25913
3981 1 18 . 1 1 34 34 SER N N 34 117.224 117.224 114.997 2.227 25913
3982 1 18 . 1 1 34 34 SER HA H 34 4.437 4.437 4.471 -0.034 25913
3983 1 18 . 1 1 34 34 SER C C 34 175.392 175.392 175.630 -0.238 25913
3984 1 18 . 1 1 34 34 SER CA C 34 59.277 59.277 59.782 -0.505 25913
3985 1 18 . 1 1 34 34 SER CB C 34 65.429 65.429 64.362 1.067 25913
3986 1 18 . 1 1 34 34 SER H H 34 8.786 8.786 7.983 0.803 25913
3987 1 18 . 1 1 35 35 GLY N N 35 111.095 111.095 108.188 2.907 25913
3988 1 18 . 1 1 35 35 GLY C C 35 175.730 175.730 174.748 0.982 25913
3989 1 18 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.705 0.536 25913
3990 1 18 . 1 1 35 35 GLY H H 35 8.511 8.511 8.464 0.047 25913
3991 1 18 . 1 1 36 36 PHE N N 36 126.409 126.409 124.889 1.520 25913
3992 1 18 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.487 0.664 25913
3993 1 18 . 1 1 36 36 PHE C C 36 174.098 174.098 174.652 -0.554 25913
3994 1 18 . 1 1 36 36 PHE CA C 36 55.269 55.269 58.152 -2.883 25913
3995 1 18 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.072 -1.046 25913
3996 1 18 . 1 1 36 36 PHE H H 36 8.850 8.850 7.909 0.941 25913
3997 1 18 . 1 1 37 37 ILE N N 37 117.377 117.377 115.138 2.239 25913
3998 1 18 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.471 -0.115 25913
3999 1 18 . 1 1 37 37 ILE C C 37 175.508 175.508 175.028 0.480 25913
4000 1 18 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.507 0.180 25913
4001 1 18 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.536 -1.388 25913
4002 1 18 . 1 1 37 37 ILE H H 37 7.972 7.972 7.968 0.004 25913
4003 1 18 . 1 1 38 38 GLU N N 38 124.869 124.869 122.999 1.870 25913
4004 1 18 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.580 0.305 25913
4005 1 18 . 1 1 38 38 GLU C C 38 174.300 174.300 175.340 -1.040 25913
4006 1 18 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.919 -0.263 25913
4007 1 18 . 1 1 38 38 GLU CB C 38 34.589 34.589 32.195 2.394 25913
4008 1 18 . 1 1 38 38 GLU H H 38 9.131 9.131 8.818 0.313 25913
4009 1 18 . 1 1 39 39 GLU N N 39 127.840 127.840 127.214 0.626 25913
4010 1 18 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.182 0.666 25913
4011 1 18 . 1 1 39 39 GLU C C 39 175.507 175.507 175.619 -0.112 25913
4012 1 18 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.744 0.761 25913
4013 1 18 . 1 1 39 39 GLU CB C 39 30.249 30.249 28.832 1.417 25913
4014 1 18 . 1 1 39 39 GLU H H 39 8.844 8.844 8.658 0.186 25913
4015 1 19 . 1 1 0 0 SER HA H 0 4.525 4.525 4.490 0.035 25913
4016 1 19 . 1 1 0 0 SER C C 0 174.776 174.776 174.436 0.340 25913
4017 1 19 . 1 1 0 0 SER CA C 0 58.364 58.364 58.556 -0.192 25913
4018 1 19 . 1 1 0 0 SER CB C 0 64.049 64.049 64.166 -0.117 25913
4019 1 19 . 1 1 1 1 MET N N 1 123.174 123.174 118.090 5.084 25913
4020 1 19 . 1 1 1 1 MET HA H 1 4.486 4.486 4.887 -0.401 25913
4021 1 19 . 1 1 1 1 MET C C 1 176.177 176.177 174.328 1.849 25913
4022 1 19 . 1 1 1 1 MET CA C 1 55.804 55.804 54.443 1.361 25913
4023 1 19 . 1 1 1 1 MET CB C 1 32.941 32.941 35.938 -2.997 25913
4024 1 19 . 1 1 1 1 MET H H 1 8.592 8.592 7.417 1.175 25913
4025 1 19 . 1 1 2 2 ALA N N 2 125.785 125.785 121.200 4.585 25913
4026 1 19 . 1 1 2 2 ALA HA H 2 4.293 4.293 5.059 -0.766 25913
4027 1 19 . 1 1 2 2 ALA C C 2 177.812 177.812 176.678 1.134 25913
4028 1 19 . 1 1 2 2 ALA CA C 2 52.809 52.809 51.509 1.300 25913
4029 1 19 . 1 1 2 2 ALA CB C 2 19.224 19.224 19.856 -0.632 25913
4030 1 19 . 1 1 2 2 ALA H H 2 8.337 8.337 8.411 -0.074 25913
4031 1 19 . 1 1 3 3 GLU N N 3 120.731 120.731 118.981 1.750 25913
4032 1 19 . 1 1 3 3 GLU HA H 3 4.256 4.256 4.483 -0.227 25913
4033 1 19 . 1 1 3 3 GLU C C 3 176.186 176.186 176.263 -0.077 25913
4034 1 19 . 1 1 3 3 GLU CA C 3 56.377 56.377 55.344 1.033 25913
4035 1 19 . 1 1 3 3 GLU CB C 3 30.549 30.549 30.911 -0.362 25913
4036 1 19 . 1 1 3 3 GLU H H 3 8.274 8.274 7.699 0.575 25913
4037 1 19 . 1 1 4 4 ALA N N 4 125.716 125.716 125.653 0.063 25913
4038 1 19 . 1 1 4 4 ALA HA H 4 4.345 4.345 3.996 0.349 25913
4039 1 19 . 1 1 4 4 ALA C C 4 177.530 177.530 177.282 0.248 25913
4040 1 19 . 1 1 4 4 ALA CA C 4 52.413 52.413 54.597 -2.184 25913
4041 1 19 . 1 1 4 4 ALA CB C 4 19.466 19.466 17.835 1.631 25913
4042 1 19 . 1 1 4 4 ALA H H 4 8.271 8.271 8.711 -0.441 25913
4043 1 19 . 1 1 5 5 SER N N 5 117.161 117.161 114.949 2.212 25913
4044 1 19 . 1 1 5 5 SER HA H 5 4.724 4.724 4.678 0.046 25913
4045 1 19 . 1 1 5 5 SER C C 5 172.661 172.661 172.842 -0.181 25913
4046 1 19 . 1 1 5 5 SER CA C 5 56.354 56.354 58.184 -1.830 25913
4047 1 19 . 1 1 5 5 SER CB C 5 63.442 63.442 64.039 -0.597 25913
4048 1 19 . 1 1 5 5 SER H H 5 8.259 8.259 8.191 0.068 25913
4049 1 19 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.480 -0.066 25913
4050 1 19 . 1 1 6 6 PRO C C 6 176.523 176.523 175.447 1.076 25913
4051 1 19 . 1 1 6 6 PRO CA C 6 63.385 63.385 64.030 -0.645 25913
4052 1 19 . 1 1 6 6 PRO CB C 6 32.187 32.187 32.009 0.178 25913
4053 1 19 . 1 1 7 7 HIS N N 7 120.170 120.170 119.446 0.724 25913
4054 1 19 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.899 0.081 25913
4055 1 19 . 1 1 7 7 HIS C C 7 172.577 172.577 173.489 -0.912 25913
4056 1 19 . 1 1 7 7 HIS CA C 7 53.492 53.492 53.159 0.333 25913
4057 1 19 . 1 1 7 7 HIS CB C 7 29.133 29.133 30.843 -1.710 25913
4058 1 19 . 1 1 7 7 HIS H H 7 8.489 8.489 8.092 0.397 25913
4059 1 19 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.668 -0.122 25913
4060 1 19 . 1 1 8 8 PRO C C 8 177.382 177.382 176.180 1.202 25913
4061 1 19 . 1 1 8 8 PRO CA C 8 63.443 63.443 62.387 1.056 25913
4062 1 19 . 1 1 8 8 PRO CB C 8 32.377 32.377 33.113 -0.736 25913
4063 1 19 . 1 1 9 9 GLY N N 9 110.263 110.263 107.064 3.199 25913
4064 1 19 . 1 1 9 9 GLY C C 9 172.859 172.859 173.496 -0.637 25913
4065 1 19 . 1 1 9 9 GLY CA C 9 45.211 45.211 45.895 -0.684 25913
4066 1 19 . 1 1 9 9 GLY H H 9 8.635 8.635 8.873 -0.238 25913
4067 1 19 . 1 1 10 10 ARG N N 10 121.025 121.025 123.255 -2.230 25913
4068 1 19 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.643 0.139 25913
4069 1 19 . 1 1 10 10 ARG C C 10 175.125 175.125 174.826 0.299 25913
4070 1 19 . 1 1 10 10 ARG CA C 10 55.356 55.356 56.226 -0.870 25913
4071 1 19 . 1 1 10 10 ARG CB C 10 32.982 32.982 28.969 4.013 25913
4072 1 19 . 1 1 10 10 ARG H H 10 8.229 8.229 7.924 0.305 25913
4073 1 19 . 1 1 11 11 TYR N N 11 121.353 121.353 123.878 -2.525 25913
4074 1 19 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.639 -0.311 25913
4075 1 19 . 1 1 11 11 TYR C C 11 174.229 174.229 174.693 -0.464 25913
4076 1 19 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.184 0.866 25913
4077 1 19 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.459 -0.408 25913
4078 1 19 . 1 1 11 11 TYR H H 11 8.692 8.692 9.362 -0.670 25913
4079 1 19 . 1 1 12 12 PHE N N 12 122.456 122.456 122.347 0.109 25913
4080 1 19 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.312 -0.428 25913
4081 1 19 . 1 1 12 12 PHE C C 12 174.224 174.224 174.790 -0.566 25913
4082 1 19 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.416 0.603 25913
4083 1 19 . 1 1 12 12 PHE CB C 12 44.078 44.078 41.925 2.153 25913
4084 1 19 . 1 1 12 12 PHE H H 12 9.415 9.415 9.141 0.274 25913
4085 1 19 . 1 1 13 13 CYS N N 13 128.438 128.438 128.521 -0.083 25913
4086 1 19 . 1 1 13 13 CYS HA H 13 4.653 4.653 5.017 -0.364 25913
4087 1 19 . 1 1 13 13 CYS C C 13 176.686 176.686 175.323 1.363 25913
4088 1 19 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.669 0.659 25913
4089 1 19 . 1 1 13 13 CYS CB C 13 31.220 31.220 28.072 3.148 25913
4090 1 19 . 1 1 13 13 CYS H H 13 7.942 7.942 8.963 -1.020 25913
4091 1 19 . 1 1 14 14 HIS N N 14 126.467 126.467 125.770 0.697 25913
4092 1 19 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.589 -0.266 25913
4093 1 19 . 1 1 14 14 HIS C C 14 175.452 175.452 176.246 -0.794 25913
4094 1 19 . 1 1 14 14 HIS CA C 14 58.736 58.736 57.942 0.794 25913
4095 1 19 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.601 -1.410 25913
4096 1 19 . 1 1 14 14 HIS H H 14 8.971 8.971 9.460 -0.489 25913
4097 1 19 . 1 1 15 15 CYS N N 15 123.882 123.882 117.581 6.301 25913
4098 1 19 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.343 0.099 25913
4099 1 19 . 1 1 15 15 CYS C C 15 176.939 176.939 175.751 1.188 25913
4100 1 19 . 1 1 15 15 CYS CA C 15 61.704 61.704 62.002 -0.298 25913
4101 1 19 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.704 -0.363 25913
4102 1 19 . 1 1 15 15 CYS H H 15 9.195 9.195 8.291 0.904 25913
4103 1 19 . 1 1 16 16 CYS N N 16 124.898 124.898 118.969 5.929 25913
4104 1 19 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.569 -0.571 25913
4105 1 19 . 1 1 16 16 CYS C C 16 175.557 175.557 174.628 0.929 25913
4106 1 19 . 1 1 16 16 CYS CB C 16 30.961 30.961 27.932 3.029 25913
4107 1 19 . 1 1 16 16 CYS H H 16 9.794 9.794 8.002 1.792 25913
4108 1 19 . 1 1 17 17 SER N N 17 114.055 114.055 114.771 -0.716 25913
4109 1 19 . 1 1 17 17 SER HA H 17 3.755 3.755 4.095 -0.340 25913
4110 1 19 . 1 1 17 17 SER C C 17 173.790 173.790 173.262 0.528 25913
4111 1 19 . 1 1 17 17 SER CA C 17 58.868 58.868 59.520 -0.652 25913
4112 1 19 . 1 1 17 17 SER CB C 17 61.703 61.703 60.632 1.071 25913
4113 1 19 . 1 1 17 17 SER H H 17 7.950 7.950 8.078 -0.128 25913
4114 1 19 . 1 1 18 18 VAL N N 18 111.916 111.916 112.812 -0.896 25913
4115 1 19 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.269 0.189 25913
4116 1 19 . 1 1 18 18 VAL C C 18 173.765 173.765 173.583 0.182 25913
4117 1 19 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.648 -0.616 25913
4118 1 19 . 1 1 18 18 VAL CB C 18 36.667 36.667 34.851 1.816 25913
4119 1 19 . 1 1 18 18 VAL H H 18 6.438 6.438 7.038 -0.600 25913
4120 1 19 . 1 1 19 19 GLU N N 19 123.431 123.431 121.611 1.820 25913
4121 1 19 . 1 1 19 19 GLU HA H 19 5.023 5.023 5.162 -0.139 25913
4122 1 19 . 1 1 19 19 GLU C C 19 176.506 176.506 176.248 0.258 25913
4123 1 19 . 1 1 19 19 GLU CA C 19 56.818 56.818 56.118 0.700 25913
4124 1 19 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.587 -0.422 25913
4125 1 19 . 1 1 19 19 GLU H H 19 8.346 8.346 8.417 -0.071 25913
4126 1 19 . 1 1 20 20 ILE N N 20 117.751 117.751 121.309 -3.558 25913
4127 1 19 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.748 -0.007 25913
4128 1 19 . 1 1 20 20 ILE C C 20 175.511 175.511 173.760 1.751 25913
4129 1 19 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.481 -0.536 25913
4130 1 19 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.583 3.084 25913
4131 1 19 . 1 1 20 20 ILE H H 20 8.537 8.537 8.899 -0.362 25913
4132 1 19 . 1 1 21 21 VAL N N 21 124.220 124.220 121.978 2.242 25913
4133 1 19 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.201 -0.615 25913
4134 1 19 . 1 1 21 21 VAL C C 21 174.640 174.640 174.125 0.515 25913
4135 1 19 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.907 1.811 25913
4136 1 19 . 1 1 21 21 VAL CB C 21 32.503 32.503 33.452 -0.949 25913
4137 1 19 . 1 1 21 21 VAL H H 21 8.203 8.203 8.382 -0.179 25913
4138 1 19 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.732 -0.673 25913
4139 1 19 . 1 1 22 22 PRO C C 22 175.352 175.352 176.131 -0.779 25913
4140 1 19 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.541 0.120 25913
4141 1 19 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.440 -0.426 25913
4142 1 19 . 1 1 23 23 ARG N N 23 121.370 121.370 122.482 -1.112 25913
4143 1 19 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.293 -0.038 25913
4144 1 19 . 1 1 23 23 ARG C C 23 175.759 175.759 176.604 -0.845 25913
4145 1 19 . 1 1 23 23 ARG CA C 23 56.052 56.052 55.891 0.161 25913
4146 1 19 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.220 1.666 25913
4147 1 19 . 1 1 23 23 ARG H H 23 8.635 8.635 8.242 0.393 25913
4148 1 19 . 1 1 24 24 LEU N N 24 127.914 127.914 127.050 0.864 25913
4149 1 19 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.725 0.448 25913
4150 1 19 . 1 1 24 24 LEU C C 24 175.774 175.774 176.175 -0.401 25913
4151 1 19 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.473 -5.535 25913
4152 1 19 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.035 2.385 25913
4153 1 19 . 1 1 24 24 LEU H H 24 8.521 8.521 8.707 -0.186 25913
4154 1 19 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.157 0.183 25913
4155 1 19 . 1 1 25 25 PRO C C 25 176.386 176.386 177.252 -0.866 25913
4156 1 19 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.845 -1.178 25913
4157 1 19 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.781 2.895 25913
4158 1 19 . 1 1 26 26 ASP N N 26 122.078 122.078 113.529 8.549 25913
4159 1 19 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.693 -0.306 25913
4160 1 19 . 1 1 26 26 ASP C C 26 175.321 175.321 175.673 -0.352 25913
4161 1 19 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.390 1.965 25913
4162 1 19 . 1 1 26 26 ASP CB C 26 41.066 41.066 42.109 -1.043 25913
4163 1 19 . 1 1 26 26 ASP H H 26 8.752 8.752 7.774 0.978 25913
4164 1 19 . 1 1 27 27 TYR N N 27 117.607 117.607 118.200 -0.593 25913
4165 1 19 . 1 1 27 27 TYR HA H 27 3.449 3.449 4.029 -0.580 25913
4166 1 19 . 1 1 27 27 TYR C C 27 173.074 173.074 174.240 -1.166 25913
4167 1 19 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.026 1.411 25913
4168 1 19 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.855 -0.795 25913
4169 1 19 . 1 1 27 27 TYR H H 27 8.666 8.666 8.065 0.601 25913
4170 1 19 . 1 1 28 28 ILE N N 28 111.804 111.804 112.361 -0.557 25913
4171 1 19 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.532 0.243 25913
4172 1 19 . 1 1 28 28 ILE C C 28 175.083 175.083 174.668 0.415 25913
4173 1 19 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.759 -1.190 25913
4174 1 19 . 1 1 28 28 ILE CB C 28 42.107 42.107 40.878 1.229 25913
4175 1 19 . 1 1 28 28 ILE H H 28 6.761 6.761 7.372 -0.611 25913
4176 1 19 . 1 1 29 29 CYS N N 29 126.875 126.875 118.902 7.973 25913
4177 1 19 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.769 -0.361 25913
4178 1 19 . 1 1 29 29 CYS C C 29 175.932 175.932 175.051 0.881 25913
4179 1 19 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.908 0.494 25913
4180 1 19 . 1 1 29 29 CYS CB C 29 32.214 32.214 28.034 4.180 25913
4181 1 19 . 1 1 29 29 CYS H H 29 8.783 8.783 8.751 0.032 25913
4182 1 19 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.477 -0.095 25913
4183 1 19 . 1 1 30 30 PRO C C 30 176.824 176.824 177.337 -0.513 25913
4184 1 19 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.409 -0.369 25913
4185 1 19 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.838 0.506 25913
4186 1 19 . 1 1 31 31 ARG N N 31 124.131 124.131 117.830 6.301 25913
4187 1 19 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.456 -0.155 25913
4188 1 19 . 1 1 31 31 ARG C C 31 177.721 177.721 177.212 0.509 25913
4189 1 19 . 1 1 31 31 ARG CA C 31 58.190 58.190 57.913 0.277 25913
4190 1 19 . 1 1 31 31 ARG CB C 31 31.682 31.682 30.904 0.778 25913
4191 1 19 . 1 1 31 31 ARG H H 31 9.604 9.604 7.684 1.920 25913
4192 1 19 . 1 1 32 32 CYS N N 32 119.758 119.758 114.144 5.614 25913
4193 1 19 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.838 0.001 25913
4194 1 19 . 1 1 32 32 CYS C C 32 176.450 176.450 174.507 1.943 25913
4195 1 19 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.558 1.152 25913
4196 1 19 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.062 4.168 25913
4197 1 19 . 1 1 32 32 CYS H H 32 8.549 8.549 7.791 0.758 25913
4198 1 19 . 1 1 33 33 GLU N N 33 118.109 118.109 119.636 -1.527 25913
4199 1 19 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.078 -0.000 25913
4200 1 19 . 1 1 33 33 GLU C C 33 174.739 174.739 176.027 -1.288 25913
4201 1 19 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.538 0.980 25913
4202 1 19 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.198 -0.506 25913
4203 1 19 . 1 1 33 33 GLU H H 33 7.868 7.868 8.150 -0.282 25913
4204 1 19 . 1 1 34 34 SER N N 34 117.224 117.224 114.895 2.329 25913
4205 1 19 . 1 1 34 34 SER HA H 34 4.437 4.437 4.503 -0.066 25913
4206 1 19 . 1 1 34 34 SER C C 34 175.392 175.392 175.496 -0.104 25913
4207 1 19 . 1 1 34 34 SER CA C 34 59.277 59.277 59.714 -0.437 25913
4208 1 19 . 1 1 34 34 SER CB C 34 65.429 65.429 64.500 0.929 25913
4209 1 19 . 1 1 34 34 SER H H 34 8.786 8.786 7.937 0.849 25913
4210 1 19 . 1 1 35 35 GLY N N 35 111.095 111.095 107.736 3.359 25913
4211 1 19 . 1 1 35 35 GLY C C 35 175.730 175.730 174.287 1.443 25913
4212 1 19 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.590 0.652 25913
4213 1 19 . 1 1 35 35 GLY H H 35 8.511 8.511 8.445 0.066 25913
4214 1 19 . 1 1 36 36 PHE N N 36 126.409 126.409 125.029 1.380 25913
4215 1 19 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.407 0.744 25913
4216 1 19 . 1 1 36 36 PHE C C 36 174.098 174.098 174.727 -0.629 25913
4217 1 19 . 1 1 36 36 PHE CA C 36 55.269 55.269 59.093 -3.824 25913
4218 1 19 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.619 -1.592 25913
4219 1 19 . 1 1 36 36 PHE H H 36 8.850 8.850 7.636 1.214 25913
4220 1 19 . 1 1 37 37 ILE N N 37 117.377 117.377 115.959 1.418 25913
4221 1 19 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.329 0.027 25913
4222 1 19 . 1 1 37 37 ILE C C 37 175.508 175.508 174.739 0.769 25913
4223 1 19 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.717 -0.030 25913
4224 1 19 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.548 -1.400 25913
4225 1 19 . 1 1 37 37 ILE H H 37 7.972 7.972 7.838 0.134 25913
4226 1 19 . 1 1 38 38 GLU N N 38 124.869 124.869 123.104 1.765 25913
4227 1 19 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.592 0.293 25913
4228 1 19 . 1 1 38 38 GLU C C 38 174.300 174.300 175.357 -1.057 25913
4229 1 19 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.877 -0.221 25913
4230 1 19 . 1 1 38 38 GLU CB C 38 34.589 34.589 32.436 2.153 25913
4231 1 19 . 1 1 38 38 GLU H H 38 9.131 9.131 8.877 0.254 25913
4232 1 19 . 1 1 39 39 GLU N N 39 127.840 127.840 126.801 1.039 25913
4233 1 19 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.241 0.607 25913
4234 1 19 . 1 1 39 39 GLU C C 39 175.507 175.507 175.558 -0.051 25913
4235 1 19 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.844 0.661 25913
4236 1 19 . 1 1 39 39 GLU CB C 39 30.249 30.249 29.118 1.131 25913
4237 1 19 . 1 1 39 39 GLU H H 39 8.844 8.844 8.639 0.205 25913
4238 1 20 . 1 1 0 0 SER HA H 0 4.525 4.525 4.559 -0.034 25913
4239 1 20 . 1 1 0 0 SER C C 0 174.776 174.776 175.130 -0.354 25913
4240 1 20 . 1 1 0 0 SER CA C 0 58.364 58.364 59.868 -1.504 25913
4241 1 20 . 1 1 0 0 SER CB C 0 64.049 64.049 63.609 0.440 25913
4242 1 20 . 1 1 1 1 MET N N 1 123.174 123.174 119.425 3.749 25913
4243 1 20 . 1 1 1 1 MET HA H 1 4.486 4.486 4.076 0.410 25913
4244 1 20 . 1 1 1 1 MET C C 1 176.177 176.177 175.338 0.839 25913
4245 1 20 . 1 1 1 1 MET CA C 1 55.804 55.804 56.741 -0.937 25913
4246 1 20 . 1 1 1 1 MET CB C 1 32.941 32.941 30.770 2.171 25913
4247 1 20 . 1 1 1 1 MET H H 1 8.592 8.592 8.639 -0.047 25913
4248 1 20 . 1 1 2 2 ALA N N 2 125.785 125.785 120.297 5.488 25913
4249 1 20 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.430 -0.137 25913
4250 1 20 . 1 1 2 2 ALA C C 2 177.812 177.812 177.477 0.335 25913
4251 1 20 . 1 1 2 2 ALA CA C 2 52.809 52.809 52.489 0.320 25913
4252 1 20 . 1 1 2 2 ALA CB C 2 19.224 19.224 20.265 -1.041 25913
4253 1 20 . 1 1 2 2 ALA H H 2 8.337 8.337 7.682 0.655 25913
4254 1 20 . 1 1 3 3 GLU N N 3 120.731 120.731 120.466 0.265 25913
4255 1 20 . 1 1 3 3 GLU HA H 3 4.256 4.256 4.275 -0.019 25913
4256 1 20 . 1 1 3 3 GLU C C 3 176.186 176.186 175.646 0.540 25913
4257 1 20 . 1 1 3 3 GLU CA C 3 56.377 56.377 56.131 0.246 25913
4258 1 20 . 1 1 3 3 GLU CB C 3 30.549 30.549 28.491 2.058 25913
4259 1 20 . 1 1 3 3 GLU H H 3 8.274 8.274 8.037 0.237 25913
4260 1 20 . 1 1 4 4 ALA N N 4 125.716 125.716 126.930 -1.214 25913
4261 1 20 . 1 1 4 4 ALA HA H 4 4.345 4.345 4.640 -0.295 25913
4262 1 20 . 1 1 4 4 ALA C C 4 177.530 177.530 176.641 0.889 25913
4263 1 20 . 1 1 4 4 ALA CA C 4 52.413 52.413 51.999 0.414 25913
4264 1 20 . 1 1 4 4 ALA CB C 4 19.466 19.466 19.809 -0.343 25913
4265 1 20 . 1 1 4 4 ALA H H 4 8.271 8.271 7.850 0.421 25913
4266 1 20 . 1 1 5 5 SER N N 5 117.161 117.161 115.318 1.843 25913
4267 1 20 . 1 1 5 5 SER HA H 5 4.724 4.724 4.714 0.010 25913
4268 1 20 . 1 1 5 5 SER C C 5 172.661 172.661 173.441 -0.780 25913
4269 1 20 . 1 1 5 5 SER CA C 5 56.354 56.354 55.605 0.749 25913
4270 1 20 . 1 1 5 5 SER CB C 5 63.442 63.442 63.550 -0.108 25913
4271 1 20 . 1 1 5 5 SER H H 5 8.259 8.259 7.600 0.659 25913
4272 1 20 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.426 -0.012 25913
4273 1 20 . 1 1 6 6 PRO C C 6 176.523 176.523 176.268 0.255 25913
4274 1 20 . 1 1 6 6 PRO CA C 6 63.385 63.385 64.025 -0.640 25913
4275 1 20 . 1 1 6 6 PRO CB C 6 32.187 32.187 32.244 -0.057 25913
4276 1 20 . 1 1 7 7 HIS N N 7 120.170 120.170 114.341 5.829 25913
4277 1 20 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.929 0.051 25913
4278 1 20 . 1 1 7 7 HIS C C 7 172.577 172.577 173.856 -1.279 25913
4279 1 20 . 1 1 7 7 HIS CA C 7 53.492 53.492 52.707 0.785 25913
4280 1 20 . 1 1 7 7 HIS CB C 7 29.133 29.133 29.614 -0.481 25913
4281 1 20 . 1 1 7 7 HIS H H 7 8.489 8.489 7.347 1.142 25913
4282 1 20 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.390 0.156 25913
4283 1 20 . 1 1 8 8 PRO C C 8 177.382 177.382 177.935 -0.553 25913
4284 1 20 . 1 1 8 8 PRO CA C 8 63.443 63.443 63.603 -0.160 25913
4285 1 20 . 1 1 8 8 PRO CB C 8 32.377 32.377 32.629 -0.252 25913
4286 1 20 . 1 1 9 9 GLY N N 9 110.263 110.263 106.246 4.017 25913
4287 1 20 . 1 1 9 9 GLY C C 9 172.859 172.859 173.680 -0.821 25913
4288 1 20 . 1 1 9 9 GLY CA C 9 45.211 45.211 45.180 0.031 25913
4289 1 20 . 1 1 9 9 GLY H H 9 8.635 8.635 8.555 0.080 25913
4290 1 20 . 1 1 10 10 ARG N N 10 121.025 121.025 123.203 -2.178 25913
4291 1 20 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.542 0.240 25913
4292 1 20 . 1 1 10 10 ARG C C 10 175.125 175.125 174.800 0.325 25913
4293 1 20 . 1 1 10 10 ARG CA C 10 55.356 55.356 56.487 -1.131 25913
4294 1 20 . 1 1 10 10 ARG CB C 10 32.982 32.982 29.067 3.914 25913
4295 1 20 . 1 1 10 10 ARG H H 10 8.229 8.229 8.105 0.124 25913
4296 1 20 . 1 1 11 11 TYR N N 11 121.353 121.353 123.695 -2.342 25913
4297 1 20 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.737 -0.409 25913
4298 1 20 . 1 1 11 11 TYR C C 11 174.229 174.229 174.731 -0.502 25913
4299 1 20 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.006 1.043 25913
4300 1 20 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.592 -0.541 25913
4301 1 20 . 1 1 11 11 TYR H H 11 8.692 8.692 9.343 -0.651 25913
4302 1 20 . 1 1 12 12 PHE N N 12 122.456 122.456 122.186 0.270 25913
4303 1 20 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.360 -0.476 25913
4304 1 20 . 1 1 12 12 PHE C C 12 174.224 174.224 174.803 -0.579 25913
4305 1 20 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.353 0.666 25913
4306 1 20 . 1 1 12 12 PHE CB C 12 44.078 44.078 42.009 2.069 25913
4307 1 20 . 1 1 12 12 PHE H H 12 9.415 9.415 9.121 0.294 25913
4308 1 20 . 1 1 13 13 CYS N N 13 128.438 128.438 128.580 -0.142 25913
4309 1 20 . 1 1 13 13 CYS HA H 13 4.653 4.653 4.962 -0.309 25913
4310 1 20 . 1 1 13 13 CYS C C 13 176.686 176.686 175.445 1.241 25913
4311 1 20 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.569 0.759 25913
4312 1 20 . 1 1 13 13 CYS CB C 13 31.220 31.220 27.909 3.311 25913
4313 1 20 . 1 1 13 13 CYS H H 13 7.942 7.942 8.792 -0.850 25913
4314 1 20 . 1 1 14 14 HIS N N 14 126.467 126.467 126.018 0.449 25913
4315 1 20 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.447 -0.124 25913
4316 1 20 . 1 1 14 14 HIS C C 14 175.452 175.452 176.732 -1.280 25913
4317 1 20 . 1 1 14 14 HIS CA C 14 58.736 58.736 58.624 0.112 25913
4318 1 20 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.350 -1.159 25913
4319 1 20 . 1 1 14 14 HIS H H 14 8.971 8.971 9.537 -0.566 25913
4320 1 20 . 1 1 15 15 CYS N N 15 123.882 123.882 118.524 5.358 25913
4321 1 20 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.271 0.171 25913
4322 1 20 . 1 1 15 15 CYS C C 15 176.939 176.939 176.248 0.691 25913
4323 1 20 . 1 1 15 15 CYS CA C 15 61.704 61.704 61.645 0.059 25913
4324 1 20 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.898 -0.557 25913
4325 1 20 . 1 1 15 15 CYS H H 15 9.195 9.195 8.231 0.964 25913
4326 1 20 . 1 1 16 16 CYS N N 16 124.898 124.898 121.418 3.480 25913
4327 1 20 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.461 -0.463 25913
4328 1 20 . 1 1 16 16 CYS C C 16 175.557 175.557 174.893 0.664 25913
4329 1 20 . 1 1 16 16 CYS CB C 16 30.961 30.961 27.153 3.808 25913
4330 1 20 . 1 1 16 16 CYS H H 16 9.794 9.794 8.150 1.644 25913
4331 1 20 . 1 1 17 17 SER N N 17 114.055 114.055 113.669 0.386 25913
4332 1 20 . 1 1 17 17 SER HA H 17 3.755 3.755 4.044 -0.289 25913
4333 1 20 . 1 1 17 17 SER C C 17 173.790 173.790 173.207 0.583 25913
4334 1 20 . 1 1 17 17 SER CA C 17 58.868 58.868 59.648 -0.780 25913
4335 1 20 . 1 1 17 17 SER CB C 17 61.703 61.703 60.435 1.268 25913
4336 1 20 . 1 1 17 17 SER H H 17 7.950 7.950 8.249 -0.299 25913
4337 1 20 . 1 1 18 18 VAL N N 18 111.916 111.916 112.098 -0.182 25913
4338 1 20 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.334 0.124 25913
4339 1 20 . 1 1 18 18 VAL C C 18 173.765 173.765 173.778 -0.013 25913
4340 1 20 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.130 -0.098 25913
4341 1 20 . 1 1 18 18 VAL CB C 18 36.667 36.667 35.387 1.280 25913
4342 1 20 . 1 1 18 18 VAL H H 18 6.438 6.438 6.978 -0.540 25913
4343 1 20 . 1 1 19 19 GLU N N 19 123.431 123.431 123.245 0.186 25913
4344 1 20 . 1 1 19 19 GLU HA H 19 5.023 5.023 5.159 -0.136 25913
4345 1 20 . 1 1 19 19 GLU C C 19 176.506 176.506 175.718 0.788 25913
4346 1 20 . 1 1 19 19 GLU CA C 19 56.818 56.818 56.329 0.489 25913
4347 1 20 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.694 -0.529 25913
4348 1 20 . 1 1 19 19 GLU H H 19 8.346 8.346 8.376 -0.030 25913
4349 1 20 . 1 1 20 20 ILE N N 20 117.751 117.751 122.164 -4.413 25913
4350 1 20 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.685 0.056 25913
4351 1 20 . 1 1 20 20 ILE C C 20 175.511 175.511 173.879 1.632 25913
4352 1 20 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.578 -0.633 25913
4353 1 20 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.867 2.800 25913
4354 1 20 . 1 1 20 20 ILE H H 20 8.537 8.537 8.968 -0.431 25913
4355 1 20 . 1 1 21 21 VAL N N 21 124.220 124.220 121.707 2.513 25913
4356 1 20 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.192 -0.606 25913
4357 1 20 . 1 1 21 21 VAL C C 21 174.640 174.640 174.076 0.564 25913
4358 1 20 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.847 1.871 25913
4359 1 20 . 1 1 21 21 VAL CB C 21 32.503 32.503 33.501 -0.998 25913
4360 1 20 . 1 1 21 21 VAL H H 21 8.203 8.203 8.366 -0.163 25913
4361 1 20 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.694 -0.635 25913
4362 1 20 . 1 1 22 22 PRO C C 22 175.352 175.352 176.147 -0.795 25913
4363 1 20 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.628 0.033 25913
4364 1 20 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.245 -0.231 25913
4365 1 20 . 1 1 23 23 ARG N N 23 121.370 121.370 123.024 -1.654 25913
4366 1 20 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.187 0.068 25913
4367 1 20 . 1 1 23 23 ARG C C 23 175.759 175.759 176.626 -0.867 25913
4368 1 20 . 1 1 23 23 ARG CA C 23 56.052 56.052 56.053 -0.001 25913
4369 1 20 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.202 1.684 25913
4370 1 20 . 1 1 23 23 ARG H H 23 8.635 8.635 8.155 0.480 25913
4371 1 20 . 1 1 24 24 LEU N N 24 127.914 127.914 128.553 -0.639 25913
4372 1 20 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.731 0.442 25913
4373 1 20 . 1 1 24 24 LEU C C 24 175.774 175.774 175.806 -0.032 25913
4374 1 20 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.087 -5.149 25913
4375 1 20 . 1 1 24 24 LEU CB C 24 41.420 41.420 38.834 2.586 25913
4376 1 20 . 1 1 24 24 LEU H H 24 8.521 8.521 8.736 -0.215 25913
4377 1 20 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.145 0.195 25913
4378 1 20 . 1 1 25 25 PRO C C 25 176.386 176.386 176.802 -0.416 25913
4379 1 20 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.505 -0.838 25913
4380 1 20 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.793 2.883 25913
4381 1 20 . 1 1 26 26 ASP N N 26 122.078 122.078 114.966 7.112 25913
4382 1 20 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.707 -0.320 25913
4383 1 20 . 1 1 26 26 ASP C C 26 175.321 175.321 175.499 -0.178 25913
4384 1 20 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.115 2.240 25913
4385 1 20 . 1 1 26 26 ASP CB C 26 41.066 41.066 42.798 -1.732 25913
4386 1 20 . 1 1 26 26 ASP H H 26 8.752 8.752 7.633 1.119 25913
4387 1 20 . 1 1 27 27 TYR N N 27 117.607 117.607 116.942 0.665 25913
4388 1 20 . 1 1 27 27 TYR HA H 27 3.449 3.449 3.958 -0.509 25913
4389 1 20 . 1 1 27 27 TYR C C 27 173.074 173.074 174.374 -1.300 25913
4390 1 20 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.235 1.202 25913
4391 1 20 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.648 -0.588 25913
4392 1 20 . 1 1 27 27 TYR H H 27 8.666 8.666 7.967 0.699 25913
4393 1 20 . 1 1 28 28 ILE N N 28 111.804 111.804 113.152 -1.348 25913
4394 1 20 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.475 0.300 25913
4395 1 20 . 1 1 28 28 ILE C C 28 175.083 175.083 174.725 0.358 25913
4396 1 20 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.147 -0.578 25913
4397 1 20 . 1 1 28 28 ILE CB C 28 42.107 42.107 41.131 0.976 25913
4398 1 20 . 1 1 28 28 ILE H H 28 6.761 6.761 7.342 -0.581 25913
4399 1 20 . 1 1 29 29 CYS N N 29 126.875 126.875 119.028 7.847 25913
4400 1 20 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.759 -0.351 25913
4401 1 20 . 1 1 29 29 CYS C C 29 175.932 175.932 175.241 0.691 25913
4402 1 20 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.821 0.581 25913
4403 1 20 . 1 1 29 29 CYS CB C 29 32.214 32.214 27.918 4.296 25913
4404 1 20 . 1 1 29 29 CYS H H 29 8.783 8.783 8.781 0.002 25913
4405 1 20 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.390 -0.008 25913
4406 1 20 . 1 1 30 30 PRO C C 30 176.824 176.824 177.917 -1.093 25913
4407 1 20 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.775 -0.735 25913
4408 1 20 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.942 0.402 25913
4409 1 20 . 1 1 31 31 ARG N N 31 124.131 124.131 117.600 6.531 25913
4410 1 20 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.411 -0.110 25913
4411 1 20 . 1 1 31 31 ARG C C 31 177.721 177.721 177.273 0.448 25913
4412 1 20 . 1 1 31 31 ARG CA C 31 58.190 58.190 58.357 -0.167 25913
4413 1 20 . 1 1 31 31 ARG CB C 31 31.682 31.682 30.590 1.092 25913
4414 1 20 . 1 1 31 31 ARG H H 31 9.604 9.604 7.792 1.812 25913
4415 1 20 . 1 1 32 32 CYS N N 32 119.758 119.758 113.443 6.315 25913
4416 1 20 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.835 0.004 25913
4417 1 20 . 1 1 32 32 CYS C C 32 176.450 176.450 174.466 1.984 25913
4418 1 20 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.463 1.247 25913
4419 1 20 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.066 4.164 25913
4420 1 20 . 1 1 32 32 CYS H H 32 8.549 8.549 7.755 0.794 25913
4421 1 20 . 1 1 33 33 GLU N N 33 118.109 118.109 119.942 -1.833 25913
4422 1 20 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.098 -0.020 25913
4423 1 20 . 1 1 33 33 GLU C C 33 174.739 174.739 175.998 -1.259 25913
4424 1 20 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.446 1.072 25913
4425 1 20 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.129 -0.437 25913
4426 1 20 . 1 1 33 33 GLU H H 33 7.868 7.868 8.210 -0.342 25913
4427 1 20 . 1 1 34 34 SER N N 34 117.224 117.224 114.913 2.311 25913
4428 1 20 . 1 1 34 34 SER HA H 34 4.437 4.437 4.450 -0.013 25913
4429 1 20 . 1 1 34 34 SER C C 34 175.392 175.392 175.596 -0.204 25913
4430 1 20 . 1 1 34 34 SER CA C 34 59.277 59.277 59.959 -0.682 25913
4431 1 20 . 1 1 34 34 SER CB C 34 65.429 65.429 64.272 1.157 25913
4432 1 20 . 1 1 34 34 SER H H 34 8.786 8.786 8.115 0.671 25913
4433 1 20 . 1 1 35 35 GLY N N 35 111.095 111.095 107.948 3.147 25913
4434 1 20 . 1 1 35 35 GLY C C 35 175.730 175.730 174.678 1.052 25913
4435 1 20 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.703 0.539 25913
4436 1 20 . 1 1 35 35 GLY H H 35 8.511 8.511 8.421 0.090 25913
4437 1 20 . 1 1 36 36 PHE N N 36 126.409 126.409 125.470 0.939 25913
4438 1 20 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.436 0.715 25913
4439 1 20 . 1 1 36 36 PHE C C 36 174.098 174.098 174.216 -0.118 25913
4440 1 20 . 1 1 36 36 PHE CA C 36 55.269 55.269 59.123 -3.853 25913
4441 1 20 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.250 -1.223 25913
4442 1 20 . 1 1 36 36 PHE H H 36 8.850 8.850 7.750 1.100 25913
4443 1 20 . 1 1 37 37 ILE N N 37 117.377 117.377 115.813 1.564 25913
4444 1 20 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.314 0.042 25913
4445 1 20 . 1 1 37 37 ILE C C 37 175.508 175.508 174.881 0.627 25913
4446 1 20 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.438 0.249 25913
4447 1 20 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.574 -1.426 25913
4448 1 20 . 1 1 37 37 ILE H H 37 7.972 7.972 7.790 0.182 25913
4449 1 20 . 1 1 38 38 GLU N N 38 124.869 124.869 122.341 2.528 25913
4450 1 20 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.581 0.304 25913
4451 1 20 . 1 1 38 38 GLU C C 38 174.300 174.300 175.233 -0.933 25913
4452 1 20 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.029 0.627 25913
4453 1 20 . 1 1 38 38 GLU CB C 38 34.589 34.589 31.872 2.717 25913
4454 1 20 . 1 1 38 38 GLU H H 38 9.131 9.131 8.761 0.370 25913
4455 1 20 . 1 1 39 39 GLU N N 39 127.840 127.840 126.798 1.042 25913
4456 1 20 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.456 0.392 25913
4457 1 20 . 1 1 39 39 GLU C C 39 175.507 175.507 175.622 -0.115 25913
4458 1 20 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.408 1.097 25913
4459 1 20 . 1 1 39 39 GLU CB C 39 30.249 30.249 29.208 1.041 25913
4460 1 20 . 1 1 39 39 GLU H H 39 8.844 8.844 8.588 0.256 25913
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 34 3.300 -1.684 2.881 25913
2 1 1 "Average Difference" HA 42 0.348 0.001 0.352 25913
3 1 1 "Average Difference" C 40 0.917 -0.018 0.928 25913
4 1 1 "Average Difference" CA 39 1.603 0.213 1.610 25913
5 1 1 "Average Difference" CB 38 1.946 -1.008 1.687 25913
6 1 1 "Average Difference" HN 34 0.694 -0.201 0.675 25913
7 1 2 "Average Difference" N 34 3.332 -1.582 2.977 25913
8 1 2 "Average Difference" HA 42 0.353 0.027 0.357 25913
9 1 2 "Average Difference" C 40 0.851 -0.137 0.851 25913
10 1 2 "Average Difference" CA 39 1.344 0.117 1.357 25913
11 1 2 "Average Difference" CB 38 1.879 -0.931 1.654 25913
12 1 2 "Average Difference" HN 34 0.691 -0.183 0.676 25913
13 1 3 "Average Difference" N 34 3.259 -1.350 3.011 25913
14 1 3 "Average Difference" HA 42 0.348 0.014 0.352 25913
15 1 3 "Average Difference" C 40 0.847 -0.077 0.855 25913
16 1 3 "Average Difference" CA 39 1.421 0.052 1.439 25913
17 1 3 "Average Difference" CB 38 1.871 -0.840 1.694 25913
18 1 3 "Average Difference" HN 34 0.693 -0.212 0.670 25913
19 1 4 "Average Difference" N 34 3.355 -1.470 3.061 25913
20 1 4 "Average Difference" HA 42 0.353 0.044 0.355 25913
21 1 4 "Average Difference" C 40 0.873 -0.112 0.877 25913
22 1 4 "Average Difference" CA 39 1.345 0.091 1.359 25913
23 1 4 "Average Difference" CB 38 1.782 -0.820 1.604 25913
24 1 4 "Average Difference" HN 34 0.697 -0.191 0.680 25913
25 1 5 "Average Difference" N 34 3.342 -1.627 2.963 25913
26 1 5 "Average Difference" HA 42 0.339 0.063 0.337 25913
27 1 5 "Average Difference" C 40 0.860 -0.117 0.862 25913
28 1 5 "Average Difference" CA 39 1.281 0.076 1.295 25913
29 1 5 "Average Difference" CB 38 1.835 -0.733 1.705 25913
30 1 5 "Average Difference" HN 34 0.654 -0.202 0.631 25913
31 1 6 "Average Difference" N 34 3.134 -0.990 3.018 25913
32 1 6 "Average Difference" HA 42 0.331 0.051 0.331 25913
33 1 6 "Average Difference" C 40 0.852 -0.107 0.856 25913
34 1 6 "Average Difference" CA 39 1.291 0.014 1.308 25913
35 1 6 "Average Difference" CB 38 1.917 -0.809 1.762 25913
36 1 6 "Average Difference" HN 34 0.653 -0.183 0.636 25913
37 1 7 "Average Difference" N 34 3.380 -1.675 2.980 25913
38 1 7 "Average Difference" HA 42 0.349 0.045 0.351 25913
39 1 7 "Average Difference" C 40 0.879 0.011 0.890 25913
40 1 7 "Average Difference" CA 39 1.461 0.151 1.472 25913
41 1 7 "Average Difference" CB 38 1.857 -0.911 1.640 25913
42 1 7 "Average Difference" HN 34 0.715 -0.244 0.682 25913
43 1 8 "Average Difference" N 34 3.035 -1.402 2.732 25913
44 1 8 "Average Difference" HA 42 0.356 0.035 0.359 25913
45 1 8 "Average Difference" C 40 0.888 -0.095 0.894 25913
46 1 8 "Average Difference" CA 39 1.435 0.140 1.447 25913
47 1 8 "Average Difference" CB 38 1.917 -0.830 1.751 25913
48 1 8 "Average Difference" HN 34 0.698 -0.181 0.685 25913
49 1 9 "Average Difference" N 34 3.804 -1.859 3.368 25913
50 1 9 "Average Difference" HA 42 0.355 0.022 0.358 25913
51 1 9 "Average Difference" C 40 0.936 -0.232 0.918 25913
52 1 9 "Average Difference" CA 39 1.337 0.102 1.351 25913
53 1 9 "Average Difference" CB 38 1.782 -0.889 1.565 25913
54 1 9 "Average Difference" HN 34 0.703 -0.230 0.674 25913
55 1 10 "Average Difference" N 34 3.431 -1.847 2.935 25913
56 1 10 "Average Difference" HA 42 0.346 0.041 0.348 25913
57 1 10 "Average Difference" C 40 0.832 -0.115 0.834 25913
58 1 10 "Average Difference" CA 39 1.240 -0.036 1.255 25913
59 1 10 "Average Difference" CB 38 1.889 -0.822 1.724 25913
60 1 10 "Average Difference" HN 34 0.705 -0.250 0.669 25913
61 1 11 "Average Difference" N 34 3.404 -1.925 2.850 25913
62 1 11 "Average Difference" HA 42 0.338 0.027 0.341 25913
63 1 11 "Average Difference" C 40 0.820 -0.062 0.828 25913
64 1 11 "Average Difference" CA 39 1.414 -0.008 1.433 25913
65 1 11 "Average Difference" CB 38 1.951 -0.952 1.725 25913
66 1 11 "Average Difference" HN 34 0.714 -0.230 0.687 25913
67 1 12 "Average Difference" N 34 3.296 -1.768 2.823 25913
68 1 12 "Average Difference" HA 42 0.359 0.021 0.363 25913
69 1 12 "Average Difference" C 40 0.873 -0.046 0.883 25913
70 1 12 "Average Difference" CA 39 1.365 0.082 1.380 25913
71 1 12 "Average Difference" CB 38 1.893 -0.845 1.717 25913
72 1 12 "Average Difference" HN 34 0.681 -0.215 0.656 25913
73 1 13 "Average Difference" N 34 3.429 -1.722 3.010 25913
74 1 13 "Average Difference" HA 42 0.358 0.037 0.360 25913
75 1 13 "Average Difference" C 40 0.906 -0.163 0.903 25913
76 1 13 "Average Difference" CA 39 1.411 0.102 1.426 25913
77 1 13 "Average Difference" CB 38 1.868 -0.779 1.720 25913
78 1 13 "Average Difference" HN 34 0.687 -0.259 0.645 25913
79 1 14 "Average Difference" N 34 3.726 -2.104 3.121 25913
80 1 14 "Average Difference" HA 42 0.334 0.014 0.337 25913
81 1 14 "Average Difference" C 40 0.852 -0.148 0.850 25913
82 1 14 "Average Difference" CA 39 1.286 0.097 1.299 25913
83 1 14 "Average Difference" CB 38 1.843 -0.798 1.684 25913
84 1 14 "Average Difference" HN 34 0.733 -0.295 0.681 25913
85 1 15 "Average Difference" N 34 3.396 -1.698 2.985 25913
86 1 15 "Average Difference" HA 42 0.342 0.036 0.344 25913
87 1 15 "Average Difference" C 40 0.859 -0.141 0.858 25913
88 1 15 "Average Difference" CA 39 1.398 0.071 1.414 25913
89 1 15 "Average Difference" CB 38 1.850 -0.996 1.579 25913
90 1 15 "Average Difference" HN 34 0.691 -0.180 0.677 25913
91 1 16 "Average Difference" N 34 3.303 -1.657 2.900 25913
92 1 16 "Average Difference" HA 42 0.369 0.025 0.372 25913
93 1 16 "Average Difference" C 40 0.861 -0.150 0.858 25913
94 1 16 "Average Difference" CA 39 1.418 0.138 1.430 25913
95 1 16 "Average Difference" CB 38 1.846 -0.859 1.656 25913
96 1 16 "Average Difference" HN 34 0.706 -0.170 0.695 25913
97 1 17 "Average Difference" N 34 3.246 -1.589 2.873 25913
98 1 17 "Average Difference" HA 42 0.355 0.077 0.350 25913
99 1 17 "Average Difference" C 40 0.895 -0.161 0.891 25913
100 1 17 "Average Difference" CA 39 1.314 0.078 1.329 25913
101 1 17 "Average Difference" CB 38 1.817 -0.670 1.712 25913
102 1 17 "Average Difference" HN 34 0.672 -0.174 0.659 25913
103 1 18 "Average Difference" N 34 3.660 -1.891 3.181 25913
104 1 18 "Average Difference" HA 42 0.345 0.047 0.346 25913
105 1 18 "Average Difference" C 40 0.854 -0.138 0.853 25913
106 1 18 "Average Difference" CA 39 1.366 0.174 1.372 25913
107 1 18 "Average Difference" CB 38 1.820 -0.822 1.646 25913
108 1 18 "Average Difference" HN 34 0.722 -0.195 0.705 25913
109 1 19 "Average Difference" N 34 3.482 -1.809 3.020 25913
110 1 19 "Average Difference" HA 42 0.375 0.067 0.374 25913
111 1 19 "Average Difference" C 40 0.904 -0.178 0.897 25913
112 1 19 "Average Difference" CA 39 1.437 0.074 1.454 25913
113 1 19 "Average Difference" CB 38 1.924 -0.676 1.826 25913
114 1 19 "Average Difference" HN 34 0.710 -0.222 0.685 25913
115 1 20 "Average Difference" N 34 3.456 -1.703 3.053 25913
116 1 20 "Average Difference" HA 42 0.320 0.021 0.324 25913
117 1 20 "Average Difference" C 40 0.826 -0.026 0.836 25913
118 1 20 "Average Difference" CA 39 1.322 0.037 1.338 25913
119 1 20 "Average Difference" CB 38 1.939 -0.906 1.738 25913
120 1 20 "Average Difference" HN 34 0.696 -0.267 0.653 25913
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 25913
_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 0 0 SER HA H 0 4.525 4.525 4.522 0.003 25913
2 1 . 1 1 0 0 SER C C 0 174.776 174.776 174.720 0.056 25913
3 1 . 1 1 0 0 SER CA C 0 58.364 58.364 58.724 -0.360 25913
4 1 . 1 1 0 0 SER CB C 0 64.049 64.049 63.753 0.296 25913
5 1 . 1 1 1 1 MET N N 1 123.174 123.174 121.184 1.990 25913
6 1 . 1 1 1 1 MET HA H 1 4.486 4.486 4.434 0.052 25913
7 1 . 1 1 1 1 MET C C 1 176.177 176.177 175.608 0.569 25913
8 1 . 1 1 1 1 MET CA C 1 55.804 55.804 55.825 -0.021 25913
9 1 . 1 1 1 1 MET CB C 1 32.941 32.941 32.119 0.822 25913
10 1 . 1 1 1 1 MET H H 1 8.592 8.592 8.373 0.219 25913
11 1 . 1 1 2 2 ALA N N 2 125.785 125.785 123.155 2.630 25913
12 1 . 1 1 2 2 ALA HA H 2 4.293 4.293 4.455 -0.162 25913
13 1 . 1 1 2 2 ALA C C 2 177.812 177.812 177.433 0.379 25913
14 1 . 1 1 2 2 ALA CA C 2 52.809 52.809 52.376 0.433 25913
15 1 . 1 1 2 2 ALA CB C 2 19.224 19.224 19.283 -0.059 25913
16 1 . 1 1 2 2 ALA H H 2 8.337 8.337 8.128 0.209 25913
17 1 . 1 1 3 3 GLU N N 3 120.731 120.731 118.954 1.777 25913
18 1 . 1 1 3 3 GLU HA H 3 4.256 4.256 4.226 0.030 25913
19 1 . 1 1 3 3 GLU C C 3 176.186 176.186 176.254 -0.068 25913
20 1 . 1 1 3 3 GLU CA C 3 56.377 56.377 57.022 -0.645 25913
21 1 . 1 1 3 3 GLU CB C 3 30.549 30.549 29.355 1.194 25913
22 1 . 1 1 3 3 GLU H H 3 8.274 8.274 8.230 0.044 25913
23 1 . 1 1 4 4 ALA N N 4 125.716 125.716 123.115 2.601 25913
24 1 . 1 1 4 4 ALA HA H 4 4.345 4.345 4.366 -0.021 25913
25 1 . 1 1 4 4 ALA C C 4 177.530 177.530 177.014 0.516 25913
26 1 . 1 1 4 4 ALA CA C 4 52.413 52.413 52.626 -0.213 25913
27 1 . 1 1 4 4 ALA CB C 4 19.466 19.466 19.004 0.462 25913
28 1 . 1 1 4 4 ALA H H 4 8.271 8.271 8.124 0.147 25913
29 1 . 1 1 5 5 SER N N 5 117.161 117.161 115.677 1.484 25913
30 1 . 1 1 5 5 SER HA H 5 4.724 4.724 4.627 0.097 25913
31 1 . 1 1 5 5 SER C C 5 172.661 172.661 172.925 -0.264 25913
32 1 . 1 1 5 5 SER CA C 5 56.354 56.354 57.467 -1.113 25913
33 1 . 1 1 5 5 SER CB C 5 63.442 63.442 63.256 0.186 25913
34 1 . 1 1 5 5 SER H H 5 8.259 8.259 8.197 0.062 25913
35 1 . 1 1 6 6 PRO HA H 6 4.414 4.414 4.519 -0.105 25913
36 1 . 1 1 6 6 PRO C C 6 176.523 176.523 175.825 0.698 25913
37 1 . 1 1 6 6 PRO CA C 6 63.385 63.385 63.432 -0.047 25913
38 1 . 1 1 6 6 PRO CB C 6 32.187 32.187 31.652 0.535 25913
39 1 . 1 1 7 7 HIS N N 7 120.170 120.170 118.538 1.632 25913
40 1 . 1 1 7 7 HIS HA H 7 4.980 4.980 4.797 0.183 25913
41 1 . 1 1 7 7 HIS C C 7 172.577 172.577 173.266 -0.689 25913
42 1 . 1 1 7 7 HIS CA C 7 53.492 53.492 53.695 -0.203 25913
43 1 . 1 1 7 7 HIS CB C 7 29.133 29.133 29.972 -0.839 25913
44 1 . 1 1 7 7 HIS H H 7 8.489 8.489 7.839 0.650 25913
45 1 . 1 1 8 8 PRO HA H 8 4.546 4.546 4.554 -0.008 25913
46 1 . 1 1 8 8 PRO C C 8 177.382 177.382 176.428 0.954 25913
47 1 . 1 1 8 8 PRO CA C 8 63.443 63.443 63.095 0.348 25913
48 1 . 1 1 8 8 PRO CB C 8 32.377 32.377 32.671 -0.294 25913
49 1 . 1 1 9 9 GLY N N 9 110.263 110.263 108.678 1.585 25913
50 1 . 1 1 9 9 GLY C C 9 172.859 172.859 173.364 -0.505 25913
51 1 . 1 1 9 9 GLY CA C 9 45.211 45.211 45.970 -0.759 25913
52 1 . 1 1 9 9 GLY H H 9 8.635 8.635 8.857 -0.222 25913
53 1 . 1 1 10 10 ARG N N 10 121.025 121.025 123.124 -2.099 25913
54 1 . 1 1 10 10 ARG HA H 10 4.782 4.782 4.739 0.043 25913
55 1 . 1 1 10 10 ARG C C 10 175.125 175.125 174.865 0.261 25913
56 1 . 1 1 10 10 ARG CA C 10 55.356 55.356 56.163 -0.807 25913
57 1 . 1 1 10 10 ARG CB C 10 32.982 32.982 29.228 3.753 25913
58 1 . 1 1 10 10 ARG H H 10 8.229 8.229 8.001 0.228 25913
59 1 . 1 1 11 11 TYR N N 11 121.353 121.353 123.677 -2.324 25913
60 1 . 1 1 11 11 TYR HA H 11 5.328 5.328 5.669 -0.341 25913
61 1 . 1 1 11 11 TYR C C 11 174.229 174.229 174.748 -0.519 25913
62 1 . 1 1 11 11 TYR CA C 11 57.049 57.049 56.102 0.947 25913
63 1 . 1 1 11 11 TYR CB C 11 43.051 43.051 43.481 -0.430 25913
64 1 . 1 1 11 11 TYR H H 11 8.692 8.692 9.357 -0.665 25913
65 1 . 1 1 12 12 PHE N N 12 122.456 122.456 122.096 0.360 25913
66 1 . 1 1 12 12 PHE HA H 12 4.884 4.884 5.320 -0.436 25913
67 1 . 1 1 12 12 PHE C C 12 174.224 174.224 174.782 -0.558 25913
68 1 . 1 1 12 12 PHE CA C 12 57.019 57.019 56.426 0.593 25913
69 1 . 1 1 12 12 PHE CB C 12 44.078 44.078 41.994 2.084 25913
70 1 . 1 1 12 12 PHE H H 12 9.415 9.415 9.047 0.368 25913
71 1 . 1 1 13 13 CYS N N 13 128.438 128.438 128.469 -0.031 25913
72 1 . 1 1 13 13 CYS HA H 13 4.653 4.653 5.007 -0.354 25913
73 1 . 1 1 13 13 CYS C C 13 176.686 176.686 175.341 1.344 25913
74 1 . 1 1 13 13 CYS CA C 13 58.328 58.328 57.634 0.694 25913
75 1 . 1 1 13 13 CYS CB C 13 31.220 31.220 28.122 3.098 25913
76 1 . 1 1 13 13 CYS H H 13 7.942 7.942 8.902 -0.960 25913
77 1 . 1 1 14 14 HIS N N 14 126.467 126.467 125.951 0.516 25913
78 1 . 1 1 14 14 HIS HA H 14 4.323 4.323 4.588 -0.265 25913
79 1 . 1 1 14 14 HIS C C 14 175.452 175.452 176.352 -0.900 25913
80 1 . 1 1 14 14 HIS CA C 14 58.736 58.736 58.239 0.496 25913
81 1 . 1 1 14 14 HIS CB C 14 29.191 29.191 30.579 -1.388 25913
82 1 . 1 1 14 14 HIS H H 14 8.971 8.971 9.524 -0.553 25913
83 1 . 1 1 15 15 CYS N N 15 123.882 123.882 118.003 5.879 25913
84 1 . 1 1 15 15 CYS HA H 15 4.442 4.442 4.329 0.113 25913
85 1 . 1 1 15 15 CYS C C 15 176.939 176.939 175.938 1.001 25913
86 1 . 1 1 15 15 CYS CA C 15 61.704 61.704 61.528 0.176 25913
87 1 . 1 1 15 15 CYS CB C 15 28.341 28.341 28.674 -0.333 25913
88 1 . 1 1 15 15 CYS H H 15 9.195 9.195 8.240 0.955 25913
89 1 . 1 1 16 16 CYS N N 16 124.898 124.898 119.692 5.206 25913
90 1 . 1 1 16 16 CYS HA H 16 3.998 3.998 4.547 -0.549 25913
91 1 . 1 1 16 16 CYS C C 16 175.557 175.557 174.586 0.971 25913
92 1 . 1 1 16 16 CYS CB C 16 30.961 30.961 27.720 3.241 25913
93 1 . 1 1 16 16 CYS H H 16 9.794 9.794 7.997 1.797 25913
94 1 . 1 1 17 17 SER N N 17 114.055 114.055 114.076 -0.021 25913
95 1 . 1 1 17 17 SER HA H 17 3.755 3.755 4.095 -0.340 25913
96 1 . 1 1 17 17 SER C C 17 173.790 173.790 173.237 0.553 25913
97 1 . 1 1 17 17 SER CA C 17 58.868 58.868 59.498 -0.630 25913
98 1 . 1 1 17 17 SER CB C 17 61.703 61.703 60.575 1.128 25913
99 1 . 1 1 17 17 SER H H 17 7.950 7.950 8.117 -0.167 25913
100 1 . 1 1 18 18 VAL N N 18 111.916 111.916 112.448 -0.532 25913
101 1 . 1 1 18 18 VAL HA H 18 4.458 4.458 4.278 0.180 25913
102 1 . 1 1 18 18 VAL C C 18 173.765 173.765 173.586 0.179 25913
103 1 . 1 1 18 18 VAL CA C 18 59.032 59.032 59.285 -0.253 25913
104 1 . 1 1 18 18 VAL CB C 18 36.667 36.667 35.266 1.401 25913
105 1 . 1 1 18 18 VAL H H 18 6.438 6.438 6.988 -0.550 25913
106 1 . 1 1 19 19 GLU N N 19 123.431 123.431 122.220 1.211 25913
107 1 . 1 1 19 19 GLU HA H 19 5.023 5.023 5.049 -0.026 25913
108 1 . 1 1 19 19 GLU C C 19 176.506 176.506 175.994 0.512 25913
109 1 . 1 1 19 19 GLU CA C 19 56.818 56.818 56.227 0.591 25913
110 1 . 1 1 19 19 GLU CB C 19 30.165 30.165 30.564 -0.399 25913
111 1 . 1 1 19 19 GLU H H 19 8.346 8.346 8.381 -0.035 25913
112 1 . 1 1 20 20 ILE N N 20 117.751 117.751 121.008 -3.257 25913
113 1 . 1 1 20 20 ILE HA H 20 4.741 4.741 4.711 0.030 25913
114 1 . 1 1 20 20 ILE C C 20 175.511 175.511 173.888 1.623 25913
115 1 . 1 1 20 20 ILE CA C 20 58.945 58.945 59.401 -0.456 25913
116 1 . 1 1 20 20 ILE CB C 20 44.667 44.667 41.782 2.885 25913
117 1 . 1 1 20 20 ILE H H 20 8.537 8.537 8.973 -0.436 25913
118 1 . 1 1 21 21 VAL N N 21 124.220 124.220 122.006 2.214 25913
119 1 . 1 1 21 21 VAL HA H 21 4.586 4.586 5.191 -0.605 25913
120 1 . 1 1 21 21 VAL C C 21 174.640 174.640 174.086 0.554 25913
121 1 . 1 1 21 21 VAL CA C 21 59.718 59.718 57.819 1.899 25913
122 1 . 1 1 21 21 VAL CB C 21 32.503 32.503 33.405 -0.902 25913
123 1 . 1 1 21 21 VAL H H 21 8.203 8.203 8.374 -0.171 25913
124 1 . 1 1 22 22 PRO HA H 22 4.059 4.059 4.663 -0.604 25913
125 1 . 1 1 22 22 PRO C C 22 175.352 175.352 176.125 -0.773 25913
126 1 . 1 1 22 22 PRO CA C 22 62.661 62.661 62.601 0.060 25913
127 1 . 1 1 22 22 PRO CB C 22 32.014 32.014 32.353 -0.339 25913
128 1 . 1 1 23 23 ARG N N 23 121.370 121.370 122.696 -1.326 25913
129 1 . 1 1 23 23 ARG HA H 23 4.255 4.255 4.218 0.037 25913
130 1 . 1 1 23 23 ARG C C 23 175.759 175.759 176.689 -0.930 25913
131 1 . 1 1 23 23 ARG CA C 23 56.052 56.052 56.058 -0.006 25913
132 1 . 1 1 23 23 ARG CB C 23 30.886 30.886 29.208 1.678 25913
133 1 . 1 1 23 23 ARG H H 23 8.635 8.635 8.140 0.495 25913
134 1 . 1 1 24 24 LEU N N 24 127.914 127.914 127.279 0.635 25913
135 1 . 1 1 24 24 LEU HA H 24 4.173 4.173 3.742 0.431 25913
136 1 . 1 1 24 24 LEU C C 24 175.774 175.774 175.985 -0.211 25913
137 1 . 1 1 24 24 LEU CA C 24 52.938 52.938 58.492 -5.554 25913
138 1 . 1 1 24 24 LEU CB C 24 41.420 41.420 39.141 2.279 25913
139 1 . 1 1 24 24 LEU H H 24 8.521 8.521 8.662 -0.141 25913
140 1 . 1 1 25 25 PRO HA H 25 4.340 4.340 4.164 0.176 25913
141 1 . 1 1 25 25 PRO C C 25 176.386 176.386 177.026 -0.640 25913
142 1 . 1 1 25 25 PRO CA C 25 63.667 63.667 64.568 -0.901 25913
143 1 . 1 1 25 25 PRO CB C 25 34.676 34.676 31.741 2.935 25913
144 1 . 1 1 26 26 ASP N N 26 122.078 122.078 114.920 7.158 25913
145 1 . 1 1 26 26 ASP HA H 26 4.387 4.387 4.675 -0.288 25913
146 1 . 1 1 26 26 ASP C C 26 175.321 175.321 175.882 -0.561 25913
147 1 . 1 1 26 26 ASP CA C 26 56.355 56.355 54.339 2.016 25913
148 1 . 1 1 26 26 ASP CB C 26 41.066 41.066 42.907 -1.841 25913
149 1 . 1 1 26 26 ASP H H 26 8.752 8.752 7.703 1.049 25913
150 1 . 1 1 27 27 TYR N N 27 117.607 117.607 117.549 0.058 25913
151 1 . 1 1 27 27 TYR HA H 27 3.449 3.449 3.990 -0.541 25913
152 1 . 1 1 27 27 TYR C C 27 173.074 173.074 174.332 -1.258 25913
153 1 . 1 1 27 27 TYR CA C 27 60.437 60.437 59.302 1.135 25913
154 1 . 1 1 27 27 TYR CB C 27 35.060 35.060 35.758 -0.698 25913
155 1 . 1 1 27 27 TYR H H 27 8.666 8.666 8.092 0.574 25913
156 1 . 1 1 28 28 ILE N N 28 111.804 111.804 112.685 -0.881 25913
157 1 . 1 1 28 28 ILE HA H 28 4.775 4.775 4.506 0.269 25913
158 1 . 1 1 28 28 ILE C C 28 175.083 175.083 174.613 0.470 25913
159 1 . 1 1 28 28 ILE CA C 28 57.569 57.569 58.343 -0.774 25913
160 1 . 1 1 28 28 ILE CB C 28 42.107 42.107 41.166 0.941 25913
161 1 . 1 1 28 28 ILE H H 28 6.761 6.761 7.308 -0.547 25913
162 1 . 1 1 29 29 CYS N N 29 126.875 126.875 118.886 7.989 25913
163 1 . 1 1 29 29 CYS HA H 29 4.408 4.408 4.766 -0.358 25913
164 1 . 1 1 29 29 CYS C C 29 175.932 175.932 175.104 0.828 25913
165 1 . 1 1 29 29 CYS CA C 29 56.402 56.402 55.808 0.594 25913
166 1 . 1 1 29 29 CYS CB C 29 32.214 32.214 28.011 4.203 25913
167 1 . 1 1 29 29 CYS H H 29 8.783 8.783 8.726 0.057 25913
168 1 . 1 1 30 30 PRO HA H 30 4.382 4.382 4.447 -0.065 25913
169 1 . 1 1 30 30 PRO C C 30 176.824 176.824 177.376 -0.552 25913
170 1 . 1 1 30 30 PRO CA C 30 64.040 64.040 64.462 -0.422 25913
171 1 . 1 1 30 30 PRO CB C 30 32.344 32.344 31.908 0.436 25913
172 1 . 1 1 31 31 ARG N N 31 124.131 124.131 117.261 6.870 25913
173 1 . 1 1 31 31 ARG HA H 31 4.301 4.301 4.434 -0.133 25913
174 1 . 1 1 31 31 ARG C C 31 177.721 177.721 177.160 0.561 25913
175 1 . 1 1 31 31 ARG CA C 31 58.190 58.190 57.790 0.400 25913
176 1 . 1 1 31 31 ARG CB C 31 31.682 31.682 30.952 0.730 25913
177 1 . 1 1 31 31 ARG H H 31 9.604 9.604 7.711 1.893 25913
178 1 . 1 1 32 32 CYS N N 32 119.758 119.758 113.854 5.904 25913
179 1 . 1 1 32 32 CYS HA H 32 4.839 4.839 4.845 -0.006 25913
180 1 . 1 1 32 32 CYS C C 32 176.450 176.450 174.407 2.043 25913
181 1 . 1 1 32 32 CYS CA C 32 58.710 58.710 57.585 1.125 25913
182 1 . 1 1 32 32 CYS CB C 32 33.230 33.230 29.359 3.871 25913
183 1 . 1 1 32 32 CYS H H 32 8.549 8.549 7.749 0.800 25913
184 1 . 1 1 33 33 GLU N N 33 118.109 118.109 119.902 -1.793 25913
185 1 . 1 1 33 33 GLU HA H 33 4.078 4.078 4.065 0.013 25913
186 1 . 1 1 33 33 GLU C C 33 174.739 174.739 176.046 -1.307 25913
187 1 . 1 1 33 33 GLU CA C 33 58.518 58.518 57.519 0.998 25913
188 1 . 1 1 33 33 GLU CB C 33 26.692 26.692 27.219 -0.527 25913
189 1 . 1 1 33 33 GLU H H 33 7.868 7.868 8.215 -0.347 25913
190 1 . 1 1 34 34 SER N N 34 117.224 117.224 114.951 2.273 25913
191 1 . 1 1 34 34 SER HA H 34 4.437 4.437 4.490 -0.053 25913
192 1 . 1 1 34 34 SER C C 34 175.392 175.392 175.584 -0.192 25913
193 1 . 1 1 34 34 SER CA C 34 59.277 59.277 59.801 -0.524 25913
194 1 . 1 1 34 34 SER CB C 34 65.429 65.429 64.384 1.045 25913
195 1 . 1 1 34 34 SER H H 34 8.786 8.786 8.007 0.779 25913
196 1 . 1 1 35 35 GLY N N 35 111.095 111.095 107.764 3.331 25913
197 1 . 1 1 35 35 GLY C C 35 175.730 175.730 174.469 1.261 25913
198 1 . 1 1 35 35 GLY CA C 35 45.241 45.241 44.664 0.577 25913
199 1 . 1 1 35 35 GLY H H 35 8.511 8.511 8.478 0.033 25913
200 1 . 1 1 36 36 PHE N N 36 126.409 126.409 125.122 1.287 25913
201 1 . 1 1 36 36 PHE HA H 36 5.151 5.151 4.447 0.704 25913
202 1 . 1 1 36 36 PHE C C 36 174.098 174.098 174.578 -0.480 25913
203 1 . 1 1 36 36 PHE CA C 36 55.269 55.269 58.885 -3.616 25913
204 1 . 1 1 36 36 PHE CB C 36 36.027 36.027 37.449 -1.422 25913
205 1 . 1 1 36 36 PHE H H 36 8.850 8.850 7.722 1.128 25913
206 1 . 1 1 37 37 ILE N N 37 117.377 117.377 115.743 1.634 25913
207 1 . 1 1 37 37 ILE HA H 37 5.356 5.356 5.374 -0.018 25913
208 1 . 1 1 37 37 ILE C C 37 175.508 175.508 174.870 0.638 25913
209 1 . 1 1 37 37 ILE CA C 37 58.687 58.687 58.620 0.067 25913
210 1 . 1 1 37 37 ILE CB C 37 41.148 41.148 42.556 -1.408 25913
211 1 . 1 1 37 37 ILE H H 37 7.972 7.972 7.874 0.098 25913
212 1 . 1 1 38 38 GLU N N 38 124.869 124.869 122.913 1.956 25913
213 1 . 1 1 38 38 GLU HA H 38 4.885 4.885 4.587 0.298 25913
214 1 . 1 1 38 38 GLU C C 38 174.300 174.300 175.343 -1.043 25913
215 1 . 1 1 38 38 GLU CA C 38 54.656 54.656 54.686 -0.030 25913
216 1 . 1 1 38 38 GLU CB C 38 34.589 34.589 32.136 2.453 25913
217 1 . 1 1 38 38 GLU H H 38 9.131 9.131 8.849 0.282 25913
218 1 . 1 1 39 39 GLU N N 39 127.840 127.840 127.060 0.780 25913
219 1 . 1 1 39 39 GLU HA H 39 3.848 3.848 3.205 0.643 25913
220 1 . 1 1 39 39 GLU C C 39 175.507 175.507 175.605 -0.098 25913
221 1 . 1 1 39 39 GLU CA C 39 56.505 56.505 55.764 0.741 25913
222 1 . 1 1 39 39 GLU CB C 39 30.249 30.249 28.928 1.321 25913
223 1 . 1 1 39 39 GLU H H 39 8.844 8.844 8.635 0.209 25913
stop_
save_