data_19542
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19542
_Entry.PDB_ID 2MFA
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 19542
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 LYS N N 2 126.352 126.352 121.449 4.903 19542
2 1 1 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.202 0.188 19542
3 1 1 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.743 -0.341 19542
4 1 1 . 1 1 2 2 LYS CB C 2 29.734 29.734 33.276 -3.542 19542
5 1 1 . 1 1 2 2 LYS H H 2 8.381 8.381 8.290 0.091 19542
6 1 1 . 1 1 3 3 CYS N N 3 117.974 117.974 120.780 -2.806 19542
7 1 1 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.526 0.433 19542
8 1 1 . 1 1 3 3 CYS CA C 3 51.272 51.272 58.262 -6.990 19542
9 1 1 . 1 1 3 3 CYS CB C 3 42.039 42.039 32.368 9.671 19542
10 1 1 . 1 1 3 3 CYS H H 3 8.394 8.394 8.918 -0.524 19542
11 1 1 . 1 1 4 4 PHE N N 4 120.016 120.016 121.057 -1.041 19542
12 1 1 . 1 1 4 4 PHE HA H 4 4.606 4.606 4.852 -0.246 19542
13 1 1 . 1 1 4 4 PHE CB C 4 39.719 39.719 36.811 2.908 19542
14 1 1 . 1 1 4 4 PHE H H 4 9.550 9.550 9.320 0.230 19542
15 1 1 . 1 1 5 5 GLN N N 5 120.517 120.517 122.010 -1.493 19542
16 1 1 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.305 0.117 19542
17 1 1 . 1 1 5 5 GLN CA C 5 56.003 56.003 57.793 -1.790 19542
18 1 1 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.498 3.096 19542
19 1 1 . 1 1 5 5 GLN H H 5 9.406 9.406 7.904 1.502 19542
20 1 1 . 1 1 6 6 HIS N N 6 118.478 118.478 117.094 1.384 19542
21 1 1 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.751 -0.273 19542
22 1 1 . 1 1 6 6 HIS CA C 6 56.627 56.627 55.580 1.047 19542
23 1 1 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.384 -2.408 19542
24 1 1 . 1 1 6 6 HIS H H 6 8.827 8.827 7.414 1.413 19542
25 1 1 . 1 1 7 7 GLY N N 7 103.072 103.072 108.181 -5.109 19542
26 1 1 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.513 0.411 19542
27 1 1 . 1 1 7 7 GLY H H 7 8.440 8.440 8.607 -0.167 19542
28 1 1 . 1 1 8 8 LYS N N 8 119.909 119.909 121.195 -1.286 19542
29 1 1 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.634 0.194 19542
30 1 1 . 1 1 8 8 LYS CB C 8 35.493 35.493 33.838 1.655 19542
31 1 1 . 1 1 8 8 LYS H H 8 7.703 7.703 7.337 0.366 19542
32 1 1 . 1 1 9 9 VAL N N 9 122.232 122.232 123.687 -1.455 19542
33 1 1 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.658 0.154 19542
34 1 1 . 1 1 9 9 VAL CA C 9 63.286 63.286 61.961 1.325 19542
35 1 1 . 1 1 9 9 VAL CB C 9 26.812 26.812 30.395 -3.583 19542
36 1 1 . 1 1 9 9 VAL H H 9 8.552 8.552 8.531 0.021 19542
37 1 1 . 1 1 10 10 VAL N N 10 123.963 123.963 125.370 -1.407 19542
38 1 1 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.725 -0.119 19542
39 1 1 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.294 1.098 19542
40 1 1 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.033 -0.251 19542
41 1 1 . 1 1 10 10 VAL H H 10 8.920 8.920 8.562 0.358 19542
42 1 1 . 1 1 11 11 THR N N 11 118.572 118.572 119.135 -0.563 19542
43 1 1 . 1 1 11 11 THR HA H 11 4.443 4.443 4.444 -0.001 19542
44 1 1 . 1 1 11 11 THR CA C 11 62.719 62.719 63.181 -0.462 19542
45 1 1 . 1 1 11 11 THR CB C 11 68.689 68.689 68.622 0.067 19542
46 1 1 . 1 1 11 11 THR H H 11 8.517 8.517 8.194 0.323 19542
47 1 1 . 1 1 12 12 CYS N N 12 126.835 126.835 127.027 -0.192 19542
48 1 1 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.373 0.298 19542
49 1 1 . 1 1 12 12 CYS CA C 12 53.036 53.036 59.011 -5.976 19542
50 1 1 . 1 1 12 12 CYS CB C 12 38.892 38.892 27.579 11.312 19542
51 1 1 . 1 1 12 12 CYS H H 12 8.970 8.970 8.401 0.569 19542
52 1 1 . 1 1 13 13 HIS N N 13 121.091 121.091 122.239 -1.148 19542
53 1 1 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.506 0.143 19542
54 1 1 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.931 -2.433 19542
55 1 1 . 1 1 13 13 HIS H H 13 9.015 9.015 8.732 0.283 19542
56 1 1 . 1 1 14 14 ARG N N 14 120.872 120.872 121.864 -0.992 19542
57 1 1 . 1 1 14 14 ARG HA H 14 4.043 4.043 4.011 0.032 19542
58 1 1 . 1 1 14 14 ARG CA C 14 58.962 58.962 58.179 0.783 19542
59 1 1 . 1 1 14 14 ARG CB C 14 30.014 30.014 29.697 0.317 19542
60 1 1 . 1 1 14 14 ARG H H 14 8.689 8.689 8.117 0.572 19542
61 1 1 . 1 1 15 15 ASP N N 15 121.233 121.233 118.838 2.395 19542
62 1 1 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.687 -0.184 19542
63 1 1 . 1 1 15 15 ASP CA C 15 54.306 54.306 56.136 -1.830 19542
64 1 1 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.468 -2.361 19542
65 1 1 . 1 1 15 15 ASP H H 15 8.907 8.907 7.820 1.087 19542
66 1 1 . 1 1 16 16 MET N N 16 119.073 119.073 118.791 0.282 19542
67 1 1 . 1 1 16 16 MET HA H 16 4.415 4.415 4.574 -0.159 19542
68 1 1 . 1 1 16 16 MET CA C 16 55.995 55.995 55.946 0.049 19542
69 1 1 . 1 1 16 16 MET CB C 16 32.662 32.662 32.351 0.311 19542
70 1 1 . 1 1 16 16 MET H H 16 7.811 7.811 7.720 0.091 19542
71 1 1 . 1 1 17 17 LYS N N 17 120.187 120.187 122.056 -1.869 19542
72 1 1 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.160 0.107 19542
73 1 1 . 1 1 17 17 LYS CA C 17 55.889 55.889 57.291 -1.402 19542
74 1 1 . 1 1 17 17 LYS CB C 17 34.106 34.106 33.334 0.772 19542
75 1 1 . 1 1 17 17 LYS H H 17 7.763 7.763 8.200 -0.437 19542
76 1 1 . 1 1 18 18 PHE N N 18 115.631 115.631 116.996 -1.365 19542
77 1 1 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.089 0.024 19542
78 1 1 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.491 0.480 19542
79 1 1 . 1 1 18 18 PHE CB C 18 43.018 43.018 43.172 -0.154 19542
80 1 1 . 1 1 18 18 PHE H H 18 8.252 8.252 8.127 0.125 19542
81 1 1 . 1 1 19 19 CYS N N 19 115.508 115.508 119.835 -4.327 19542
82 1 1 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.213 0.789 19542
83 1 1 . 1 1 19 19 CYS CA C 19 52.258 52.258 57.867 -5.609 19542
84 1 1 . 1 1 19 19 CYS CB C 19 38.627 38.627 28.515 10.112 19542
85 1 1 . 1 1 19 19 CYS H H 19 9.343 9.343 9.496 -0.153 19542
86 1 1 . 1 1 20 20 TYR N N 20 128.934 128.934 118.623 10.311 19542
87 1 1 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.717 0.490 19542
88 1 1 . 1 1 20 20 TYR CA C 20 55.701 55.701 54.982 0.719 19542
89 1 1 . 1 1 20 20 TYR CB C 20 43.184 43.184 41.158 2.026 19542
90 1 1 . 1 1 20 20 TYR H H 20 8.871 8.871 9.148 -0.277 19542
91 1 1 . 1 1 21 21 HIS N N 21 122.079 122.079 124.413 -2.334 19542
92 1 1 . 1 1 21 21 HIS HA H 21 5.283 5.283 5.104 0.179 19542
93 1 1 . 1 1 21 21 HIS CA C 21 54.713 54.713 54.267 0.446 19542
94 1 1 . 1 1 21 21 HIS CB C 21 31.719 31.719 31.620 0.099 19542
95 1 1 . 1 1 21 21 HIS H H 21 8.797 8.797 9.259 -0.462 19542
96 1 1 . 1 1 22 22 ASN N N 22 128.444 128.444 127.683 0.761 19542
97 1 1 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.222 0.624 19542
98 1 1 . 1 1 22 22 ASN CA C 22 52.512 52.512 51.660 0.852 19542
99 1 1 . 1 1 22 22 ASN CB C 22 40.821 40.821 41.332 -0.511 19542
100 1 1 . 1 1 22 22 ASN H H 22 9.823 9.823 8.949 0.874 19542
101 1 1 . 1 1 23 23 THR N N 23 116.691 116.691 115.480 1.211 19542
102 1 1 . 1 1 23 23 THR HA H 23 4.604 4.604 4.148 0.456 19542
103 1 1 . 1 1 23 23 THR CA C 23 57.003 57.003 62.819 -5.816 19542
104 1 1 . 1 1 23 23 THR CB C 23 69.344 69.344 69.363 -0.019 19542
105 1 1 . 1 1 23 23 THR H H 23 8.561 8.561 8.634 -0.073 19542
106 1 1 . 1 1 24 24 GLY N N 24 110.763 110.763 112.105 -1.342 19542
107 1 1 . 1 1 24 24 GLY CA C 24 44.993 44.993 45.082 -0.089 19542
108 1 1 . 1 1 24 24 GLY H H 24 8.608 8.608 8.582 0.026 19542
109 1 1 . 1 1 25 25 MET N N 25 120.520 120.520 121.442 -0.922 19542
110 1 1 . 1 1 25 25 MET HA H 25 4.818 4.818 4.777 0.041 19542
111 1 1 . 1 1 25 25 MET CA C 25 53.892 53.892 51.568 2.325 19542
112 1 1 . 1 1 25 25 MET CB C 25 32.399 32.399 32.788 -0.390 19542
113 1 1 . 1 1 25 25 MET H H 25 8.418 8.418 8.273 0.145 19542
114 1 1 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.390 -0.013 19542
115 1 1 . 1 1 26 26 PRO CA C 26 63.841 63.841 63.263 0.578 19542
116 1 1 . 1 1 26 26 PRO CB C 26 31.750 31.750 30.500 1.250 19542
117 1 1 . 1 1 27 27 PHE N N 27 118.056 118.056 123.480 -5.424 19542
118 1 1 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.751 -0.126 19542
119 1 1 . 1 1 27 27 PHE CA C 27 57.332 57.332 56.749 0.583 19542
120 1 1 . 1 1 27 27 PHE CB C 27 39.701 39.701 42.819 -3.118 19542
121 1 1 . 1 1 27 27 PHE H H 27 7.988 7.988 7.877 0.111 19542
122 1 1 . 1 1 28 28 ARG N N 28 121.294 121.294 122.775 -1.481 19542
123 1 1 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.542 -0.483 19542
124 1 1 . 1 1 28 28 ARG CA C 28 57.142 57.142 56.091 1.051 19542
125 1 1 . 1 1 28 28 ARG CB C 28 29.711 29.711 30.933 -1.222 19542
126 1 1 . 1 1 28 28 ARG H H 28 8.333 8.333 8.800 -0.467 19542
127 1 1 . 1 1 29 29 ASN N N 29 116.243 116.243 117.014 -0.771 19542
128 1 1 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.435 0.161 19542
129 1 1 . 1 1 29 29 ASN CA C 29 53.795 53.795 53.912 -0.117 19542
130 1 1 . 1 1 29 29 ASN CB C 29 38.239 38.239 38.285 -0.046 19542
131 1 1 . 1 1 29 29 ASN H H 29 8.356 8.356 8.809 -0.453 19542
132 1 1 . 1 1 30 30 LEU N N 30 121.660 121.660 121.110 0.550 19542
133 1 1 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.575 -0.130 19542
134 1 1 . 1 1 30 30 LEU CA C 30 55.203 55.203 54.666 0.537 19542
135 1 1 . 1 1 30 30 LEU CB C 30 42.982 42.982 42.842 0.140 19542
136 1 1 . 1 1 30 30 LEU H H 30 8.028 8.028 7.810 0.218 19542
137 1 1 . 1 1 31 31 LYS N N 31 120.928 120.928 128.652 -7.724 19542
138 1 1 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.551 -0.173 19542
139 1 1 . 1 1 31 31 LYS CA C 31 56.271 56.271 55.665 0.606 19542
140 1 1 . 1 1 31 31 LYS CB C 31 32.230 32.230 31.623 0.607 19542
141 1 1 . 1 1 31 31 LYS H H 31 8.306 8.306 8.601 -0.295 19542
142 1 1 . 1 1 32 32 LEU N N 32 122.843 122.843 124.881 -2.038 19542
143 1 1 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.593 -0.147 19542
144 1 1 . 1 1 32 32 LEU CA C 32 54.484 54.484 54.048 0.436 19542
145 1 1 . 1 1 32 32 LEU CB C 32 43.404 43.404 43.883 -0.479 19542
146 1 1 . 1 1 32 32 LEU H H 32 8.027 8.027 8.260 -0.233 19542
147 1 1 . 1 1 33 33 ILE N N 33 123.311 123.311 123.191 0.120 19542
148 1 1 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.374 0.009 19542
149 1 1 . 1 1 33 33 ILE CA C 33 60.595 60.595 60.209 0.386 19542
150 1 1 . 1 1 33 33 ILE CB C 33 38.303 38.303 38.421 -0.118 19542
151 1 1 . 1 1 33 33 ILE H H 33 8.327 8.327 8.506 -0.179 19542
152 1 1 . 1 1 34 34 LEU N N 34 128.669 128.669 129.596 -0.927 19542
153 1 1 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.782 0.012 19542
154 1 1 . 1 1 34 34 LEU CB C 34 42.873 42.873 41.506 1.367 19542
155 1 1 . 1 1 34 34 LEU H H 34 8.880 8.880 9.007 -0.127 19542
156 1 1 . 1 1 35 35 GLN N N 35 121.600 121.600 120.503 1.097 19542
157 1 1 . 1 1 35 35 GLN HA H 35 4.588 4.588 5.314 -0.726 19542
158 1 1 . 1 1 35 35 GLN CA C 35 61.390 61.390 54.487 6.903 19542
159 1 1 . 1 1 35 35 GLN CB C 35 33.866 33.866 31.999 1.867 19542
160 1 1 . 1 1 35 35 GLN H H 35 8.210 8.210 8.088 0.122 19542
161 1 1 . 1 1 36 36 GLY N N 36 106.726 106.726 109.658 -2.932 19542
162 1 1 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.512 2.366 19542
163 1 1 . 1 1 36 36 GLY H H 36 6.121 6.121 7.137 -1.016 19542
164 1 1 . 1 1 37 37 CYS N N 37 124.584 124.584 118.180 6.404 19542
165 1 1 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.196 0.678 19542
166 1 1 . 1 1 37 37 CYS CA C 37 55.955 55.955 58.226 -2.271 19542
167 1 1 . 1 1 37 37 CYS CB C 37 48.202 48.202 30.937 17.265 19542
168 1 1 . 1 1 37 37 CYS H H 37 8.505 8.505 8.639 -0.134 19542
169 1 1 . 1 1 38 38 SER N N 38 115.036 115.036 117.419 -2.383 19542
170 1 1 . 1 1 38 38 SER HA H 38 4.980 4.980 5.031 -0.051 19542
171 1 1 . 1 1 38 38 SER CA C 38 58.792 58.792 56.711 2.081 19542
172 1 1 . 1 1 38 38 SER CB C 38 65.971 65.971 66.004 -0.033 19542
173 1 1 . 1 1 38 38 SER H H 38 9.749 9.749 9.345 0.404 19542
174 1 1 . 1 1 39 39 SER N N 39 117.276 117.276 120.453 -3.177 19542
175 1 1 . 1 1 39 39 SER HA H 39 4.827 4.827 4.937 -0.110 19542
176 1 1 . 1 1 39 39 SER CA C 39 60.040 60.040 59.553 0.487 19542
177 1 1 . 1 1 39 39 SER CB C 39 63.784 63.784 63.807 -0.023 19542
178 1 1 . 1 1 39 39 SER H H 39 9.161 9.161 8.998 0.163 19542
179 1 1 . 1 1 40 40 SER N N 40 115.041 115.041 116.486 -1.445 19542
180 1 1 . 1 1 40 40 SER HA H 40 4.660 4.660 4.701 -0.041 19542
181 1 1 . 1 1 40 40 SER CA C 40 55.868 55.868 56.896 -1.028 19542
182 1 1 . 1 1 40 40 SER CB C 40 64.868 64.868 63.596 1.272 19542
183 1 1 . 1 1 40 40 SER H H 40 7.911 7.911 7.629 0.282 19542
184 1 1 . 1 1 41 41 CYS N N 41 124.146 124.146 122.996 1.150 19542
185 1 1 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.441 -0.133 19542
186 1 1 . 1 1 41 41 CYS CA C 41 57.567 57.567 58.296 -0.729 19542
187 1 1 . 1 1 41 41 CYS CB C 41 40.000 40.000 28.285 11.715 19542
188 1 1 . 1 1 41 41 CYS H H 41 8.067 8.067 8.175 -0.108 19542
189 1 1 . 1 1 42 42 SER N N 42 118.590 118.590 118.355 0.235 19542
190 1 1 . 1 1 42 42 SER HA H 42 4.611 4.611 4.437 0.174 19542
191 1 1 . 1 1 42 42 SER CA C 42 59.020 59.020 56.940 2.080 19542
192 1 1 . 1 1 42 42 SER CB C 42 64.112 64.112 63.883 0.229 19542
193 1 1 . 1 1 42 42 SER H H 42 8.491 8.491 8.423 0.068 19542
194 1 1 . 1 1 43 43 GLU N N 43 118.830 118.830 128.972 -10.142 19542
195 1 1 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.157 0.492 19542
196 1 1 . 1 1 43 43 GLU CA C 43 56.856 56.856 57.118 -0.262 19542
197 1 1 . 1 1 43 43 GLU CB C 43 29.206 29.206 29.258 -0.052 19542
198 1 1 . 1 1 43 43 GLU H H 43 8.861 8.861 8.765 0.096 19542
199 1 1 . 1 1 44 44 THR N N 44 117.954 117.954 116.950 1.004 19542
200 1 1 . 1 1 44 44 THR HA H 44 4.619 4.619 4.715 -0.096 19542
201 1 1 . 1 1 44 44 THR CB C 44 72.341 72.341 71.164 1.177 19542
202 1 1 . 1 1 44 44 THR H H 44 9.030 9.030 8.762 0.268 19542
203 1 1 . 1 1 45 45 GLU N N 45 127.100 127.100 119.675 7.425 19542
204 1 1 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.358 -0.264 19542
205 1 1 . 1 1 45 45 GLU CA C 45 58.934 58.934 56.901 2.034 19542
206 1 1 . 1 1 45 45 GLU CB C 45 27.009 27.009 29.675 -2.666 19542
207 1 1 . 1 1 45 45 GLU H H 45 8.837 8.837 8.607 0.230 19542
208 1 1 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.531 0.371 19542
209 1 1 . 1 1 46 46 ASN CA C 46 53.244 53.244 54.589 -1.345 19542
210 1 1 . 1 1 46 46 ASN CB C 46 40.053 40.053 39.208 0.846 19542
211 1 1 . 1 1 46 46 ASN H H 46 8.018 8.018 8.067 -0.049 19542
212 1 1 . 1 1 47 47 ASN N N 47 120.765 120.765 118.543 2.222 19542
213 1 1 . 1 1 47 47 ASN HA H 47 5.362 5.362 5.347 0.015 19542
214 1 1 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.374 1.605 19542
215 1 1 . 1 1 47 47 ASN CB C 47 41.749 41.749 40.896 0.853 19542
216 1 1 . 1 1 47 47 ASN H H 47 7.835 7.835 8.273 -0.438 19542
217 1 1 . 1 1 48 48 LYS N N 48 123.576 123.576 125.960 -2.384 19542
218 1 1 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.903 -0.061 19542
219 1 1 . 1 1 48 48 LYS CB C 48 34.398 34.398 34.908 -0.510 19542
220 1 1 . 1 1 48 48 LYS H H 48 8.548 8.548 8.984 -0.436 19542
221 1 1 . 1 1 49 49 CYS N N 49 116.141 116.141 119.818 -3.677 19542
222 1 1 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.560 -0.007 19542
223 1 1 . 1 1 49 49 CYS CA C 49 53.386 53.386 57.940 -4.554 19542
224 1 1 . 1 1 49 49 CYS CB C 49 44.935 44.935 27.649 17.286 19542
225 1 1 . 1 1 49 49 CYS H H 49 8.873 8.873 8.708 0.165 19542
226 1 1 . 1 1 50 50 CYS N N 50 118.484 118.484 123.616 -5.132 19542
227 1 1 . 1 1 50 50 CYS HA H 50 5.265 5.265 4.986 0.279 19542
228 1 1 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.218 -1.235 19542
229 1 1 . 1 1 50 50 CYS CB C 50 46.111 46.111 30.173 15.938 19542
230 1 1 . 1 1 50 50 CYS H H 50 9.389 9.389 9.433 -0.044 19542
231 1 1 . 1 1 51 51 SER N N 51 115.213 115.213 116.030 -0.817 19542
232 1 1 . 1 1 51 51 SER HA H 51 5.016 5.016 4.807 0.209 19542
233 1 1 . 1 1 51 51 SER CA C 51 58.118 58.118 58.141 -0.023 19542
234 1 1 . 1 1 51 51 SER CB C 51 64.457 64.457 63.456 1.001 19542
235 1 1 . 1 1 51 51 SER H H 51 9.290 9.290 8.617 0.673 19542
236 1 1 . 1 1 52 52 THR N N 52 112.156 112.156 118.234 -6.078 19542
237 1 1 . 1 1 52 52 THR HA H 52 4.692 4.692 4.449 0.243 19542
238 1 1 . 1 1 52 52 THR CA C 52 59.835 59.835 61.371 -1.536 19542
239 1 1 . 1 1 52 52 THR CB C 52 71.872 71.872 71.485 0.387 19542
240 1 1 . 1 1 52 52 THR H H 52 7.624 7.624 7.399 0.225 19542
241 1 1 . 1 1 53 53 ASP N N 53 119.869 119.869 121.755 -1.886 19542
242 1 1 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.423 0.547 19542
243 1 1 . 1 1 53 53 ASP CA C 53 55.485 55.485 55.019 0.466 19542
244 1 1 . 1 1 53 53 ASP CB C 53 40.722 40.722 41.019 -0.297 19542
245 1 1 . 1 1 53 53 ASP H H 53 8.410 8.410 8.606 -0.196 19542
246 1 1 . 1 1 54 54 ARG N N 54 111.677 111.677 117.206 -5.529 19542
247 1 1 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.626 -0.441 19542
248 1 1 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.608 0.354 19542
249 1 1 . 1 1 54 54 ARG CB C 54 28.429 28.429 27.447 0.982 19542
250 1 1 . 1 1 54 54 ARG H H 54 9.306 9.306 8.903 0.403 19542
251 1 1 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.389 0.172 19542
252 1 1 . 1 1 55 55 CYS CA C 55 57.814 57.814 59.794 -1.980 19542
253 1 1 . 1 1 55 55 CYS CB C 55 46.236 46.236 27.540 18.696 19542
254 1 1 . 1 1 55 55 CYS H H 55 7.995 7.995 7.834 0.161 19542
255 1 1 . 1 1 56 56 ASN N N 56 121.881 121.881 119.607 2.274 19542
256 1 1 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.618 0.192 19542
257 1 1 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.678 -0.312 19542
258 1 1 . 1 1 56 56 ASN CB C 56 37.837 37.837 36.355 1.482 19542
259 1 1 . 1 1 56 56 ASN H H 56 8.755 8.755 8.652 0.103 19542
260 1 2 . 1 1 2 2 LYS N N 2 126.352 126.352 120.883 5.469 19542
261 1 2 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.172 0.218 19542
262 1 2 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.800 -0.398 19542
263 1 2 . 1 1 2 2 LYS CB C 2 29.734 29.734 33.515 -3.781 19542
264 1 2 . 1 1 2 2 LYS H H 2 8.381 8.381 8.316 0.065 19542
265 1 2 . 1 1 3 3 CYS N N 3 117.974 117.974 120.397 -2.423 19542
266 1 2 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.734 0.225 19542
267 1 2 . 1 1 3 3 CYS CA C 3 51.272 51.272 57.609 -6.337 19542
268 1 2 . 1 1 3 3 CYS CB C 3 42.039 42.039 31.738 10.301 19542
269 1 2 . 1 1 3 3 CYS H H 3 8.394 8.394 8.903 -0.509 19542
270 1 2 . 1 1 4 4 PHE N N 4 120.016 120.016 120.911 -0.895 19542
271 1 2 . 1 1 4 4 PHE HA H 4 4.606 4.606 4.941 -0.335 19542
272 1 2 . 1 1 4 4 PHE CB C 4 39.719 39.719 37.139 2.580 19542
273 1 2 . 1 1 4 4 PHE H H 4 9.550 9.550 9.397 0.153 19542
274 1 2 . 1 1 5 5 GLN N N 5 120.517 120.517 124.299 -3.782 19542
275 1 2 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.375 0.047 19542
276 1 2 . 1 1 5 5 GLN CA C 5 56.003 56.003 57.805 -1.802 19542
277 1 2 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.562 3.032 19542
278 1 2 . 1 1 5 5 GLN H H 5 9.406 9.406 8.061 1.345 19542
279 1 2 . 1 1 6 6 HIS N N 6 118.478 118.478 116.579 1.899 19542
280 1 2 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.637 -0.159 19542
281 1 2 . 1 1 6 6 HIS CA C 6 56.627 56.627 55.839 0.788 19542
282 1 2 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.517 -2.541 19542
283 1 2 . 1 1 6 6 HIS H H 6 8.827 8.827 7.793 1.034 19542
284 1 2 . 1 1 7 7 GLY N N 7 103.072 103.072 107.844 -4.772 19542
285 1 2 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.349 0.575 19542
286 1 2 . 1 1 7 7 GLY H H 7 8.440 8.440 8.571 -0.131 19542
287 1 2 . 1 1 8 8 LYS N N 8 119.909 119.909 120.946 -1.037 19542
288 1 2 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.822 0.006 19542
289 1 2 . 1 1 8 8 LYS CB C 8 35.493 35.493 34.068 1.425 19542
290 1 2 . 1 1 8 8 LYS H H 8 7.703 7.703 7.957 -0.254 19542
291 1 2 . 1 1 9 9 VAL N N 9 122.232 122.232 125.186 -2.954 19542
292 1 2 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.915 -0.103 19542
293 1 2 . 1 1 9 9 VAL CA C 9 63.286 63.286 61.902 1.384 19542
294 1 2 . 1 1 9 9 VAL CB C 9 26.812 26.812 31.435 -4.623 19542
295 1 2 . 1 1 9 9 VAL H H 9 8.552 8.552 8.578 -0.026 19542
296 1 2 . 1 1 10 10 VAL N N 10 123.963 123.963 125.219 -1.256 19542
297 1 2 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.632 -0.026 19542
298 1 2 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.403 0.989 19542
299 1 2 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.314 -0.532 19542
300 1 2 . 1 1 10 10 VAL H H 10 8.920 8.920 8.780 0.140 19542
301 1 2 . 1 1 11 11 THR N N 11 118.572 118.572 118.845 -0.273 19542
302 1 2 . 1 1 11 11 THR HA H 11 4.443 4.443 4.190 0.253 19542
303 1 2 . 1 1 11 11 THR CA C 11 62.719 62.719 63.961 -1.242 19542
304 1 2 . 1 1 11 11 THR CB C 11 68.689 68.689 68.538 0.151 19542
305 1 2 . 1 1 11 11 THR H H 11 8.517 8.517 8.188 0.329 19542
306 1 2 . 1 1 12 12 CYS N N 12 126.835 126.835 126.325 0.510 19542
307 1 2 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.517 0.154 19542
308 1 2 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.346 -5.310 19542
309 1 2 . 1 1 12 12 CYS CB C 12 38.892 38.892 28.089 10.803 19542
310 1 2 . 1 1 12 12 CYS H H 12 8.970 8.970 8.444 0.526 19542
311 1 2 . 1 1 13 13 HIS N N 13 121.091 121.091 121.556 -0.465 19542
312 1 2 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.535 0.114 19542
313 1 2 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.468 -1.970 19542
314 1 2 . 1 1 13 13 HIS H H 13 9.015 9.015 8.537 0.478 19542
315 1 2 . 1 1 14 14 ARG N N 14 120.872 120.872 122.229 -1.357 19542
316 1 2 . 1 1 14 14 ARG HA H 14 4.043 4.043 4.051 -0.008 19542
317 1 2 . 1 1 14 14 ARG CA C 14 58.962 58.962 58.077 0.886 19542
318 1 2 . 1 1 14 14 ARG CB C 14 30.014 30.014 29.550 0.464 19542
319 1 2 . 1 1 14 14 ARG H H 14 8.689 8.689 8.180 0.509 19542
320 1 2 . 1 1 15 15 ASP N N 15 121.233 121.233 118.963 2.270 19542
321 1 2 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.679 -0.176 19542
322 1 2 . 1 1 15 15 ASP CA C 15 54.306 54.306 55.825 -1.519 19542
323 1 2 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.631 -2.524 19542
324 1 2 . 1 1 15 15 ASP H H 15 8.907 8.907 7.767 1.140 19542
325 1 2 . 1 1 16 16 MET N N 16 119.073 119.073 119.181 -0.108 19542
326 1 2 . 1 1 16 16 MET HA H 16 4.415 4.415 4.593 -0.178 19542
327 1 2 . 1 1 16 16 MET CA C 16 55.995 55.995 54.897 1.098 19542
328 1 2 . 1 1 16 16 MET CB C 16 32.662 32.662 31.293 1.369 19542
329 1 2 . 1 1 16 16 MET H H 16 7.811 7.811 7.833 -0.022 19542
330 1 2 . 1 1 17 17 LYS N N 17 120.187 120.187 123.641 -3.454 19542
331 1 2 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.212 0.055 19542
332 1 2 . 1 1 17 17 LYS CA C 17 55.889 55.889 56.753 -0.864 19542
333 1 2 . 1 1 17 17 LYS CB C 17 34.106 34.106 33.965 0.141 19542
334 1 2 . 1 1 17 17 LYS H H 17 7.763 7.763 8.206 -0.443 19542
335 1 2 . 1 1 18 18 PHE N N 18 115.631 115.631 116.656 -1.025 19542
336 1 2 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.228 -0.115 19542
337 1 2 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.257 0.714 19542
338 1 2 . 1 1 18 18 PHE CB C 18 43.018 43.018 43.115 -0.097 19542
339 1 2 . 1 1 18 18 PHE H H 18 8.252 8.252 8.329 -0.077 19542
340 1 2 . 1 1 19 19 CYS N N 19 115.508 115.508 120.196 -4.688 19542
341 1 2 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.301 0.702 19542
342 1 2 . 1 1 19 19 CYS CA C 19 52.258 52.258 57.846 -5.588 19542
343 1 2 . 1 1 19 19 CYS CB C 19 38.627 38.627 27.576 11.052 19542
344 1 2 . 1 1 19 19 CYS H H 19 9.343 9.343 9.407 -0.064 19542
345 1 2 . 1 1 20 20 TYR N N 20 128.934 128.934 119.026 9.908 19542
346 1 2 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.566 0.641 19542
347 1 2 . 1 1 20 20 TYR CA C 20 55.701 55.701 55.139 0.562 19542
348 1 2 . 1 1 20 20 TYR CB C 20 43.184 43.184 40.900 2.284 19542
349 1 2 . 1 1 20 20 TYR H H 20 8.871 8.871 9.206 -0.335 19542
350 1 2 . 1 1 21 21 HIS N N 21 122.079 122.079 122.676 -0.597 19542
351 1 2 . 1 1 21 21 HIS HA H 21 5.283 5.283 4.912 0.371 19542
352 1 2 . 1 1 21 21 HIS CA C 21 54.713 54.713 54.589 0.124 19542
353 1 2 . 1 1 21 21 HIS CB C 21 31.719 31.719 32.723 -1.004 19542
354 1 2 . 1 1 21 21 HIS H H 21 8.797 8.797 9.281 -0.484 19542
355 1 2 . 1 1 22 22 ASN N N 22 128.444 128.444 126.895 1.549 19542
356 1 2 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.194 0.652 19542
357 1 2 . 1 1 22 22 ASN CA C 22 52.512 52.512 51.714 0.798 19542
358 1 2 . 1 1 22 22 ASN CB C 22 40.821 40.821 41.143 -0.322 19542
359 1 2 . 1 1 22 22 ASN H H 22 9.823 9.823 8.744 1.079 19542
360 1 2 . 1 1 23 23 THR N N 23 116.691 116.691 119.756 -3.065 19542
361 1 2 . 1 1 23 23 THR HA H 23 4.604 4.604 4.455 0.149 19542
362 1 2 . 1 1 23 23 THR CA C 23 57.003 57.003 61.052 -4.049 19542
363 1 2 . 1 1 23 23 THR CB C 23 69.344 69.344 67.704 1.640 19542
364 1 2 . 1 1 23 23 THR H H 23 8.561 8.561 8.578 -0.017 19542
365 1 2 . 1 1 24 24 GLY N N 24 110.763 110.763 112.541 -1.778 19542
366 1 2 . 1 1 24 24 GLY CA C 24 44.993 44.993 44.537 0.456 19542
367 1 2 . 1 1 24 24 GLY H H 24 8.608 8.608 7.697 0.911 19542
368 1 2 . 1 1 25 25 MET N N 25 120.520 120.520 122.713 -2.193 19542
369 1 2 . 1 1 25 25 MET HA H 25 4.818 4.818 4.258 0.560 19542
370 1 2 . 1 1 25 25 MET CA C 25 53.892 53.892 53.072 0.820 19542
371 1 2 . 1 1 25 25 MET CB C 25 32.399 32.399 31.578 0.821 19542
372 1 2 . 1 1 25 25 MET H H 25 8.418 8.418 8.440 -0.022 19542
373 1 2 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.417 -0.040 19542
374 1 2 . 1 1 26 26 PRO CA C 26 63.841 63.841 62.912 0.929 19542
375 1 2 . 1 1 26 26 PRO CB C 26 31.750 31.750 31.331 0.419 19542
376 1 2 . 1 1 27 27 PHE N N 27 118.056 118.056 124.782 -6.726 19542
377 1 2 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.697 -0.072 19542
378 1 2 . 1 1 27 27 PHE CA C 27 57.332 57.332 56.400 0.932 19542
379 1 2 . 1 1 27 27 PHE CB C 27 39.701 39.701 41.546 -1.845 19542
380 1 2 . 1 1 27 27 PHE H H 27 7.988 7.988 8.073 -0.085 19542
381 1 2 . 1 1 28 28 ARG N N 28 121.294 121.294 124.186 -2.892 19542
382 1 2 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.168 -0.109 19542
383 1 2 . 1 1 28 28 ARG CA C 28 57.142 57.142 56.975 0.167 19542
384 1 2 . 1 1 28 28 ARG CB C 28 29.711 29.711 28.831 0.880 19542
385 1 2 . 1 1 28 28 ARG H H 28 8.333 8.333 9.029 -0.696 19542
386 1 2 . 1 1 29 29 ASN N N 29 116.243 116.243 117.487 -1.244 19542
387 1 2 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.350 0.246 19542
388 1 2 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.358 -0.563 19542
389 1 2 . 1 1 29 29 ASN CB C 29 38.239 38.239 37.872 0.367 19542
390 1 2 . 1 1 29 29 ASN H H 29 8.356 8.356 8.961 -0.605 19542
391 1 2 . 1 1 30 30 LEU N N 30 121.660 121.660 119.940 1.720 19542
392 1 2 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.629 -0.184 19542
393 1 2 . 1 1 30 30 LEU CA C 30 55.203 55.203 54.765 0.438 19542
394 1 2 . 1 1 30 30 LEU CB C 30 42.982 42.982 43.489 -0.507 19542
395 1 2 . 1 1 30 30 LEU H H 30 8.028 8.028 7.859 0.169 19542
396 1 2 . 1 1 31 31 LYS N N 31 120.928 120.928 126.640 -5.712 19542
397 1 2 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.487 -0.109 19542
398 1 2 . 1 1 31 31 LYS CA C 31 56.271 56.271 54.676 1.595 19542
399 1 2 . 1 1 31 31 LYS CB C 31 32.230 32.230 32.133 0.097 19542
400 1 2 . 1 1 31 31 LYS H H 31 8.306 8.306 8.281 0.025 19542
401 1 2 . 1 1 32 32 LEU N N 32 122.843 122.843 129.122 -6.279 19542
402 1 2 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.503 -0.057 19542
403 1 2 . 1 1 32 32 LEU CA C 32 54.484 54.484 55.085 -0.601 19542
404 1 2 . 1 1 32 32 LEU CB C 32 43.404 43.404 42.688 0.716 19542
405 1 2 . 1 1 32 32 LEU H H 32 8.027 8.027 8.703 -0.676 19542
406 1 2 . 1 1 33 33 ILE N N 33 123.311 123.311 127.353 -4.042 19542
407 1 2 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.364 0.019 19542
408 1 2 . 1 1 33 33 ILE CA C 33 60.595 60.595 59.429 1.166 19542
409 1 2 . 1 1 33 33 ILE CB C 33 38.303 38.303 38.447 -0.144 19542
410 1 2 . 1 1 33 33 ILE H H 33 8.327 8.327 7.858 0.469 19542
411 1 2 . 1 1 34 34 LEU N N 34 128.669 128.669 126.139 2.530 19542
412 1 2 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.366 0.428 19542
413 1 2 . 1 1 34 34 LEU CB C 34 42.873 42.873 42.886 -0.013 19542
414 1 2 . 1 1 34 34 LEU H H 34 8.880 8.880 8.518 0.362 19542
415 1 2 . 1 1 35 35 GLN N N 35 121.600 121.600 115.736 5.864 19542
416 1 2 . 1 1 35 35 GLN HA H 35 4.588 4.588 4.078 0.510 19542
417 1 2 . 1 1 35 35 GLN CA C 35 61.390 61.390 56.281 5.109 19542
418 1 2 . 1 1 35 35 GLN CB C 35 33.866 33.866 26.944 6.922 19542
419 1 2 . 1 1 35 35 GLN H H 35 8.210 8.210 8.016 0.194 19542
420 1 2 . 1 1 36 36 GLY N N 36 106.726 106.726 106.310 0.416 19542
421 1 2 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.661 2.217 19542
422 1 2 . 1 1 36 36 GLY H H 36 6.121 6.121 6.765 -0.644 19542
423 1 2 . 1 1 37 37 CYS N N 37 124.584 124.584 118.241 6.343 19542
424 1 2 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.421 0.453 19542
425 1 2 . 1 1 37 37 CYS CA C 37 55.955 55.955 57.443 -1.488 19542
426 1 2 . 1 1 37 37 CYS CB C 37 48.202 48.202 29.242 18.959 19542
427 1 2 . 1 1 37 37 CYS H H 37 8.505 8.505 8.602 -0.097 19542
428 1 2 . 1 1 38 38 SER N N 38 115.036 115.036 117.256 -2.220 19542
429 1 2 . 1 1 38 38 SER HA H 38 4.980 4.980 5.007 -0.027 19542
430 1 2 . 1 1 38 38 SER CA C 38 58.792 58.792 56.498 2.294 19542
431 1 2 . 1 1 38 38 SER CB C 38 65.971 65.971 65.120 0.851 19542
432 1 2 . 1 1 38 38 SER H H 38 9.749 9.749 9.300 0.449 19542
433 1 2 . 1 1 39 39 SER N N 39 117.276 117.276 118.907 -1.631 19542
434 1 2 . 1 1 39 39 SER HA H 39 4.827 4.827 5.093 -0.266 19542
435 1 2 . 1 1 39 39 SER CA C 39 60.040 60.040 58.413 1.627 19542
436 1 2 . 1 1 39 39 SER CB C 39 63.784 63.784 63.690 0.094 19542
437 1 2 . 1 1 39 39 SER H H 39 9.161 9.161 8.778 0.383 19542
438 1 2 . 1 1 40 40 SER N N 40 115.041 115.041 115.344 -0.303 19542
439 1 2 . 1 1 40 40 SER HA H 40 4.660 4.660 4.770 -0.110 19542
440 1 2 . 1 1 40 40 SER CA C 40 55.868 55.868 57.012 -1.144 19542
441 1 2 . 1 1 40 40 SER CB C 40 64.868 64.868 65.872 -1.004 19542
442 1 2 . 1 1 40 40 SER H H 40 7.911 7.911 7.746 0.165 19542
443 1 2 . 1 1 41 41 CYS N N 41 124.146 124.146 120.980 3.166 19542
444 1 2 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.338 -0.029 19542
445 1 2 . 1 1 41 41 CYS CA C 41 57.567 57.567 57.179 0.388 19542
446 1 2 . 1 1 41 41 CYS CB C 41 40.000 40.000 26.921 13.079 19542
447 1 2 . 1 1 41 41 CYS H H 41 8.067 8.067 8.281 -0.214 19542
448 1 2 . 1 1 42 42 SER N N 42 118.590 118.590 120.893 -2.303 19542
449 1 2 . 1 1 42 42 SER HA H 42 4.611 4.611 4.380 0.231 19542
450 1 2 . 1 1 42 42 SER CA C 42 59.020 59.020 57.834 1.186 19542
451 1 2 . 1 1 42 42 SER CB C 42 64.112 64.112 63.583 0.529 19542
452 1 2 . 1 1 42 42 SER H H 42 8.491 8.491 8.594 -0.103 19542
453 1 2 . 1 1 43 43 GLU N N 43 118.830 118.830 127.591 -8.761 19542
454 1 2 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.531 0.118 19542
455 1 2 . 1 1 43 43 GLU CA C 43 56.856 56.856 55.080 1.776 19542
456 1 2 . 1 1 43 43 GLU CB C 43 29.206 29.206 27.918 1.288 19542
457 1 2 . 1 1 43 43 GLU H H 43 8.861 8.861 8.806 0.055 19542
458 1 2 . 1 1 44 44 THR N N 44 117.954 117.954 113.254 4.700 19542
459 1 2 . 1 1 44 44 THR HA H 44 4.619 4.619 4.511 0.108 19542
460 1 2 . 1 1 44 44 THR CB C 44 72.341 72.341 71.131 1.210 19542
461 1 2 . 1 1 44 44 THR H H 44 9.030 9.030 7.594 1.436 19542
462 1 2 . 1 1 45 45 GLU N N 45 127.100 127.100 119.068 8.032 19542
463 1 2 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.133 -0.039 19542
464 1 2 . 1 1 45 45 GLU CA C 45 58.934 58.934 58.333 0.601 19542
465 1 2 . 1 1 45 45 GLU CB C 45 27.009 27.009 29.517 -2.508 19542
466 1 2 . 1 1 45 45 GLU H H 45 8.837 8.837 8.622 0.215 19542
467 1 2 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.497 0.405 19542
468 1 2 . 1 1 46 46 ASN CA C 46 53.244 53.244 54.484 -1.240 19542
469 1 2 . 1 1 46 46 ASN CB C 46 40.053 40.053 39.080 0.973 19542
470 1 2 . 1 1 46 46 ASN H H 46 8.018 8.018 7.936 0.082 19542
471 1 2 . 1 1 47 47 ASN N N 47 120.765 120.765 118.891 1.874 19542
472 1 2 . 1 1 47 47 ASN HA H 47 5.362 5.362 5.370 -0.008 19542
473 1 2 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.701 1.278 19542
474 1 2 . 1 1 47 47 ASN CB C 47 41.749 41.749 40.640 1.109 19542
475 1 2 . 1 1 47 47 ASN H H 47 7.835 7.835 7.933 -0.098 19542
476 1 2 . 1 1 48 48 LYS N N 48 123.576 123.576 125.365 -1.789 19542
477 1 2 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.933 -0.091 19542
478 1 2 . 1 1 48 48 LYS CB C 48 34.398 34.398 36.262 -1.864 19542
479 1 2 . 1 1 48 48 LYS H H 48 8.548 8.548 9.134 -0.586 19542
480 1 2 . 1 1 49 49 CYS N N 49 116.141 116.141 116.629 -0.488 19542
481 1 2 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.846 -0.293 19542
482 1 2 . 1 1 49 49 CYS CA C 49 53.386 53.386 55.601 -2.215 19542
483 1 2 . 1 1 49 49 CYS CB C 49 44.935 44.935 29.492 15.443 19542
484 1 2 . 1 1 49 49 CYS H H 49 8.873 8.873 8.513 0.360 19542
485 1 2 . 1 1 50 50 CYS N N 50 118.484 118.484 119.712 -1.228 19542
486 1 2 . 1 1 50 50 CYS HA H 50 5.265 5.265 4.903 0.362 19542
487 1 2 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.264 -1.281 19542
488 1 2 . 1 1 50 50 CYS CB C 50 46.111 46.111 30.202 15.909 19542
489 1 2 . 1 1 50 50 CYS H H 50 9.389 9.389 9.513 -0.124 19542
490 1 2 . 1 1 51 51 SER N N 51 115.213 115.213 118.530 -3.317 19542
491 1 2 . 1 1 51 51 SER HA H 51 5.016 5.016 4.736 0.280 19542
492 1 2 . 1 1 51 51 SER CA C 51 58.118 58.118 57.870 0.248 19542
493 1 2 . 1 1 51 51 SER CB C 51 64.457 64.457 62.321 2.136 19542
494 1 2 . 1 1 51 51 SER H H 51 9.290 9.290 8.841 0.449 19542
495 1 2 . 1 1 52 52 THR N N 52 112.156 112.156 118.939 -6.783 19542
496 1 2 . 1 1 52 52 THR HA H 52 4.692 4.692 4.512 0.180 19542
497 1 2 . 1 1 52 52 THR CA C 52 59.835 59.835 61.202 -1.367 19542
498 1 2 . 1 1 52 52 THR CB C 52 71.872 71.872 71.594 0.278 19542
499 1 2 . 1 1 52 52 THR H H 52 7.624 7.624 7.686 -0.062 19542
500 1 2 . 1 1 53 53 ASP N N 53 119.869 119.869 121.197 -1.328 19542
501 1 2 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.498 0.472 19542
502 1 2 . 1 1 53 53 ASP CA C 53 55.485 55.485 54.978 0.507 19542
503 1 2 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.915 -0.193 19542
504 1 2 . 1 1 53 53 ASP H H 53 8.410 8.410 8.407 0.003 19542
505 1 2 . 1 1 54 54 ARG N N 54 111.677 111.677 117.573 -5.896 19542
506 1 2 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.562 -0.377 19542
507 1 2 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.517 0.445 19542
508 1 2 . 1 1 54 54 ARG CB C 54 28.429 28.429 27.288 1.141 19542
509 1 2 . 1 1 54 54 ARG H H 54 9.306 9.306 8.940 0.366 19542
510 1 2 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.484 0.077 19542
511 1 2 . 1 1 55 55 CYS CA C 55 57.814 57.814 59.332 -1.518 19542
512 1 2 . 1 1 55 55 CYS CB C 55 46.236 46.236 27.518 18.718 19542
513 1 2 . 1 1 55 55 CYS H H 55 7.995 7.995 7.839 0.156 19542
514 1 2 . 1 1 56 56 ASN N N 56 121.881 121.881 120.117 1.764 19542
515 1 2 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.671 0.139 19542
516 1 2 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.397 -0.031 19542
517 1 2 . 1 1 56 56 ASN CB C 56 37.837 37.837 36.500 1.337 19542
518 1 2 . 1 1 56 56 ASN H H 56 8.755 8.755 8.786 -0.031 19542
519 1 3 . 1 1 2 2 LYS N N 2 126.352 126.352 120.944 5.408 19542
520 1 3 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.276 0.114 19542
521 1 3 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.560 -0.158 19542
522 1 3 . 1 1 2 2 LYS CB C 2 29.734 29.734 32.806 -3.072 19542
523 1 3 . 1 1 2 2 LYS H H 2 8.381 8.381 9.287 -0.906 19542
524 1 3 . 1 1 3 3 CYS N N 3 117.974 117.974 120.977 -3.003 19542
525 1 3 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.519 0.440 19542
526 1 3 . 1 1 3 3 CYS CA C 3 51.272 51.272 58.132 -6.860 19542
527 1 3 . 1 1 3 3 CYS CB C 3 42.039 42.039 32.233 9.806 19542
528 1 3 . 1 1 3 3 CYS H H 3 8.394 8.394 8.799 -0.405 19542
529 1 3 . 1 1 4 4 PHE N N 4 120.016 120.016 120.928 -0.912 19542
530 1 3 . 1 1 4 4 PHE HA H 4 4.606 4.606 4.926 -0.320 19542
531 1 3 . 1 1 4 4 PHE CB C 4 39.719 39.719 36.978 2.741 19542
532 1 3 . 1 1 4 4 PHE H H 4 9.550 9.550 9.151 0.399 19542
533 1 3 . 1 1 5 5 GLN N N 5 120.517 120.517 122.717 -2.200 19542
534 1 3 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.064 0.358 19542
535 1 3 . 1 1 5 5 GLN CA C 5 56.003 56.003 57.899 -1.896 19542
536 1 3 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.582 3.011 19542
537 1 3 . 1 1 5 5 GLN H H 5 9.406 9.406 7.834 1.572 19542
538 1 3 . 1 1 6 6 HIS N N 6 118.478 118.478 115.944 2.534 19542
539 1 3 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.747 -0.269 19542
540 1 3 . 1 1 6 6 HIS CA C 6 56.627 56.627 55.923 0.704 19542
541 1 3 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.103 -2.127 19542
542 1 3 . 1 1 6 6 HIS H H 6 8.827 8.827 7.549 1.278 19542
543 1 3 . 1 1 7 7 GLY N N 7 103.072 103.072 105.817 -2.745 19542
544 1 3 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.517 0.407 19542
545 1 3 . 1 1 7 7 GLY H H 7 8.440 8.440 8.476 -0.036 19542
546 1 3 . 1 1 8 8 LYS N N 8 119.909 119.909 120.793 -0.884 19542
547 1 3 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.856 -0.028 19542
548 1 3 . 1 1 8 8 LYS CB C 8 35.493 35.493 35.123 0.370 19542
549 1 3 . 1 1 8 8 LYS H H 8 7.703 7.703 7.888 -0.185 19542
550 1 3 . 1 1 9 9 VAL N N 9 122.232 122.232 123.193 -0.961 19542
551 1 3 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.823 -0.011 19542
552 1 3 . 1 1 9 9 VAL CA C 9 63.286 63.286 63.033 0.253 19542
553 1 3 . 1 1 9 9 VAL CB C 9 26.812 26.812 31.194 -4.382 19542
554 1 3 . 1 1 9 9 VAL H H 9 8.552 8.552 8.610 -0.058 19542
555 1 3 . 1 1 10 10 VAL N N 10 123.963 123.963 123.277 0.686 19542
556 1 3 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.728 -0.122 19542
557 1 3 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.325 1.067 19542
558 1 3 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.455 -0.673 19542
559 1 3 . 1 1 10 10 VAL H H 10 8.920 8.920 8.769 0.151 19542
560 1 3 . 1 1 11 11 THR N N 11 118.572 118.572 120.325 -1.753 19542
561 1 3 . 1 1 11 11 THR HA H 11 4.443 4.443 4.682 -0.239 19542
562 1 3 . 1 1 11 11 THR CA C 11 62.719 62.719 63.030 -0.311 19542
563 1 3 . 1 1 11 11 THR CB C 11 68.689 68.689 68.723 -0.034 19542
564 1 3 . 1 1 11 11 THR H H 11 8.517 8.517 8.334 0.183 19542
565 1 3 . 1 1 12 12 CYS N N 12 126.835 126.835 126.471 0.364 19542
566 1 3 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.477 0.194 19542
567 1 3 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.647 -5.611 19542
568 1 3 . 1 1 12 12 CYS CB C 12 38.892 38.892 27.788 11.104 19542
569 1 3 . 1 1 12 12 CYS H H 12 8.970 8.970 8.638 0.332 19542
570 1 3 . 1 1 13 13 HIS N N 13 121.091 121.091 121.358 -0.267 19542
571 1 3 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.583 0.066 19542
572 1 3 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.355 -1.857 19542
573 1 3 . 1 1 13 13 HIS H H 13 9.015 9.015 8.484 0.531 19542
574 1 3 . 1 1 14 14 ARG N N 14 120.872 120.872 120.114 0.758 19542
575 1 3 . 1 1 14 14 ARG HA H 14 4.043 4.043 3.953 0.090 19542
576 1 3 . 1 1 14 14 ARG CA C 14 58.962 58.962 58.692 0.270 19542
577 1 3 . 1 1 14 14 ARG CB C 14 30.014 30.014 30.006 0.008 19542
578 1 3 . 1 1 14 14 ARG H H 14 8.689 8.689 7.979 0.710 19542
579 1 3 . 1 1 15 15 ASP N N 15 121.233 121.233 117.678 3.555 19542
580 1 3 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.570 -0.067 19542
581 1 3 . 1 1 15 15 ASP CA C 15 54.306 54.306 56.329 -2.023 19542
582 1 3 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.152 -2.045 19542
583 1 3 . 1 1 15 15 ASP H H 15 8.907 8.907 7.826 1.081 19542
584 1 3 . 1 1 16 16 MET N N 16 119.073 119.073 118.230 0.843 19542
585 1 3 . 1 1 16 16 MET HA H 16 4.415 4.415 4.601 -0.186 19542
586 1 3 . 1 1 16 16 MET CA C 16 55.995 55.995 54.792 1.203 19542
587 1 3 . 1 1 16 16 MET CB C 16 32.662 32.662 31.715 0.947 19542
588 1 3 . 1 1 16 16 MET H H 16 7.811 7.811 7.584 0.227 19542
589 1 3 . 1 1 17 17 LYS N N 17 120.187 120.187 121.339 -1.152 19542
590 1 3 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.222 0.045 19542
591 1 3 . 1 1 17 17 LYS CA C 17 55.889 55.889 57.051 -1.162 19542
592 1 3 . 1 1 17 17 LYS CB C 17 34.106 34.106 33.340 0.766 19542
593 1 3 . 1 1 17 17 LYS H H 17 7.763 7.763 8.203 -0.440 19542
594 1 3 . 1 1 18 18 PHE N N 18 115.631 115.631 117.409 -1.778 19542
595 1 3 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.135 -0.022 19542
596 1 3 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.454 0.517 19542
597 1 3 . 1 1 18 18 PHE CB C 18 43.018 43.018 43.103 -0.085 19542
598 1 3 . 1 1 18 18 PHE H H 18 8.252 8.252 8.186 0.066 19542
599 1 3 . 1 1 19 19 CYS N N 19 115.508 115.508 120.694 -5.186 19542
600 1 3 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.354 0.648 19542
601 1 3 . 1 1 19 19 CYS CA C 19 52.258 52.258 57.734 -5.476 19542
602 1 3 . 1 1 19 19 CYS CB C 19 38.627 38.627 28.286 10.341 19542
603 1 3 . 1 1 19 19 CYS H H 19 9.343 9.343 9.456 -0.113 19542
604 1 3 . 1 1 20 20 TYR N N 20 128.934 128.934 119.131 9.803 19542
605 1 3 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.952 0.255 19542
606 1 3 . 1 1 20 20 TYR CA C 20 55.701 55.701 54.726 0.975 19542
607 1 3 . 1 1 20 20 TYR CB C 20 43.184 43.184 41.169 2.015 19542
608 1 3 . 1 1 20 20 TYR H H 20 8.871 8.871 9.291 -0.420 19542
609 1 3 . 1 1 21 21 HIS N N 21 122.079 122.079 123.053 -0.974 19542
610 1 3 . 1 1 21 21 HIS HA H 21 5.283 5.283 4.858 0.425 19542
611 1 3 . 1 1 21 21 HIS CA C 21 54.713 54.713 54.391 0.322 19542
612 1 3 . 1 1 21 21 HIS CB C 21 31.719 31.719 31.362 0.357 19542
613 1 3 . 1 1 21 21 HIS H H 21 8.797 8.797 9.223 -0.426 19542
614 1 3 . 1 1 22 22 ASN N N 22 128.444 128.444 128.128 0.316 19542
615 1 3 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.373 0.473 19542
616 1 3 . 1 1 22 22 ASN CA C 22 52.512 52.512 52.350 0.162 19542
617 1 3 . 1 1 22 22 ASN CB C 22 40.821 40.821 40.351 0.470 19542
618 1 3 . 1 1 22 22 ASN H H 22 9.823 9.823 8.646 1.177 19542
619 1 3 . 1 1 23 23 THR N N 23 116.691 116.691 117.426 -0.735 19542
620 1 3 . 1 1 23 23 THR HA H 23 4.604 4.604 4.233 0.371 19542
621 1 3 . 1 1 23 23 THR CA C 23 57.003 57.003 62.696 -5.693 19542
622 1 3 . 1 1 23 23 THR CB C 23 69.344 69.344 69.563 -0.219 19542
623 1 3 . 1 1 23 23 THR H H 23 8.561 8.561 8.408 0.153 19542
624 1 3 . 1 1 24 24 GLY N N 24 110.763 110.763 110.273 0.490 19542
625 1 3 . 1 1 24 24 GLY CA C 24 44.993 44.993 45.028 -0.035 19542
626 1 3 . 1 1 24 24 GLY H H 24 8.608 8.608 7.543 1.065 19542
627 1 3 . 1 1 25 25 MET N N 25 120.520 120.520 120.388 0.132 19542
628 1 3 . 1 1 25 25 MET HA H 25 4.818 4.818 4.569 0.249 19542
629 1 3 . 1 1 25 25 MET CA C 25 53.892 53.892 51.211 2.681 19542
630 1 3 . 1 1 25 25 MET CB C 25 32.399 32.399 33.264 -0.865 19542
631 1 3 . 1 1 25 25 MET H H 25 8.418 8.418 7.779 0.639 19542
632 1 3 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.229 0.148 19542
633 1 3 . 1 1 26 26 PRO CA C 26 63.841 63.841 62.946 0.895 19542
634 1 3 . 1 1 26 26 PRO CB C 26 31.750 31.750 31.104 0.646 19542
635 1 3 . 1 1 27 27 PHE N N 27 118.056 118.056 124.123 -6.067 19542
636 1 3 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.778 -0.153 19542
637 1 3 . 1 1 27 27 PHE CA C 27 57.332 57.332 55.814 1.518 19542
638 1 3 . 1 1 27 27 PHE CB C 27 39.701 39.701 41.702 -2.001 19542
639 1 3 . 1 1 27 27 PHE H H 27 7.988 7.988 7.901 0.087 19542
640 1 3 . 1 1 28 28 ARG N N 28 121.294 121.294 122.706 -1.412 19542
641 1 3 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.226 -0.167 19542
642 1 3 . 1 1 28 28 ARG CA C 28 57.142 57.142 56.876 0.266 19542
643 1 3 . 1 1 28 28 ARG CB C 28 29.711 29.711 29.136 0.575 19542
644 1 3 . 1 1 28 28 ARG H H 28 8.333 8.333 9.063 -0.730 19542
645 1 3 . 1 1 29 29 ASN N N 29 116.243 116.243 115.444 0.799 19542
646 1 3 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.336 0.260 19542
647 1 3 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.083 -0.288 19542
648 1 3 . 1 1 29 29 ASN CB C 29 38.239 38.239 37.983 0.256 19542
649 1 3 . 1 1 29 29 ASN H H 29 8.356 8.356 8.932 -0.576 19542
650 1 3 . 1 1 30 30 LEU N N 30 121.660 121.660 120.193 1.467 19542
651 1 3 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.673 -0.228 19542
652 1 3 . 1 1 30 30 LEU CA C 30 55.203 55.203 54.415 0.788 19542
653 1 3 . 1 1 30 30 LEU CB C 30 42.982 42.982 43.752 -0.770 19542
654 1 3 . 1 1 30 30 LEU H H 30 8.028 8.028 7.595 0.433 19542
655 1 3 . 1 1 31 31 LYS N N 31 120.928 120.928 127.174 -6.246 19542
656 1 3 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.488 -0.110 19542
657 1 3 . 1 1 31 31 LYS CA C 31 56.271 56.271 55.332 0.939 19542
658 1 3 . 1 1 31 31 LYS CB C 31 32.230 32.230 32.542 -0.312 19542
659 1 3 . 1 1 31 31 LYS H H 31 8.306 8.306 8.565 -0.259 19542
660 1 3 . 1 1 32 32 LEU N N 32 122.843 122.843 127.180 -4.337 19542
661 1 3 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.440 0.006 19542
662 1 3 . 1 1 32 32 LEU CA C 32 54.484 54.484 54.855 -0.371 19542
663 1 3 . 1 1 32 32 LEU CB C 32 43.404 43.404 42.586 0.818 19542
664 1 3 . 1 1 32 32 LEU H H 32 8.027 8.027 8.569 -0.542 19542
665 1 3 . 1 1 33 33 ILE N N 33 123.311 123.311 128.050 -4.739 19542
666 1 3 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.454 -0.071 19542
667 1 3 . 1 1 33 33 ILE CA C 33 60.595 60.595 58.800 1.795 19542
668 1 3 . 1 1 33 33 ILE CB C 33 38.303 38.303 39.015 -0.712 19542
669 1 3 . 1 1 33 33 ILE H H 33 8.327 8.327 8.054 0.273 19542
670 1 3 . 1 1 34 34 LEU N N 34 128.669 128.669 128.929 -0.260 19542
671 1 3 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.801 -0.007 19542
672 1 3 . 1 1 34 34 LEU CB C 34 42.873 42.873 42.437 0.436 19542
673 1 3 . 1 1 34 34 LEU H H 34 8.880 8.880 8.373 0.507 19542
674 1 3 . 1 1 35 35 GLN N N 35 121.600 121.600 121.785 -0.185 19542
675 1 3 . 1 1 35 35 GLN HA H 35 4.588 4.588 5.084 -0.496 19542
676 1 3 . 1 1 35 35 GLN CA C 35 61.390 61.390 55.085 6.305 19542
677 1 3 . 1 1 35 35 GLN CB C 35 33.866 33.866 30.475 3.391 19542
678 1 3 . 1 1 35 35 GLN H H 35 8.210 8.210 8.238 -0.028 19542
679 1 3 . 1 1 36 36 GLY N N 36 106.726 106.726 109.720 -2.994 19542
680 1 3 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.394 2.484 19542
681 1 3 . 1 1 36 36 GLY H H 36 6.121 6.121 7.360 -1.239 19542
682 1 3 . 1 1 37 37 CYS N N 37 124.584 124.584 118.793 5.791 19542
683 1 3 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.333 0.541 19542
684 1 3 . 1 1 37 37 CYS CA C 37 55.955 55.955 57.882 -1.927 19542
685 1 3 . 1 1 37 37 CYS CB C 37 48.202 48.202 29.297 18.905 19542
686 1 3 . 1 1 37 37 CYS H H 37 8.505 8.505 8.451 0.054 19542
687 1 3 . 1 1 38 38 SER N N 38 115.036 115.036 118.595 -3.559 19542
688 1 3 . 1 1 38 38 SER HA H 38 4.980 4.980 5.053 -0.073 19542
689 1 3 . 1 1 38 38 SER CA C 38 58.792 58.792 56.934 1.858 19542
690 1 3 . 1 1 38 38 SER CB C 38 65.971 65.971 66.189 -0.218 19542
691 1 3 . 1 1 38 38 SER H H 38 9.749 9.749 9.317 0.432 19542
692 1 3 . 1 1 39 39 SER N N 39 117.276 117.276 119.707 -2.431 19542
693 1 3 . 1 1 39 39 SER HA H 39 4.827 4.827 4.975 -0.148 19542
694 1 3 . 1 1 39 39 SER CA C 39 60.040 60.040 59.479 0.561 19542
695 1 3 . 1 1 39 39 SER CB C 39 63.784 63.784 63.723 0.061 19542
696 1 3 . 1 1 39 39 SER H H 39 9.161 9.161 8.915 0.246 19542
697 1 3 . 1 1 40 40 SER N N 40 115.041 115.041 115.796 -0.755 19542
698 1 3 . 1 1 40 40 SER HA H 40 4.660 4.660 4.855 -0.195 19542
699 1 3 . 1 1 40 40 SER CA C 40 55.868 55.868 57.147 -1.279 19542
700 1 3 . 1 1 40 40 SER CB C 40 64.868 64.868 65.785 -0.917 19542
701 1 3 . 1 1 40 40 SER H H 40 7.911 7.911 7.992 -0.081 19542
702 1 3 . 1 1 41 41 CYS N N 41 124.146 124.146 119.120 5.026 19542
703 1 3 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.424 -0.115 19542
704 1 3 . 1 1 41 41 CYS CA C 41 57.567 57.567 58.562 -0.994 19542
705 1 3 . 1 1 41 41 CYS CB C 41 40.000 40.000 29.094 10.906 19542
706 1 3 . 1 1 41 41 CYS H H 41 8.067 8.067 8.219 -0.152 19542
707 1 3 . 1 1 42 42 SER N N 42 118.590 118.590 123.070 -4.480 19542
708 1 3 . 1 1 42 42 SER HA H 42 4.611 4.611 4.488 0.123 19542
709 1 3 . 1 1 42 42 SER CA C 42 59.020 59.020 57.022 1.998 19542
710 1 3 . 1 1 42 42 SER CB C 42 64.112 64.112 63.290 0.822 19542
711 1 3 . 1 1 42 42 SER H H 42 8.491 8.491 8.521 -0.030 19542
712 1 3 . 1 1 43 43 GLU N N 43 118.830 118.830 126.123 -7.293 19542
713 1 3 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.234 0.415 19542
714 1 3 . 1 1 43 43 GLU CA C 43 56.856 56.856 56.583 0.273 19542
715 1 3 . 1 1 43 43 GLU CB C 43 29.206 29.206 29.324 -0.118 19542
716 1 3 . 1 1 43 43 GLU H H 43 8.861 8.861 8.679 0.182 19542
717 1 3 . 1 1 44 44 THR N N 44 117.954 117.954 117.381 0.573 19542
718 1 3 . 1 1 44 44 THR HA H 44 4.619 4.619 4.553 0.066 19542
719 1 3 . 1 1 44 44 THR CB C 44 72.341 72.341 70.793 1.548 19542
720 1 3 . 1 1 44 44 THR H H 44 9.030 9.030 8.003 1.027 19542
721 1 3 . 1 1 45 45 GLU N N 45 127.100 127.100 118.692 8.408 19542
722 1 3 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.265 -0.171 19542
723 1 3 . 1 1 45 45 GLU CA C 45 58.934 58.934 57.266 1.668 19542
724 1 3 . 1 1 45 45 GLU CB C 45 27.009 27.009 30.032 -3.023 19542
725 1 3 . 1 1 45 45 GLU H H 45 8.837 8.837 8.673 0.164 19542
726 1 3 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.525 0.377 19542
727 1 3 . 1 1 46 46 ASN CA C 46 53.244 53.244 54.520 -1.276 19542
728 1 3 . 1 1 46 46 ASN CB C 46 40.053 40.053 39.287 0.766 19542
729 1 3 . 1 1 46 46 ASN H H 46 8.018 8.018 8.108 -0.090 19542
730 1 3 . 1 1 47 47 ASN N N 47 120.765 120.765 117.417 3.348 19542
731 1 3 . 1 1 47 47 ASN HA H 47 5.362 5.362 5.002 0.360 19542
732 1 3 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.443 1.536 19542
733 1 3 . 1 1 47 47 ASN CB C 47 41.749 41.749 39.482 2.267 19542
734 1 3 . 1 1 47 47 ASN H H 47 7.835 7.835 7.428 0.407 19542
735 1 3 . 1 1 48 48 LYS N N 48 123.576 123.576 128.302 -4.726 19542
736 1 3 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.508 0.334 19542
737 1 3 . 1 1 48 48 LYS CB C 48 34.398 34.398 32.754 1.644 19542
738 1 3 . 1 1 48 48 LYS H H 48 8.548 8.548 8.597 -0.049 19542
739 1 3 . 1 1 49 49 CYS N N 49 116.141 116.141 122.742 -6.601 19542
740 1 3 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.630 -0.077 19542
741 1 3 . 1 1 49 49 CYS CA C 49 53.386 53.386 55.897 -2.511 19542
742 1 3 . 1 1 49 49 CYS CB C 49 44.935 44.935 26.169 18.766 19542
743 1 3 . 1 1 49 49 CYS H H 49 8.873 8.873 8.346 0.527 19542
744 1 3 . 1 1 50 50 CYS N N 50 118.484 118.484 124.098 -5.614 19542
745 1 3 . 1 1 50 50 CYS HA H 50 5.265 5.265 4.963 0.302 19542
746 1 3 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.426 -1.444 19542
747 1 3 . 1 1 50 50 CYS CB C 50 46.111 46.111 30.495 15.616 19542
748 1 3 . 1 1 50 50 CYS H H 50 9.389 9.389 9.386 0.003 19542
749 1 3 . 1 1 51 51 SER N N 51 115.213 115.213 115.271 -0.058 19542
750 1 3 . 1 1 51 51 SER HA H 51 5.016 5.016 4.834 0.182 19542
751 1 3 . 1 1 51 51 SER CA C 51 58.118 58.118 58.015 0.103 19542
752 1 3 . 1 1 51 51 SER CB C 51 64.457 64.457 63.208 1.249 19542
753 1 3 . 1 1 51 51 SER H H 51 9.290 9.290 8.608 0.682 19542
754 1 3 . 1 1 52 52 THR N N 52 112.156 112.156 118.587 -6.431 19542
755 1 3 . 1 1 52 52 THR HA H 52 4.692 4.692 4.422 0.270 19542
756 1 3 . 1 1 52 52 THR CA C 52 59.835 59.835 61.545 -1.710 19542
757 1 3 . 1 1 52 52 THR CB C 52 71.872 71.872 71.438 0.434 19542
758 1 3 . 1 1 52 52 THR H H 52 7.624 7.624 7.330 0.294 19542
759 1 3 . 1 1 53 53 ASP N N 53 119.869 119.869 123.303 -3.434 19542
760 1 3 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.372 0.598 19542
761 1 3 . 1 1 53 53 ASP CA C 53 55.485 55.485 55.951 -0.466 19542
762 1 3 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.993 -0.271 19542
763 1 3 . 1 1 53 53 ASP H H 53 8.410 8.410 8.608 -0.198 19542
764 1 3 . 1 1 54 54 ARG N N 54 111.677 111.677 117.794 -6.117 19542
765 1 3 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.646 -0.461 19542
766 1 3 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.322 0.640 19542
767 1 3 . 1 1 54 54 ARG CB C 54 28.429 28.429 27.251 1.178 19542
768 1 3 . 1 1 54 54 ARG H H 54 9.306 9.306 8.653 0.653 19542
769 1 3 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.409 0.152 19542
770 1 3 . 1 1 55 55 CYS CA C 55 57.814 57.814 59.258 -1.444 19542
771 1 3 . 1 1 55 55 CYS CB C 55 46.236 46.236 27.959 18.277 19542
772 1 3 . 1 1 55 55 CYS H H 55 7.995 7.995 7.981 0.014 19542
773 1 3 . 1 1 56 56 ASN N N 56 121.881 121.881 119.714 2.167 19542
774 1 3 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.685 0.125 19542
775 1 3 . 1 1 56 56 ASN CA C 56 52.366 52.366 51.942 0.424 19542
776 1 3 . 1 1 56 56 ASN CB C 56 37.837 37.837 36.680 1.157 19542
777 1 3 . 1 1 56 56 ASN H H 56 8.755 8.755 8.622 0.133 19542
778 1 4 . 1 1 2 2 LYS N N 2 126.352 126.352 120.844 5.508 19542
779 1 4 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.256 0.134 19542
780 1 4 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.652 -0.250 19542
781 1 4 . 1 1 2 2 LYS CB C 2 29.734 29.734 33.027 -3.293 19542
782 1 4 . 1 1 2 2 LYS H H 2 8.381 8.381 8.275 0.106 19542
783 1 4 . 1 1 3 3 CYS N N 3 117.974 117.974 120.648 -2.674 19542
784 1 4 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.599 0.360 19542
785 1 4 . 1 1 3 3 CYS CA C 3 51.272 51.272 57.563 -6.291 19542
786 1 4 . 1 1 3 3 CYS CB C 3 42.039 42.039 31.430 10.609 19542
787 1 4 . 1 1 3 3 CYS H H 3 8.394 8.394 8.558 -0.164 19542
788 1 4 . 1 1 4 4 PHE N N 4 120.016 120.016 120.737 -0.721 19542
789 1 4 . 1 1 4 4 PHE HA H 4 4.606 4.606 4.948 -0.342 19542
790 1 4 . 1 1 4 4 PHE CB C 4 39.719 39.719 36.950 2.769 19542
791 1 4 . 1 1 4 4 PHE H H 4 9.550 9.550 9.164 0.386 19542
792 1 4 . 1 1 5 5 GLN N N 5 120.517 120.517 122.962 -2.445 19542
793 1 4 . 1 1 5 5 GLN HA H 5 4.422 4.422 3.951 0.471 19542
794 1 4 . 1 1 5 5 GLN CA C 5 56.003 56.003 58.524 -2.521 19542
795 1 4 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.163 3.431 19542
796 1 4 . 1 1 5 5 GLN H H 5 9.406 9.406 7.883 1.523 19542
797 1 4 . 1 1 6 6 HIS N N 6 118.478 118.478 115.807 2.671 19542
798 1 4 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.731 -0.253 19542
799 1 4 . 1 1 6 6 HIS CA C 6 56.627 56.627 56.341 0.286 19542
800 1 4 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.388 -2.412 19542
801 1 4 . 1 1 6 6 HIS H H 6 8.827 8.827 7.435 1.392 19542
802 1 4 . 1 1 7 7 GLY N N 7 103.072 103.072 106.878 -3.806 19542
803 1 4 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.332 0.592 19542
804 1 4 . 1 1 7 7 GLY H H 7 8.440 8.440 8.385 0.055 19542
805 1 4 . 1 1 8 8 LYS N N 8 119.909 119.909 120.088 -0.179 19542
806 1 4 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.844 -0.016 19542
807 1 4 . 1 1 8 8 LYS CB C 8 35.493 35.493 34.891 0.602 19542
808 1 4 . 1 1 8 8 LYS H H 8 7.703 7.703 7.974 -0.271 19542
809 1 4 . 1 1 9 9 VAL N N 9 122.232 122.232 124.391 -2.159 19542
810 1 4 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.982 -0.170 19542
811 1 4 . 1 1 9 9 VAL CA C 9 63.286 63.286 63.036 0.250 19542
812 1 4 . 1 1 9 9 VAL CB C 9 26.812 26.812 31.549 -4.737 19542
813 1 4 . 1 1 9 9 VAL H H 9 8.552 8.552 8.652 -0.100 19542
814 1 4 . 1 1 10 10 VAL N N 10 123.963 123.963 124.720 -0.757 19542
815 1 4 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.737 -0.131 19542
816 1 4 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.537 0.855 19542
817 1 4 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.176 -0.394 19542
818 1 4 . 1 1 10 10 VAL H H 10 8.920 8.920 8.735 0.185 19542
819 1 4 . 1 1 11 11 THR N N 11 118.572 118.572 120.146 -1.574 19542
820 1 4 . 1 1 11 11 THR HA H 11 4.443 4.443 4.405 0.038 19542
821 1 4 . 1 1 11 11 THR CA C 11 62.719 62.719 62.944 -0.225 19542
822 1 4 . 1 1 11 11 THR CB C 11 68.689 68.689 68.825 -0.136 19542
823 1 4 . 1 1 11 11 THR H H 11 8.517 8.517 8.138 0.379 19542
824 1 4 . 1 1 12 12 CYS N N 12 126.835 126.835 126.333 0.502 19542
825 1 4 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.461 0.210 19542
826 1 4 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.537 -5.501 19542
827 1 4 . 1 1 12 12 CYS CB C 12 38.892 38.892 27.464 11.428 19542
828 1 4 . 1 1 12 12 CYS H H 12 8.970 8.970 8.459 0.511 19542
829 1 4 . 1 1 13 13 HIS N N 13 121.091 121.091 122.551 -1.460 19542
830 1 4 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.492 0.157 19542
831 1 4 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.178 -1.680 19542
832 1 4 . 1 1 13 13 HIS H H 13 9.015 9.015 8.632 0.383 19542
833 1 4 . 1 1 14 14 ARG N N 14 120.872 120.872 121.111 -0.239 19542
834 1 4 . 1 1 14 14 ARG HA H 14 4.043 4.043 3.954 0.089 19542
835 1 4 . 1 1 14 14 ARG CA C 14 58.962 58.962 58.210 0.752 19542
836 1 4 . 1 1 14 14 ARG CB C 14 30.014 30.014 29.853 0.161 19542
837 1 4 . 1 1 14 14 ARG H H 14 8.689 8.689 7.822 0.867 19542
838 1 4 . 1 1 15 15 ASP N N 15 121.233 121.233 118.594 2.639 19542
839 1 4 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.644 -0.141 19542
840 1 4 . 1 1 15 15 ASP CA C 15 54.306 54.306 55.645 -1.339 19542
841 1 4 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.673 -2.566 19542
842 1 4 . 1 1 15 15 ASP H H 15 8.907 8.907 7.958 0.949 19542
843 1 4 . 1 1 16 16 MET N N 16 119.073 119.073 119.379 -0.306 19542
844 1 4 . 1 1 16 16 MET HA H 16 4.415 4.415 4.683 -0.268 19542
845 1 4 . 1 1 16 16 MET CA C 16 55.995 55.995 54.916 1.079 19542
846 1 4 . 1 1 16 16 MET CB C 16 32.662 32.662 31.380 1.282 19542
847 1 4 . 1 1 16 16 MET H H 16 7.811 7.811 7.746 0.065 19542
848 1 4 . 1 1 17 17 LYS N N 17 120.187 120.187 121.085 -0.898 19542
849 1 4 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.285 -0.018 19542
850 1 4 . 1 1 17 17 LYS CA C 17 55.889 55.889 56.626 -0.737 19542
851 1 4 . 1 1 17 17 LYS CB C 17 34.106 34.106 33.206 0.900 19542
852 1 4 . 1 1 17 17 LYS H H 17 7.763 7.763 8.209 -0.446 19542
853 1 4 . 1 1 18 18 PHE N N 18 115.631 115.631 117.716 -2.085 19542
854 1 4 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.191 -0.078 19542
855 1 4 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.399 0.572 19542
856 1 4 . 1 1 18 18 PHE CB C 18 43.018 43.018 43.343 -0.325 19542
857 1 4 . 1 1 18 18 PHE H H 18 8.252 8.252 8.284 -0.031 19542
858 1 4 . 1 1 19 19 CYS N N 19 115.508 115.508 120.292 -4.784 19542
859 1 4 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.138 0.864 19542
860 1 4 . 1 1 19 19 CYS CA C 19 52.258 52.258 58.002 -5.744 19542
861 1 4 . 1 1 19 19 CYS CB C 19 38.627 38.627 27.480 11.147 19542
862 1 4 . 1 1 19 19 CYS H H 19 9.343 9.343 9.365 -0.022 19542
863 1 4 . 1 1 20 20 TYR N N 20 128.934 128.934 119.265 9.669 19542
864 1 4 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.623 0.584 19542
865 1 4 . 1 1 20 20 TYR CA C 20 55.701 55.701 55.017 0.684 19542
866 1 4 . 1 1 20 20 TYR CB C 20 43.184 43.184 40.903 2.281 19542
867 1 4 . 1 1 20 20 TYR H H 20 8.871 8.871 8.975 -0.104 19542
868 1 4 . 1 1 21 21 HIS N N 21 122.079 122.079 122.957 -0.878 19542
869 1 4 . 1 1 21 21 HIS HA H 21 5.283 5.283 4.870 0.413 19542
870 1 4 . 1 1 21 21 HIS CA C 21 54.713 54.713 54.535 0.178 19542
871 1 4 . 1 1 21 21 HIS CB C 21 31.719 31.719 31.604 0.115 19542
872 1 4 . 1 1 21 21 HIS H H 21 8.797 8.797 9.385 -0.588 19542
873 1 4 . 1 1 22 22 ASN N N 22 128.444 128.444 128.298 0.146 19542
874 1 4 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.581 0.265 19542
875 1 4 . 1 1 22 22 ASN CA C 22 52.512 52.512 51.938 0.574 19542
876 1 4 . 1 1 22 22 ASN CB C 22 40.821 40.821 41.027 -0.206 19542
877 1 4 . 1 1 22 22 ASN H H 22 9.823 9.823 8.552 1.271 19542
878 1 4 . 1 1 23 23 THR N N 23 116.691 116.691 117.531 -0.840 19542
879 1 4 . 1 1 23 23 THR HA H 23 4.604 4.604 4.368 0.236 19542
880 1 4 . 1 1 23 23 THR CA C 23 57.003 57.003 63.228 -6.225 19542
881 1 4 . 1 1 23 23 THR CB C 23 69.344 69.344 69.504 -0.160 19542
882 1 4 . 1 1 23 23 THR H H 23 8.561 8.561 8.541 0.020 19542
883 1 4 . 1 1 24 24 GLY N N 24 110.763 110.763 111.298 -0.535 19542
884 1 4 . 1 1 24 24 GLY CA C 24 44.993 44.993 44.985 0.008 19542
885 1 4 . 1 1 24 24 GLY H H 24 8.608 8.608 7.969 0.639 19542
886 1 4 . 1 1 25 25 MET N N 25 120.520 120.520 122.386 -1.866 19542
887 1 4 . 1 1 25 25 MET HA H 25 4.818 4.818 4.532 0.286 19542
888 1 4 . 1 1 25 25 MET CA C 25 53.892 53.892 53.129 0.763 19542
889 1 4 . 1 1 25 25 MET CB C 25 32.399 32.399 33.111 -0.712 19542
890 1 4 . 1 1 25 25 MET H H 25 8.418 8.418 8.268 0.150 19542
891 1 4 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.354 0.023 19542
892 1 4 . 1 1 26 26 PRO CA C 26 63.841 63.841 62.716 1.125 19542
893 1 4 . 1 1 26 26 PRO CB C 26 31.750 31.750 31.773 -0.024 19542
894 1 4 . 1 1 27 27 PHE N N 27 118.056 118.056 123.116 -5.060 19542
895 1 4 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.788 -0.163 19542
896 1 4 . 1 1 27 27 PHE CA C 27 57.332 57.332 56.458 0.874 19542
897 1 4 . 1 1 27 27 PHE CB C 27 39.701 39.701 41.995 -2.293 19542
898 1 4 . 1 1 27 27 PHE H H 27 7.988 7.988 8.391 -0.403 19542
899 1 4 . 1 1 28 28 ARG N N 28 121.294 121.294 124.820 -3.526 19542
900 1 4 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.292 -0.233 19542
901 1 4 . 1 1 28 28 ARG CA C 28 57.142 57.142 57.252 -0.110 19542
902 1 4 . 1 1 28 28 ARG CB C 28 29.711 29.711 30.221 -0.510 19542
903 1 4 . 1 1 28 28 ARG H H 28 8.333 8.333 8.899 -0.566 19542
904 1 4 . 1 1 29 29 ASN N N 29 116.243 116.243 120.148 -3.905 19542
905 1 4 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.372 0.224 19542
906 1 4 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.080 -0.285 19542
907 1 4 . 1 1 29 29 ASN CB C 29 38.239 38.239 38.306 -0.067 19542
908 1 4 . 1 1 29 29 ASN H H 29 8.356 8.356 9.030 -0.674 19542
909 1 4 . 1 1 30 30 LEU N N 30 121.660 121.660 120.179 1.481 19542
910 1 4 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.662 -0.217 19542
911 1 4 . 1 1 30 30 LEU CA C 30 55.203 55.203 54.593 0.610 19542
912 1 4 . 1 1 30 30 LEU CB C 30 42.982 42.982 43.752 -0.770 19542
913 1 4 . 1 1 30 30 LEU H H 30 8.028 8.028 7.607 0.421 19542
914 1 4 . 1 1 31 31 LYS N N 31 120.928 120.928 126.443 -5.515 19542
915 1 4 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.480 -0.102 19542
916 1 4 . 1 1 31 31 LYS CA C 31 56.271 56.271 55.312 0.959 19542
917 1 4 . 1 1 31 31 LYS CB C 31 32.230 32.230 32.362 -0.132 19542
918 1 4 . 1 1 31 31 LYS H H 31 8.306 8.306 8.518 -0.212 19542
919 1 4 . 1 1 32 32 LEU N N 32 122.843 122.843 126.650 -3.807 19542
920 1 4 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.418 0.028 19542
921 1 4 . 1 1 32 32 LEU CA C 32 54.484 54.484 54.903 -0.419 19542
922 1 4 . 1 1 32 32 LEU CB C 32 43.404 43.404 42.588 0.816 19542
923 1 4 . 1 1 32 32 LEU H H 32 8.027 8.027 8.546 -0.519 19542
924 1 4 . 1 1 33 33 ILE N N 33 123.311 123.311 128.355 -5.044 19542
925 1 4 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.404 -0.021 19542
926 1 4 . 1 1 33 33 ILE CA C 33 60.595 60.595 59.278 1.317 19542
927 1 4 . 1 1 33 33 ILE CB C 33 38.303 38.303 37.633 0.670 19542
928 1 4 . 1 1 33 33 ILE H H 33 8.327 8.327 8.365 -0.038 19542
929 1 4 . 1 1 34 34 LEU N N 34 128.669 128.669 129.611 -0.942 19542
930 1 4 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.757 0.037 19542
931 1 4 . 1 1 34 34 LEU CB C 34 42.873 42.873 41.493 1.380 19542
932 1 4 . 1 1 34 34 LEU H H 34 8.880 8.880 8.516 0.364 19542
933 1 4 . 1 1 35 35 GLN N N 35 121.600 121.600 119.872 1.728 19542
934 1 4 . 1 1 35 35 GLN HA H 35 4.588 4.588 4.871 -0.283 19542
935 1 4 . 1 1 35 35 GLN CA C 35 61.390 61.390 55.246 6.144 19542
936 1 4 . 1 1 35 35 GLN CB C 35 33.866 33.866 30.826 3.040 19542
937 1 4 . 1 1 35 35 GLN H H 35 8.210 8.210 7.685 0.525 19542
938 1 4 . 1 1 36 36 GLY N N 36 106.726 106.726 109.094 -2.368 19542
939 1 4 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.934 1.944 19542
940 1 4 . 1 1 36 36 GLY H H 36 6.121 6.121 7.311 -1.190 19542
941 1 4 . 1 1 37 37 CYS N N 37 124.584 124.584 118.660 5.924 19542
942 1 4 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.195 0.679 19542
943 1 4 . 1 1 37 37 CYS CA C 37 55.955 55.955 57.903 -1.948 19542
944 1 4 . 1 1 37 37 CYS CB C 37 48.202 48.202 29.833 18.369 19542
945 1 4 . 1 1 37 37 CYS H H 37 8.505 8.505 8.313 0.192 19542
946 1 4 . 1 1 38 38 SER N N 38 115.036 115.036 118.811 -3.775 19542
947 1 4 . 1 1 38 38 SER HA H 38 4.980 4.980 5.040 -0.060 19542
948 1 4 . 1 1 38 38 SER CA C 38 58.792 58.792 56.974 1.819 19542
949 1 4 . 1 1 38 38 SER CB C 38 65.971 65.971 66.264 -0.293 19542
950 1 4 . 1 1 38 38 SER H H 38 9.749 9.749 9.258 0.491 19542
951 1 4 . 1 1 39 39 SER N N 39 117.276 117.276 120.307 -3.031 19542
952 1 4 . 1 1 39 39 SER HA H 39 4.827 4.827 4.848 -0.021 19542
953 1 4 . 1 1 39 39 SER CA C 39 60.040 60.040 59.754 0.286 19542
954 1 4 . 1 1 39 39 SER CB C 39 63.784 63.784 63.712 0.072 19542
955 1 4 . 1 1 39 39 SER H H 39 9.161 9.161 8.925 0.236 19542
956 1 4 . 1 1 40 40 SER N N 40 115.041 115.041 115.375 -0.334 19542
957 1 4 . 1 1 40 40 SER HA H 40 4.660 4.660 4.818 -0.158 19542
958 1 4 . 1 1 40 40 SER CA C 40 55.868 55.868 57.472 -1.604 19542
959 1 4 . 1 1 40 40 SER CB C 40 64.868 64.868 66.004 -1.136 19542
960 1 4 . 1 1 40 40 SER H H 40 7.911 7.911 7.796 0.115 19542
961 1 4 . 1 1 41 41 CYS N N 41 124.146 124.146 119.106 5.040 19542
962 1 4 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.534 -0.225 19542
963 1 4 . 1 1 41 41 CYS CA C 41 57.567 57.567 57.530 0.037 19542
964 1 4 . 1 1 41 41 CYS CB C 41 40.000 40.000 28.066 11.934 19542
965 1 4 . 1 1 41 41 CYS H H 41 8.067 8.067 8.272 -0.205 19542
966 1 4 . 1 1 42 42 SER N N 42 118.590 118.590 121.770 -3.180 19542
967 1 4 . 1 1 42 42 SER HA H 42 4.611 4.611 4.554 0.057 19542
968 1 4 . 1 1 42 42 SER CA C 42 59.020 59.020 57.702 1.318 19542
969 1 4 . 1 1 42 42 SER CB C 42 64.112 64.112 64.848 -0.736 19542
970 1 4 . 1 1 42 42 SER H H 42 8.491 8.491 8.309 0.182 19542
971 1 4 . 1 1 43 43 GLU N N 43 118.830 118.830 118.568 0.262 19542
972 1 4 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.338 0.311 19542
973 1 4 . 1 1 43 43 GLU CA C 43 56.856 56.856 56.439 0.417 19542
974 1 4 . 1 1 43 43 GLU CB C 43 29.206 29.206 29.373 -0.167 19542
975 1 4 . 1 1 43 43 GLU H H 43 8.861 8.861 8.626 0.235 19542
976 1 4 . 1 1 44 44 THR N N 44 117.954 117.954 112.257 5.697 19542
977 1 4 . 1 1 44 44 THR HA H 44 4.619 4.619 4.333 0.286 19542
978 1 4 . 1 1 44 44 THR CB C 44 72.341 72.341 70.371 1.970 19542
979 1 4 . 1 1 44 44 THR H H 44 9.030 9.030 7.593 1.438 19542
980 1 4 . 1 1 45 45 GLU N N 45 127.100 127.100 121.747 5.353 19542
981 1 4 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.183 -0.089 19542
982 1 4 . 1 1 45 45 GLU CA C 45 58.934 58.934 58.682 0.252 19542
983 1 4 . 1 1 45 45 GLU CB C 45 27.009 27.009 29.990 -2.981 19542
984 1 4 . 1 1 45 45 GLU H H 45 8.837 8.837 8.794 0.043 19542
985 1 4 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.478 0.424 19542
986 1 4 . 1 1 46 46 ASN CA C 46 53.244 53.244 55.494 -2.250 19542
987 1 4 . 1 1 46 46 ASN CB C 46 40.053 40.053 39.046 1.007 19542
988 1 4 . 1 1 46 46 ASN H H 46 8.018 8.018 8.604 -0.586 19542
989 1 4 . 1 1 47 47 ASN N N 47 120.765 120.765 117.079 3.686 19542
990 1 4 . 1 1 47 47 ASN HA H 47 5.362 5.362 5.360 0.002 19542
991 1 4 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.080 1.899 19542
992 1 4 . 1 1 47 47 ASN CB C 47 41.749 41.749 39.768 1.981 19542
993 1 4 . 1 1 47 47 ASN H H 47 7.835 7.835 8.096 -0.261 19542
994 1 4 . 1 1 48 48 LYS N N 48 123.576 123.576 126.056 -2.480 19542
995 1 4 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.720 0.122 19542
996 1 4 . 1 1 48 48 LYS CB C 48 34.398 34.398 35.377 -0.979 19542
997 1 4 . 1 1 48 48 LYS H H 48 8.548 8.548 8.896 -0.348 19542
998 1 4 . 1 1 49 49 CYS N N 49 116.141 116.141 116.271 -0.130 19542
999 1 4 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.971 -0.418 19542
1000 1 4 . 1 1 49 49 CYS CA C 49 53.386 53.386 55.604 -2.218 19542
1001 1 4 . 1 1 49 49 CYS CB C 49 44.935 44.935 29.299 15.636 19542
1002 1 4 . 1 1 49 49 CYS H H 49 8.873 8.873 8.403 0.470 19542
1003 1 4 . 1 1 50 50 CYS N N 50 118.484 118.484 119.913 -1.429 19542
1004 1 4 . 1 1 50 50 CYS HA H 50 5.265 5.265 4.894 0.371 19542
1005 1 4 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.247 -1.264 19542
1006 1 4 . 1 1 50 50 CYS CB C 50 46.111 46.111 30.288 15.823 19542
1007 1 4 . 1 1 50 50 CYS H H 50 9.389 9.389 9.282 0.107 19542
1008 1 4 . 1 1 51 51 SER N N 51 115.213 115.213 118.659 -3.446 19542
1009 1 4 . 1 1 51 51 SER HA H 51 5.016 5.016 4.682 0.334 19542
1010 1 4 . 1 1 51 51 SER CA C 51 58.118 58.118 57.821 0.297 19542
1011 1 4 . 1 1 51 51 SER CB C 51 64.457 64.457 62.090 2.367 19542
1012 1 4 . 1 1 51 51 SER H H 51 9.290 9.290 8.839 0.451 19542
1013 1 4 . 1 1 52 52 THR N N 52 112.156 112.156 118.715 -6.559 19542
1014 1 4 . 1 1 52 52 THR HA H 52 4.692 4.692 4.478 0.214 19542
1015 1 4 . 1 1 52 52 THR CA C 52 59.835 59.835 61.147 -1.312 19542
1016 1 4 . 1 1 52 52 THR CB C 52 71.872 71.872 71.668 0.204 19542
1017 1 4 . 1 1 52 52 THR H H 52 7.624 7.624 7.646 -0.022 19542
1018 1 4 . 1 1 53 53 ASP N N 53 119.869 119.869 121.745 -1.876 19542
1019 1 4 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.372 0.598 19542
1020 1 4 . 1 1 53 53 ASP CA C 53 55.485 55.485 54.943 0.542 19542
1021 1 4 . 1 1 53 53 ASP CB C 53 40.722 40.722 41.026 -0.304 19542
1022 1 4 . 1 1 53 53 ASP H H 53 8.410 8.410 8.367 0.043 19542
1023 1 4 . 1 1 54 54 ARG N N 54 111.677 111.677 117.721 -6.044 19542
1024 1 4 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.294 -0.109 19542
1025 1 4 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.077 0.885 19542
1026 1 4 . 1 1 54 54 ARG CB C 54 28.429 28.429 26.790 1.639 19542
1027 1 4 . 1 1 54 54 ARG H H 54 9.306 9.306 8.584 0.722 19542
1028 1 4 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.495 0.066 19542
1029 1 4 . 1 1 55 55 CYS CA C 55 57.814 57.814 58.801 -0.987 19542
1030 1 4 . 1 1 55 55 CYS CB C 55 46.236 46.236 27.624 18.612 19542
1031 1 4 . 1 1 55 55 CYS H H 55 7.995 7.995 7.758 0.237 19542
1032 1 4 . 1 1 56 56 ASN N N 56 121.881 121.881 120.525 1.356 19542
1033 1 4 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.626 0.184 19542
1034 1 4 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.572 -0.205 19542
1035 1 4 . 1 1 56 56 ASN CB C 56 37.837 37.837 36.483 1.354 19542
1036 1 4 . 1 1 56 56 ASN H H 56 8.755 8.755 8.564 0.191 19542
1037 1 5 . 1 1 2 2 LYS N N 2 126.352 126.352 121.248 5.104 19542
1038 1 5 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.392 -0.002 19542
1039 1 5 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.648 -0.246 19542
1040 1 5 . 1 1 2 2 LYS CB C 2 29.734 29.734 33.075 -3.341 19542
1041 1 5 . 1 1 2 2 LYS H H 2 8.381 8.381 8.288 0.093 19542
1042 1 5 . 1 1 3 3 CYS N N 3 117.974 117.974 120.873 -2.899 19542
1043 1 5 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.540 0.419 19542
1044 1 5 . 1 1 3 3 CYS CA C 3 51.272 51.272 58.220 -6.948 19542
1045 1 5 . 1 1 3 3 CYS CB C 3 42.039 42.039 32.212 9.827 19542
1046 1 5 . 1 1 3 3 CYS H H 3 8.394 8.394 8.822 -0.428 19542
1047 1 5 . 1 1 4 4 PHE N N 4 120.016 120.016 120.676 -0.660 19542
1048 1 5 . 1 1 4 4 PHE HA H 4 4.606 4.606 5.006 -0.400 19542
1049 1 5 . 1 1 4 4 PHE CB C 4 39.719 39.719 36.609 3.110 19542
1050 1 5 . 1 1 4 4 PHE H H 4 9.550 9.550 9.327 0.223 19542
1051 1 5 . 1 1 5 5 GLN N N 5 120.517 120.517 121.619 -1.102 19542
1052 1 5 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.209 0.213 19542
1053 1 5 . 1 1 5 5 GLN CA C 5 56.003 56.003 58.033 -2.030 19542
1054 1 5 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.065 3.529 19542
1055 1 5 . 1 1 5 5 GLN H H 5 9.406 9.406 8.078 1.328 19542
1056 1 5 . 1 1 6 6 HIS N N 6 118.478 118.478 116.566 1.912 19542
1057 1 5 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.624 -0.146 19542
1058 1 5 . 1 1 6 6 HIS CA C 6 56.627 56.627 56.072 0.555 19542
1059 1 5 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.842 -2.866 19542
1060 1 5 . 1 1 6 6 HIS H H 6 8.827 8.827 7.582 1.245 19542
1061 1 5 . 1 1 7 7 GLY N N 7 103.072 103.072 105.451 -2.379 19542
1062 1 5 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.027 0.897 19542
1063 1 5 . 1 1 7 7 GLY H H 7 8.440 8.440 8.691 -0.252 19542
1064 1 5 . 1 1 8 8 LYS N N 8 119.909 119.909 120.908 -0.999 19542
1065 1 5 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.854 -0.026 19542
1066 1 5 . 1 1 8 8 LYS CB C 8 35.493 35.493 34.924 0.569 19542
1067 1 5 . 1 1 8 8 LYS H H 8 7.703 7.703 7.830 -0.127 19542
1068 1 5 . 1 1 9 9 VAL N N 9 122.232 122.232 122.117 0.115 19542
1069 1 5 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.763 0.049 19542
1070 1 5 . 1 1 9 9 VAL CA C 9 63.286 63.286 62.979 0.307 19542
1071 1 5 . 1 1 9 9 VAL CB C 9 26.812 26.812 30.622 -3.810 19542
1072 1 5 . 1 1 9 9 VAL H H 9 8.552 8.552 8.465 0.087 19542
1073 1 5 . 1 1 10 10 VAL N N 10 123.963 123.963 124.130 -0.167 19542
1074 1 5 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.595 0.011 19542
1075 1 5 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.123 1.269 19542
1076 1 5 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.515 -0.733 19542
1077 1 5 . 1 1 10 10 VAL H H 10 8.920 8.920 8.586 0.334 19542
1078 1 5 . 1 1 11 11 THR N N 11 118.572 118.572 119.187 -0.615 19542
1079 1 5 . 1 1 11 11 THR HA H 11 4.443 4.443 4.616 -0.173 19542
1080 1 5 . 1 1 11 11 THR CA C 11 62.719 62.719 62.923 -0.204 19542
1081 1 5 . 1 1 11 11 THR CB C 11 68.689 68.689 68.061 0.628 19542
1082 1 5 . 1 1 11 11 THR H H 11 8.517 8.517 8.296 0.221 19542
1083 1 5 . 1 1 12 12 CYS N N 12 126.835 126.835 126.142 0.693 19542
1084 1 5 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.430 0.241 19542
1085 1 5 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.907 -5.872 19542
1086 1 5 . 1 1 12 12 CYS CB C 12 38.892 38.892 27.422 11.470 19542
1087 1 5 . 1 1 12 12 CYS H H 12 8.970 8.970 8.743 0.227 19542
1088 1 5 . 1 1 13 13 HIS N N 13 121.091 121.091 124.183 -3.092 19542
1089 1 5 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.375 0.274 19542
1090 1 5 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.373 -1.875 19542
1091 1 5 . 1 1 13 13 HIS H H 13 9.015 9.015 8.633 0.382 19542
1092 1 5 . 1 1 14 14 ARG N N 14 120.872 120.872 121.369 -0.497 19542
1093 1 5 . 1 1 14 14 ARG HA H 14 4.043 4.043 4.017 0.026 19542
1094 1 5 . 1 1 14 14 ARG CA C 14 58.962 58.962 57.921 1.041 19542
1095 1 5 . 1 1 14 14 ARG CB C 14 30.014 30.014 29.489 0.525 19542
1096 1 5 . 1 1 14 14 ARG H H 14 8.689 8.689 8.179 0.510 19542
1097 1 5 . 1 1 15 15 ASP N N 15 121.233 121.233 118.927 2.306 19542
1098 1 5 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.555 -0.052 19542
1099 1 5 . 1 1 15 15 ASP CA C 15 54.306 54.306 56.527 -2.221 19542
1100 1 5 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.124 -2.017 19542
1101 1 5 . 1 1 15 15 ASP H H 15 8.907 8.907 7.838 1.069 19542
1102 1 5 . 1 1 16 16 MET N N 16 119.073 119.073 118.561 0.512 19542
1103 1 5 . 1 1 16 16 MET HA H 16 4.415 4.415 4.642 -0.227 19542
1104 1 5 . 1 1 16 16 MET CA C 16 55.995 55.995 54.770 1.225 19542
1105 1 5 . 1 1 16 16 MET CB C 16 32.662 32.662 31.302 1.359 19542
1106 1 5 . 1 1 16 16 MET H H 16 7.811 7.811 7.801 0.010 19542
1107 1 5 . 1 1 17 17 LYS N N 17 120.187 120.187 121.859 -1.672 19542
1108 1 5 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.145 0.122 19542
1109 1 5 . 1 1 17 17 LYS CA C 17 55.889 55.889 57.351 -1.462 19542
1110 1 5 . 1 1 17 17 LYS CB C 17 34.106 34.106 33.230 0.876 19542
1111 1 5 . 1 1 17 17 LYS H H 17 7.763 7.763 8.111 -0.348 19542
1112 1 5 . 1 1 18 18 PHE N N 18 115.631 115.631 117.284 -1.653 19542
1113 1 5 . 1 1 18 18 PHE HA H 18 5.113 5.113 4.985 0.128 19542
1114 1 5 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.562 0.409 19542
1115 1 5 . 1 1 18 18 PHE CB C 18 43.018 43.018 42.346 0.672 19542
1116 1 5 . 1 1 18 18 PHE H H 18 8.252 8.252 8.022 0.230 19542
1117 1 5 . 1 1 19 19 CYS N N 19 115.508 115.508 121.981 -6.473 19542
1118 1 5 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.266 0.736 19542
1119 1 5 . 1 1 19 19 CYS CA C 19 52.258 52.258 58.005 -5.747 19542
1120 1 5 . 1 1 19 19 CYS CB C 19 38.627 38.627 27.352 11.275 19542
1121 1 5 . 1 1 19 19 CYS H H 19 9.343 9.343 9.361 -0.018 19542
1122 1 5 . 1 1 20 20 TYR N N 20 128.934 128.934 120.569 8.365 19542
1123 1 5 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.463 0.744 19542
1124 1 5 . 1 1 20 20 TYR CA C 20 55.701 55.701 54.881 0.820 19542
1125 1 5 . 1 1 20 20 TYR CB C 20 43.184 43.184 40.951 2.233 19542
1126 1 5 . 1 1 20 20 TYR H H 20 8.871 8.871 9.063 -0.192 19542
1127 1 5 . 1 1 21 21 HIS N N 21 122.079 122.079 121.066 1.013 19542
1128 1 5 . 1 1 21 21 HIS HA H 21 5.283 5.283 4.899 0.384 19542
1129 1 5 . 1 1 21 21 HIS CA C 21 54.713 54.713 54.605 0.108 19542
1130 1 5 . 1 1 21 21 HIS CB C 21 31.719 31.719 31.501 0.218 19542
1131 1 5 . 1 1 21 21 HIS H H 21 8.797 8.797 9.490 -0.693 19542
1132 1 5 . 1 1 22 22 ASN N N 22 128.444 128.444 127.685 0.759 19542
1133 1 5 . 1 1 22 22 ASN HA H 22 5.846 5.846 4.922 0.924 19542
1134 1 5 . 1 1 22 22 ASN CA C 22 52.512 52.512 52.657 -0.145 19542
1135 1 5 . 1 1 22 22 ASN CB C 22 40.821 40.821 40.928 -0.107 19542
1136 1 5 . 1 1 22 22 ASN H H 22 9.823 9.823 8.690 1.133 19542
1137 1 5 . 1 1 23 23 THR N N 23 116.691 116.691 121.265 -4.574 19542
1138 1 5 . 1 1 23 23 THR HA H 23 4.604 4.604 5.073 -0.469 19542
1139 1 5 . 1 1 23 23 THR CA C 23 57.003 57.003 60.008 -3.006 19542
1140 1 5 . 1 1 23 23 THR CB C 23 69.344 69.344 70.547 -1.203 19542
1141 1 5 . 1 1 23 23 THR H H 23 8.561 8.561 7.675 0.886 19542
1142 1 5 . 1 1 24 24 GLY N N 24 110.763 110.763 114.893 -4.130 19542
1143 1 5 . 1 1 24 24 GLY CA C 24 44.993 44.993 44.552 0.441 19542
1144 1 5 . 1 1 24 24 GLY H H 24 8.608 8.608 8.763 -0.155 19542
1145 1 5 . 1 1 25 25 MET N N 25 120.520 120.520 119.061 1.459 19542
1146 1 5 . 1 1 25 25 MET HA H 25 4.818 4.818 4.460 0.358 19542
1147 1 5 . 1 1 25 25 MET CA C 25 53.892 53.892 53.211 0.681 19542
1148 1 5 . 1 1 25 25 MET CB C 25 32.399 32.399 32.485 -0.086 19542
1149 1 5 . 1 1 25 25 MET H H 25 8.418 8.418 8.209 0.209 19542
1150 1 5 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.251 0.126 19542
1151 1 5 . 1 1 26 26 PRO CA C 26 63.841 63.841 62.900 0.941 19542
1152 1 5 . 1 1 26 26 PRO CB C 26 31.750 31.750 31.063 0.687 19542
1153 1 5 . 1 1 27 27 PHE N N 27 118.056 118.056 124.377 -6.321 19542
1154 1 5 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.801 -0.176 19542
1155 1 5 . 1 1 27 27 PHE CA C 27 57.332 57.332 56.044 1.288 19542
1156 1 5 . 1 1 27 27 PHE CB C 27 39.701 39.701 42.428 -2.727 19542
1157 1 5 . 1 1 27 27 PHE H H 27 7.988 7.988 7.788 0.200 19542
1158 1 5 . 1 1 28 28 ARG N N 28 121.294 121.294 123.391 -2.097 19542
1159 1 5 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.183 -0.124 19542
1160 1 5 . 1 1 28 28 ARG CA C 28 57.142 57.142 57.510 -0.368 19542
1161 1 5 . 1 1 28 28 ARG CB C 28 29.711 29.711 29.958 -0.247 19542
1162 1 5 . 1 1 28 28 ARG H H 28 8.333 8.333 9.009 -0.676 19542
1163 1 5 . 1 1 29 29 ASN N N 29 116.243 116.243 114.645 1.598 19542
1164 1 5 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.401 0.195 19542
1165 1 5 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.467 -0.672 19542
1166 1 5 . 1 1 29 29 ASN CB C 29 38.239 38.239 37.800 0.439 19542
1167 1 5 . 1 1 29 29 ASN H H 29 8.356 8.356 8.905 -0.549 19542
1168 1 5 . 1 1 30 30 LEU N N 30 121.660 121.660 121.735 -0.075 19542
1169 1 5 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.646 -0.201 19542
1170 1 5 . 1 1 30 30 LEU CA C 30 55.203 55.203 54.659 0.544 19542
1171 1 5 . 1 1 30 30 LEU CB C 30 42.982 42.982 43.109 -0.128 19542
1172 1 5 . 1 1 30 30 LEU H H 30 8.028 8.028 7.671 0.357 19542
1173 1 5 . 1 1 31 31 LYS N N 31 120.928 120.928 127.366 -6.438 19542
1174 1 5 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.611 -0.233 19542
1175 1 5 . 1 1 31 31 LYS CA C 31 56.271 56.271 54.810 1.461 19542
1176 1 5 . 1 1 31 31 LYS CB C 31 32.230 32.230 32.569 -0.339 19542
1177 1 5 . 1 1 31 31 LYS H H 31 8.306 8.306 8.584 -0.278 19542
1178 1 5 . 1 1 32 32 LEU N N 32 122.843 122.843 129.247 -6.404 19542
1179 1 5 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.632 -0.186 19542
1180 1 5 . 1 1 32 32 LEU CA C 32 54.484 54.484 54.511 -0.028 19542
1181 1 5 . 1 1 32 32 LEU CB C 32 43.404 43.404 43.128 0.276 19542
1182 1 5 . 1 1 32 32 LEU H H 32 8.027 8.027 8.737 -0.710 19542
1183 1 5 . 1 1 33 33 ILE N N 33 123.311 123.311 127.614 -4.303 19542
1184 1 5 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.752 -0.369 19542
1185 1 5 . 1 1 33 33 ILE CA C 33 60.595 60.595 59.532 1.062 19542
1186 1 5 . 1 1 33 33 ILE CB C 33 38.303 38.303 38.821 -0.518 19542
1187 1 5 . 1 1 33 33 ILE H H 33 8.327 8.327 8.295 0.032 19542
1188 1 5 . 1 1 34 34 LEU N N 34 128.669 128.669 129.143 -0.474 19542
1189 1 5 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.821 -0.027 19542
1190 1 5 . 1 1 34 34 LEU CB C 34 42.873 42.873 42.055 0.818 19542
1191 1 5 . 1 1 34 34 LEU H H 34 8.880 8.880 9.093 -0.213 19542
1192 1 5 . 1 1 35 35 GLN N N 35 121.600 121.600 121.564 0.036 19542
1193 1 5 . 1 1 35 35 GLN HA H 35 4.588 4.588 4.718 -0.130 19542
1194 1 5 . 1 1 35 35 GLN CA C 35 61.390 61.390 55.880 5.510 19542
1195 1 5 . 1 1 35 35 GLN CB C 35 33.866 33.866 29.819 4.048 19542
1196 1 5 . 1 1 35 35 GLN H H 35 8.210 8.210 8.203 0.007 19542
1197 1 5 . 1 1 36 36 GLY N N 36 106.726 106.726 109.873 -3.147 19542
1198 1 5 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.285 2.593 19542
1199 1 5 . 1 1 36 36 GLY H H 36 6.121 6.121 7.571 -1.450 19542
1200 1 5 . 1 1 37 37 CYS N N 37 124.584 124.584 118.714 5.870 19542
1201 1 5 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.385 0.489 19542
1202 1 5 . 1 1 37 37 CYS CA C 37 55.955 55.955 58.185 -2.230 19542
1203 1 5 . 1 1 37 37 CYS CB C 37 48.202 48.202 30.418 17.785 19542
1204 1 5 . 1 1 37 37 CYS H H 37 8.505 8.505 8.269 0.236 19542
1205 1 5 . 1 1 38 38 SER N N 38 115.036 115.036 118.206 -3.170 19542
1206 1 5 . 1 1 38 38 SER HA H 38 4.980 4.980 5.008 -0.028 19542
1207 1 5 . 1 1 38 38 SER CA C 38 58.792 58.792 56.521 2.271 19542
1208 1 5 . 1 1 38 38 SER CB C 38 65.971 65.971 65.944 0.027 19542
1209 1 5 . 1 1 38 38 SER H H 38 9.749 9.749 9.298 0.451 19542
1210 1 5 . 1 1 39 39 SER N N 39 117.276 117.276 119.678 -2.402 19542
1211 1 5 . 1 1 39 39 SER HA H 39 4.827 4.827 4.897 -0.070 19542
1212 1 5 . 1 1 39 39 SER CA C 39 60.040 60.040 60.877 -0.837 19542
1213 1 5 . 1 1 39 39 SER CB C 39 63.784 63.784 64.003 -0.219 19542
1214 1 5 . 1 1 39 39 SER H H 39 9.161 9.161 8.869 0.292 19542
1215 1 5 . 1 1 40 40 SER N N 40 115.041 115.041 114.158 0.883 19542
1216 1 5 . 1 1 40 40 SER HA H 40 4.660 4.660 4.812 -0.152 19542
1217 1 5 . 1 1 40 40 SER CA C 40 55.868 55.868 57.530 -1.662 19542
1218 1 5 . 1 1 40 40 SER CB C 40 64.868 64.868 66.120 -1.252 19542
1219 1 5 . 1 1 40 40 SER H H 40 7.911 7.911 7.701 0.210 19542
1220 1 5 . 1 1 41 41 CYS N N 41 124.146 124.146 122.061 2.085 19542
1221 1 5 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.590 -0.281 19542
1222 1 5 . 1 1 41 41 CYS CA C 41 57.567 57.567 57.006 0.561 19542
1223 1 5 . 1 1 41 41 CYS CB C 41 40.000 40.000 28.807 11.193 19542
1224 1 5 . 1 1 41 41 CYS H H 41 8.067 8.067 8.196 -0.129 19542
1225 1 5 . 1 1 42 42 SER N N 42 118.590 118.590 117.276 1.314 19542
1226 1 5 . 1 1 42 42 SER HA H 42 4.611 4.611 4.563 0.048 19542
1227 1 5 . 1 1 42 42 SER CA C 42 59.020 59.020 57.443 1.577 19542
1228 1 5 . 1 1 42 42 SER CB C 42 64.112 64.112 65.110 -0.998 19542
1229 1 5 . 1 1 42 42 SER H H 42 8.491 8.491 8.400 0.091 19542
1230 1 5 . 1 1 43 43 GLU N N 43 118.830 118.830 118.996 -0.166 19542
1231 1 5 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.320 0.329 19542
1232 1 5 . 1 1 43 43 GLU CA C 43 56.856 56.856 55.925 0.931 19542
1233 1 5 . 1 1 43 43 GLU CB C 43 29.206 29.206 29.214 -0.008 19542
1234 1 5 . 1 1 43 43 GLU H H 43 8.861 8.861 8.512 0.349 19542
1235 1 5 . 1 1 44 44 THR N N 44 117.954 117.954 112.928 5.026 19542
1236 1 5 . 1 1 44 44 THR HA H 44 4.619 4.619 4.296 0.323 19542
1237 1 5 . 1 1 44 44 THR CB C 44 72.341 72.341 70.102 2.239 19542
1238 1 5 . 1 1 44 44 THR H H 44 9.030 9.030 7.661 1.369 19542
1239 1 5 . 1 1 45 45 GLU N N 45 127.100 127.100 122.494 4.606 19542
1240 1 5 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.142 -0.048 19542
1241 1 5 . 1 1 45 45 GLU CA C 45 58.934 58.934 59.108 -0.174 19542
1242 1 5 . 1 1 45 45 GLU CB C 45 27.009 27.009 29.900 -2.891 19542
1243 1 5 . 1 1 45 45 GLU H H 45 8.837 8.837 8.806 0.031 19542
1244 1 5 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.503 0.399 19542
1245 1 5 . 1 1 46 46 ASN CA C 46 53.244 53.244 54.894 -1.650 19542
1246 1 5 . 1 1 46 46 ASN CB C 46 40.053 40.053 38.701 1.352 19542
1247 1 5 . 1 1 46 46 ASN H H 46 8.018 8.018 8.493 -0.475 19542
1248 1 5 . 1 1 47 47 ASN N N 47 120.765 120.765 118.481 2.284 19542
1249 1 5 . 1 1 47 47 ASN HA H 47 5.362 5.362 4.946 0.416 19542
1250 1 5 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.860 1.119 19542
1251 1 5 . 1 1 47 47 ASN CB C 47 41.749 41.749 38.955 2.794 19542
1252 1 5 . 1 1 47 47 ASN H H 47 7.835 7.835 8.123 -0.288 19542
1253 1 5 . 1 1 48 48 LYS N N 48 123.576 123.576 126.551 -2.975 19542
1254 1 5 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.717 0.125 19542
1255 1 5 . 1 1 48 48 LYS CB C 48 34.398 34.398 35.065 -0.667 19542
1256 1 5 . 1 1 48 48 LYS H H 48 8.548 8.548 8.727 -0.179 19542
1257 1 5 . 1 1 49 49 CYS N N 49 116.141 116.141 115.431 0.710 19542
1258 1 5 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.810 -0.257 19542
1259 1 5 . 1 1 49 49 CYS CA C 49 53.386 53.386 56.229 -2.843 19542
1260 1 5 . 1 1 49 49 CYS CB C 49 44.935 44.935 29.496 15.439 19542
1261 1 5 . 1 1 49 49 CYS H H 49 8.873 8.873 8.414 0.459 19542
1262 1 5 . 1 1 50 50 CYS N N 50 118.484 118.484 119.974 -1.490 19542
1263 1 5 . 1 1 50 50 CYS HA H 50 5.265 5.265 4.948 0.317 19542
1264 1 5 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.161 -1.178 19542
1265 1 5 . 1 1 50 50 CYS CB C 50 46.111 46.111 30.855 15.256 19542
1266 1 5 . 1 1 50 50 CYS H H 50 9.389 9.389 9.389 -0.000 19542
1267 1 5 . 1 1 51 51 SER N N 51 115.213 115.213 115.841 -0.628 19542
1268 1 5 . 1 1 51 51 SER HA H 51 5.016 5.016 4.837 0.179 19542
1269 1 5 . 1 1 51 51 SER CA C 51 58.118 58.118 57.736 0.382 19542
1270 1 5 . 1 1 51 51 SER CB C 51 64.457 64.457 62.799 1.658 19542
1271 1 5 . 1 1 51 51 SER H H 51 9.290 9.290 8.575 0.715 19542
1272 1 5 . 1 1 52 52 THR N N 52 112.156 112.156 118.559 -6.403 19542
1273 1 5 . 1 1 52 52 THR HA H 52 4.692 4.692 4.479 0.213 19542
1274 1 5 . 1 1 52 52 THR CA C 52 59.835 59.835 61.005 -1.170 19542
1275 1 5 . 1 1 52 52 THR CB C 52 71.872 71.872 71.509 0.363 19542
1276 1 5 . 1 1 52 52 THR H H 52 7.624 7.624 7.340 0.284 19542
1277 1 5 . 1 1 53 53 ASP N N 53 119.869 119.869 121.438 -1.569 19542
1278 1 5 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.446 0.524 19542
1279 1 5 . 1 1 53 53 ASP CA C 53 55.485 55.485 54.984 0.501 19542
1280 1 5 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.718 0.004 19542
1281 1 5 . 1 1 53 53 ASP H H 53 8.410 8.410 8.644 -0.234 19542
1282 1 5 . 1 1 54 54 ARG N N 54 111.677 111.677 116.841 -5.164 19542
1283 1 5 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.659 -0.474 19542
1284 1 5 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.470 0.492 19542
1285 1 5 . 1 1 54 54 ARG CB C 54 28.429 28.429 27.211 1.218 19542
1286 1 5 . 1 1 54 54 ARG H H 54 9.306 9.306 8.675 0.631 19542
1287 1 5 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.474 0.087 19542
1288 1 5 . 1 1 55 55 CYS CA C 55 57.814 57.814 59.349 -1.535 19542
1289 1 5 . 1 1 55 55 CYS CB C 55 46.236 46.236 27.098 19.138 19542
1290 1 5 . 1 1 55 55 CYS H H 55 7.995 7.995 7.916 0.079 19542
1291 1 5 . 1 1 56 56 ASN N N 56 121.881 121.881 120.662 1.219 19542
1292 1 5 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.576 0.234 19542
1293 1 5 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.777 -0.411 19542
1294 1 5 . 1 1 56 56 ASN CB C 56 37.837 37.837 36.352 1.485 19542
1295 1 5 . 1 1 56 56 ASN H H 56 8.755 8.755 8.557 0.198 19542
1296 1 6 . 1 1 2 2 LYS N N 2 126.352 126.352 121.948 4.404 19542
1297 1 6 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.264 0.126 19542
1298 1 6 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.655 -0.253 19542
1299 1 6 . 1 1 2 2 LYS CB C 2 29.734 29.734 33.216 -3.482 19542
1300 1 6 . 1 1 2 2 LYS H H 2 8.381 8.381 8.281 0.100 19542
1301 1 6 . 1 1 3 3 CYS N N 3 117.974 117.974 120.680 -2.706 19542
1302 1 6 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.572 0.387 19542
1303 1 6 . 1 1 3 3 CYS CA C 3 51.272 51.272 58.081 -6.809 19542
1304 1 6 . 1 1 3 3 CYS CB C 3 42.039 42.039 32.130 9.909 19542
1305 1 6 . 1 1 3 3 CYS H H 3 8.394 8.394 9.007 -0.613 19542
1306 1 6 . 1 1 4 4 PHE N N 4 120.016 120.016 121.266 -1.250 19542
1307 1 6 . 1 1 4 4 PHE HA H 4 4.606 4.606 4.910 -0.304 19542
1308 1 6 . 1 1 4 4 PHE CB C 4 39.719 39.719 37.227 2.492 19542
1309 1 6 . 1 1 4 4 PHE H H 4 9.550 9.550 9.286 0.264 19542
1310 1 6 . 1 1 5 5 GLN N N 5 120.517 120.517 122.968 -2.451 19542
1311 1 6 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.393 0.029 19542
1312 1 6 . 1 1 5 5 GLN CA C 5 56.003 56.003 58.032 -2.029 19542
1313 1 6 . 1 1 5 5 GLN CB C 5 32.594 32.594 30.163 2.431 19542
1314 1 6 . 1 1 5 5 GLN H H 5 9.406 9.406 7.938 1.468 19542
1315 1 6 . 1 1 6 6 HIS N N 6 118.478 118.478 113.856 4.622 19542
1316 1 6 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.742 -0.264 19542
1317 1 6 . 1 1 6 6 HIS CA C 6 56.627 56.627 54.883 1.744 19542
1318 1 6 . 1 1 6 6 HIS CB C 6 27.976 27.976 29.939 -1.963 19542
1319 1 6 . 1 1 6 6 HIS H H 6 8.827 8.827 7.707 1.120 19542
1320 1 6 . 1 1 7 7 GLY N N 7 103.072 103.072 108.504 -5.432 19542
1321 1 6 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.235 0.689 19542
1322 1 6 . 1 1 7 7 GLY H H 7 8.440 8.440 8.706 -0.266 19542
1323 1 6 . 1 1 8 8 LYS N N 8 119.909 119.909 120.810 -0.901 19542
1324 1 6 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.902 -0.074 19542
1325 1 6 . 1 1 8 8 LYS CB C 8 35.493 35.493 34.866 0.627 19542
1326 1 6 . 1 1 8 8 LYS H H 8 7.703 7.703 7.894 -0.191 19542
1327 1 6 . 1 1 9 9 VAL N N 9 122.232 122.232 121.884 0.348 19542
1328 1 6 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.709 0.103 19542
1329 1 6 . 1 1 9 9 VAL CA C 9 63.286 63.286 63.117 0.169 19542
1330 1 6 . 1 1 9 9 VAL CB C 9 26.812 26.812 31.312 -4.500 19542
1331 1 6 . 1 1 9 9 VAL H H 9 8.552 8.552 8.483 0.069 19542
1332 1 6 . 1 1 10 10 VAL N N 10 123.963 123.963 124.106 -0.143 19542
1333 1 6 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.700 -0.094 19542
1334 1 6 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.734 0.658 19542
1335 1 6 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.782 -1.000 19542
1336 1 6 . 1 1 10 10 VAL H H 10 8.920 8.920 8.792 0.128 19542
1337 1 6 . 1 1 11 11 THR N N 11 118.572 118.572 119.940 -1.368 19542
1338 1 6 . 1 1 11 11 THR HA H 11 4.443 4.443 4.615 -0.172 19542
1339 1 6 . 1 1 11 11 THR CA C 11 62.719 62.719 62.665 0.054 19542
1340 1 6 . 1 1 11 11 THR CB C 11 68.689 68.689 69.013 -0.324 19542
1341 1 6 . 1 1 11 11 THR H H 11 8.517 8.517 8.076 0.441 19542
1342 1 6 . 1 1 12 12 CYS N N 12 126.835 126.835 126.186 0.649 19542
1343 1 6 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.421 0.250 19542
1344 1 6 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.667 -5.631 19542
1345 1 6 . 1 1 12 12 CYS CB C 12 38.892 38.892 27.358 11.534 19542
1346 1 6 . 1 1 12 12 CYS H H 12 8.970 8.970 8.691 0.279 19542
1347 1 6 . 1 1 13 13 HIS N N 13 121.091 121.091 123.170 -2.079 19542
1348 1 6 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.531 0.118 19542
1349 1 6 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.272 -1.774 19542
1350 1 6 . 1 1 13 13 HIS H H 13 9.015 9.015 8.581 0.434 19542
1351 1 6 . 1 1 14 14 ARG N N 14 120.872 120.872 119.801 1.071 19542
1352 1 6 . 1 1 14 14 ARG HA H 14 4.043 4.043 4.070 -0.027 19542
1353 1 6 . 1 1 14 14 ARG CA C 14 58.962 58.962 57.174 1.788 19542
1354 1 6 . 1 1 14 14 ARG CB C 14 30.014 30.014 29.426 0.588 19542
1355 1 6 . 1 1 14 14 ARG H H 14 8.689 8.689 7.965 0.724 19542
1356 1 6 . 1 1 15 15 ASP N N 15 121.233 121.233 118.577 2.656 19542
1357 1 6 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.616 -0.113 19542
1358 1 6 . 1 1 15 15 ASP CA C 15 54.306 54.306 56.349 -2.043 19542
1359 1 6 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.363 -2.256 19542
1360 1 6 . 1 1 15 15 ASP H H 15 8.907 8.907 7.851 1.056 19542
1361 1 6 . 1 1 16 16 MET N N 16 119.073 119.073 118.713 0.360 19542
1362 1 6 . 1 1 16 16 MET HA H 16 4.415 4.415 4.525 -0.110 19542
1363 1 6 . 1 1 16 16 MET CA C 16 55.995 55.995 55.527 0.468 19542
1364 1 6 . 1 1 16 16 MET CB C 16 32.662 32.662 32.137 0.525 19542
1365 1 6 . 1 1 16 16 MET H H 16 7.811 7.811 7.611 0.200 19542
1366 1 6 . 1 1 17 17 LYS N N 17 120.187 120.187 121.714 -1.527 19542
1367 1 6 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.212 0.055 19542
1368 1 6 . 1 1 17 17 LYS CA C 17 55.889 55.889 56.756 -0.867 19542
1369 1 6 . 1 1 17 17 LYS CB C 17 34.106 34.106 34.125 -0.019 19542
1370 1 6 . 1 1 17 17 LYS H H 17 7.763 7.763 8.703 -0.940 19542
1371 1 6 . 1 1 18 18 PHE N N 18 115.631 115.631 117.211 -1.580 19542
1372 1 6 . 1 1 18 18 PHE HA H 18 5.113 5.113 4.990 0.123 19542
1373 1 6 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.479 0.492 19542
1374 1 6 . 1 1 18 18 PHE CB C 18 43.018 43.018 42.928 0.090 19542
1375 1 6 . 1 1 18 18 PHE H H 18 8.252 8.252 8.281 -0.029 19542
1376 1 6 . 1 1 19 19 CYS N N 19 115.508 115.508 121.518 -6.010 19542
1377 1 6 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.456 0.546 19542
1378 1 6 . 1 1 19 19 CYS CA C 19 52.258 52.258 57.800 -5.543 19542
1379 1 6 . 1 1 19 19 CYS CB C 19 38.627 38.627 27.229 11.398 19542
1380 1 6 . 1 1 19 19 CYS H H 19 9.343 9.343 9.357 -0.014 19542
1381 1 6 . 1 1 20 20 TYR N N 20 128.934 128.934 121.234 7.700 19542
1382 1 6 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.468 0.739 19542
1383 1 6 . 1 1 20 20 TYR CA C 20 55.701 55.701 55.073 0.628 19542
1384 1 6 . 1 1 20 20 TYR CB C 20 43.184 43.184 40.521 2.663 19542
1385 1 6 . 1 1 20 20 TYR H H 20 8.871 8.871 9.224 -0.353 19542
1386 1 6 . 1 1 21 21 HIS N N 21 122.079 122.079 122.868 -0.789 19542
1387 1 6 . 1 1 21 21 HIS HA H 21 5.283 5.283 4.854 0.429 19542
1388 1 6 . 1 1 21 21 HIS CA C 21 54.713 54.713 54.245 0.468 19542
1389 1 6 . 1 1 21 21 HIS CB C 21 31.719 31.719 31.635 0.084 19542
1390 1 6 . 1 1 21 21 HIS H H 21 8.797 8.797 9.389 -0.592 19542
1391 1 6 . 1 1 22 22 ASN N N 22 128.444 128.444 128.323 0.121 19542
1392 1 6 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.405 0.441 19542
1393 1 6 . 1 1 22 22 ASN CA C 22 52.512 52.512 52.221 0.291 19542
1394 1 6 . 1 1 22 22 ASN CB C 22 40.821 40.821 40.871 -0.050 19542
1395 1 6 . 1 1 22 22 ASN H H 22 9.823 9.823 8.878 0.945 19542
1396 1 6 . 1 1 23 23 THR N N 23 116.691 116.691 119.684 -2.993 19542
1397 1 6 . 1 1 23 23 THR HA H 23 4.604 4.604 5.119 -0.515 19542
1398 1 6 . 1 1 23 23 THR CA C 23 57.003 57.003 59.306 -2.304 19542
1399 1 6 . 1 1 23 23 THR CB C 23 69.344 69.344 70.691 -1.347 19542
1400 1 6 . 1 1 23 23 THR H H 23 8.561 8.561 7.346 1.215 19542
1401 1 6 . 1 1 24 24 GLY N N 24 110.763 110.763 109.214 1.549 19542
1402 1 6 . 1 1 24 24 GLY CA C 24 44.993 44.993 44.376 0.617 19542
1403 1 6 . 1 1 24 24 GLY H H 24 8.608 8.608 8.318 0.290 19542
1404 1 6 . 1 1 25 25 MET N N 25 120.520 120.520 121.128 -0.608 19542
1405 1 6 . 1 1 25 25 MET HA H 25 4.818 4.818 4.688 0.130 19542
1406 1 6 . 1 1 25 25 MET CA C 25 53.892 53.892 53.892 -0.000 19542
1407 1 6 . 1 1 25 25 MET CB C 25 32.399 32.399 32.721 -0.322 19542
1408 1 6 . 1 1 25 25 MET H H 25 8.418 8.418 8.368 0.050 19542
1409 1 6 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.396 -0.019 19542
1410 1 6 . 1 1 26 26 PRO CA C 26 63.841 63.841 63.237 0.604 19542
1411 1 6 . 1 1 26 26 PRO CB C 26 31.750 31.750 31.071 0.679 19542
1412 1 6 . 1 1 27 27 PHE N N 27 118.056 118.056 123.699 -5.643 19542
1413 1 6 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.678 -0.053 19542
1414 1 6 . 1 1 27 27 PHE CA C 27 57.332 57.332 56.193 1.139 19542
1415 1 6 . 1 1 27 27 PHE CB C 27 39.701 39.701 43.019 -3.318 19542
1416 1 6 . 1 1 27 27 PHE H H 27 7.988 7.988 7.869 0.119 19542
1417 1 6 . 1 1 28 28 ARG N N 28 121.294 121.294 123.918 -2.624 19542
1418 1 6 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.319 -0.260 19542
1419 1 6 . 1 1 28 28 ARG CA C 28 57.142 57.142 57.228 -0.086 19542
1420 1 6 . 1 1 28 28 ARG CB C 28 29.711 29.711 29.989 -0.278 19542
1421 1 6 . 1 1 28 28 ARG H H 28 8.333 8.333 8.850 -0.517 19542
1422 1 6 . 1 1 29 29 ASN N N 29 116.243 116.243 115.777 0.466 19542
1423 1 6 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.413 0.183 19542
1424 1 6 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.219 -0.424 19542
1425 1 6 . 1 1 29 29 ASN CB C 29 38.239 38.239 37.780 0.459 19542
1426 1 6 . 1 1 29 29 ASN H H 29 8.356 8.356 8.892 -0.536 19542
1427 1 6 . 1 1 30 30 LEU N N 30 121.660 121.660 121.335 0.325 19542
1428 1 6 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.610 -0.165 19542
1429 1 6 . 1 1 30 30 LEU CA C 30 55.203 55.203 54.521 0.682 19542
1430 1 6 . 1 1 30 30 LEU CB C 30 42.982 42.982 42.402 0.580 19542
1431 1 6 . 1 1 30 30 LEU H H 30 8.028 8.028 7.684 0.344 19542
1432 1 6 . 1 1 31 31 LYS N N 31 120.928 120.928 126.491 -5.563 19542
1433 1 6 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.535 -0.157 19542
1434 1 6 . 1 1 31 31 LYS CA C 31 56.271 56.271 55.419 0.852 19542
1435 1 6 . 1 1 31 31 LYS CB C 31 32.230 32.230 32.964 -0.734 19542
1436 1 6 . 1 1 31 31 LYS H H 31 8.306 8.306 8.482 -0.176 19542
1437 1 6 . 1 1 32 32 LEU N N 32 122.843 122.843 127.811 -4.968 19542
1438 1 6 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.586 -0.140 19542
1439 1 6 . 1 1 32 32 LEU CA C 32 54.484 54.484 54.263 0.221 19542
1440 1 6 . 1 1 32 32 LEU CB C 32 43.404 43.404 43.329 0.075 19542
1441 1 6 . 1 1 32 32 LEU H H 32 8.027 8.027 8.703 -0.676 19542
1442 1 6 . 1 1 33 33 ILE N N 33 123.311 123.311 127.396 -4.085 19542
1443 1 6 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.439 -0.056 19542
1444 1 6 . 1 1 33 33 ILE CA C 33 60.595 60.595 60.047 0.548 19542
1445 1 6 . 1 1 33 33 ILE CB C 33 38.303 38.303 36.970 1.333 19542
1446 1 6 . 1 1 33 33 ILE H H 33 8.327 8.327 8.463 -0.136 19542
1447 1 6 . 1 1 34 34 LEU N N 34 128.669 128.669 128.803 -0.134 19542
1448 1 6 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.707 0.087 19542
1449 1 6 . 1 1 34 34 LEU CB C 34 42.873 42.873 41.936 0.937 19542
1450 1 6 . 1 1 34 34 LEU H H 34 8.880 8.880 8.447 0.433 19542
1451 1 6 . 1 1 35 35 GLN N N 35 121.600 121.600 120.387 1.213 19542
1452 1 6 . 1 1 35 35 GLN HA H 35 4.588 4.588 5.177 -0.589 19542
1453 1 6 . 1 1 35 35 GLN CA C 35 61.390 61.390 54.376 7.014 19542
1454 1 6 . 1 1 35 35 GLN CB C 35 33.866 33.866 30.814 3.053 19542
1455 1 6 . 1 1 35 35 GLN H H 35 8.210 8.210 8.486 -0.276 19542
1456 1 6 . 1 1 36 36 GLY N N 36 106.726 106.726 109.342 -2.616 19542
1457 1 6 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.326 2.552 19542
1458 1 6 . 1 1 36 36 GLY H H 36 6.121 6.121 7.265 -1.144 19542
1459 1 6 . 1 1 37 37 CYS N N 37 124.584 124.584 118.591 5.993 19542
1460 1 6 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.403 0.471 19542
1461 1 6 . 1 1 37 37 CYS CA C 37 55.955 55.955 58.003 -2.048 19542
1462 1 6 . 1 1 37 37 CYS CB C 37 48.202 48.202 28.546 19.656 19542
1463 1 6 . 1 1 37 37 CYS H H 37 8.505 8.505 8.696 -0.191 19542
1464 1 6 . 1 1 38 38 SER N N 38 115.036 115.036 119.161 -4.125 19542
1465 1 6 . 1 1 38 38 SER HA H 38 4.980 4.980 5.015 -0.035 19542
1466 1 6 . 1 1 38 38 SER CA C 38 58.792 58.792 56.626 2.166 19542
1467 1 6 . 1 1 38 38 SER CB C 38 65.971 65.971 66.120 -0.149 19542
1468 1 6 . 1 1 38 38 SER H H 38 9.749 9.749 9.390 0.359 19542
1469 1 6 . 1 1 39 39 SER N N 39 117.276 117.276 119.066 -1.790 19542
1470 1 6 . 1 1 39 39 SER HA H 39 4.827 4.827 4.927 -0.100 19542
1471 1 6 . 1 1 39 39 SER CA C 39 60.040 60.040 58.482 1.558 19542
1472 1 6 . 1 1 39 39 SER CB C 39 63.784 63.784 63.621 0.163 19542
1473 1 6 . 1 1 39 39 SER H H 39 9.161 9.161 8.984 0.177 19542
1474 1 6 . 1 1 40 40 SER N N 40 115.041 115.041 114.641 0.400 19542
1475 1 6 . 1 1 40 40 SER HA H 40 4.660 4.660 4.918 -0.258 19542
1476 1 6 . 1 1 40 40 SER CA C 40 55.868 55.868 57.142 -1.274 19542
1477 1 6 . 1 1 40 40 SER CB C 40 64.868 64.868 66.049 -1.181 19542
1478 1 6 . 1 1 40 40 SER H H 40 7.911 7.911 7.676 0.235 19542
1479 1 6 . 1 1 41 41 CYS N N 41 124.146 124.146 118.760 5.386 19542
1480 1 6 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.406 -0.097 19542
1481 1 6 . 1 1 41 41 CYS CA C 41 57.567 57.567 58.109 -0.542 19542
1482 1 6 . 1 1 41 41 CYS CB C 41 40.000 40.000 29.618 10.382 19542
1483 1 6 . 1 1 41 41 CYS H H 41 8.067 8.067 8.175 -0.108 19542
1484 1 6 . 1 1 42 42 SER N N 42 118.590 118.590 118.678 -0.088 19542
1485 1 6 . 1 1 42 42 SER HA H 42 4.611 4.611 4.632 -0.021 19542
1486 1 6 . 1 1 42 42 SER CA C 42 59.020 59.020 56.407 2.613 19542
1487 1 6 . 1 1 42 42 SER CB C 42 64.112 64.112 64.194 -0.082 19542
1488 1 6 . 1 1 42 42 SER H H 42 8.491 8.491 8.708 -0.217 19542
1489 1 6 . 1 1 43 43 GLU N N 43 118.830 118.830 128.358 -9.528 19542
1490 1 6 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.270 0.379 19542
1491 1 6 . 1 1 43 43 GLU CA C 43 56.856 56.856 56.540 0.316 19542
1492 1 6 . 1 1 43 43 GLU CB C 43 29.206 29.206 28.595 0.611 19542
1493 1 6 . 1 1 43 43 GLU H H 43 8.861 8.861 8.743 0.118 19542
1494 1 6 . 1 1 44 44 THR N N 44 117.954 117.954 117.485 0.469 19542
1495 1 6 . 1 1 44 44 THR HA H 44 4.619 4.619 4.597 0.022 19542
1496 1 6 . 1 1 44 44 THR CB C 44 72.341 72.341 71.510 0.831 19542
1497 1 6 . 1 1 44 44 THR H H 44 9.030 9.030 7.893 1.137 19542
1498 1 6 . 1 1 45 45 GLU N N 45 127.100 127.100 119.094 8.006 19542
1499 1 6 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.265 -0.171 19542
1500 1 6 . 1 1 45 45 GLU CA C 45 58.934 58.934 57.383 1.551 19542
1501 1 6 . 1 1 45 45 GLU CB C 45 27.009 27.009 30.219 -3.210 19542
1502 1 6 . 1 1 45 45 GLU H H 45 8.837 8.837 8.701 0.136 19542
1503 1 6 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.573 0.329 19542
1504 1 6 . 1 1 46 46 ASN CA C 46 53.244 53.244 54.136 -0.892 19542
1505 1 6 . 1 1 46 46 ASN CB C 46 40.053 40.053 39.229 0.824 19542
1506 1 6 . 1 1 46 46 ASN H H 46 8.018 8.018 8.081 -0.063 19542
1507 1 6 . 1 1 47 47 ASN N N 47 120.765 120.765 118.233 2.532 19542
1508 1 6 . 1 1 47 47 ASN HA H 47 5.362 5.362 5.024 0.338 19542
1509 1 6 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.812 1.167 19542
1510 1 6 . 1 1 47 47 ASN CB C 47 41.749 41.749 39.226 2.523 19542
1511 1 6 . 1 1 47 47 ASN H H 47 7.835 7.835 7.614 0.221 19542
1512 1 6 . 1 1 48 48 LYS N N 48 123.576 123.576 125.887 -2.311 19542
1513 1 6 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.713 0.129 19542
1514 1 6 . 1 1 48 48 LYS CB C 48 34.398 34.398 35.056 -0.658 19542
1515 1 6 . 1 1 48 48 LYS H H 48 8.548 8.548 8.925 -0.377 19542
1516 1 6 . 1 1 49 49 CYS N N 49 116.141 116.141 118.714 -2.573 19542
1517 1 6 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.383 0.170 19542
1518 1 6 . 1 1 49 49 CYS CA C 49 53.386 53.386 57.981 -4.595 19542
1519 1 6 . 1 1 49 49 CYS CB C 49 44.935 44.935 28.388 16.547 19542
1520 1 6 . 1 1 49 49 CYS H H 49 8.873 8.873 8.591 0.282 19542
1521 1 6 . 1 1 50 50 CYS N N 50 118.484 118.484 123.163 -4.679 19542
1522 1 6 . 1 1 50 50 CYS HA H 50 5.265 5.265 5.022 0.243 19542
1523 1 6 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.255 -1.272 19542
1524 1 6 . 1 1 50 50 CYS CB C 50 46.111 46.111 30.511 15.600 19542
1525 1 6 . 1 1 50 50 CYS H H 50 9.389 9.389 9.481 -0.092 19542
1526 1 6 . 1 1 51 51 SER N N 51 115.213 115.213 116.627 -1.414 19542
1527 1 6 . 1 1 51 51 SER HA H 51 5.016 5.016 4.690 0.326 19542
1528 1 6 . 1 1 51 51 SER CA C 51 58.118 58.118 57.922 0.196 19542
1529 1 6 . 1 1 51 51 SER CB C 51 64.457 64.457 62.965 1.492 19542
1530 1 6 . 1 1 51 51 SER H H 51 9.290 9.290 8.613 0.677 19542
1531 1 6 . 1 1 52 52 THR N N 52 112.156 112.156 118.534 -6.378 19542
1532 1 6 . 1 1 52 52 THR HA H 52 4.692 4.692 4.482 0.210 19542
1533 1 6 . 1 1 52 52 THR CA C 52 59.835 59.835 61.127 -1.292 19542
1534 1 6 . 1 1 52 52 THR CB C 52 71.872 71.872 71.096 0.776 19542
1535 1 6 . 1 1 52 52 THR H H 52 7.624 7.624 7.388 0.236 19542
1536 1 6 . 1 1 53 53 ASP N N 53 119.869 119.869 121.655 -1.786 19542
1537 1 6 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.455 0.515 19542
1538 1 6 . 1 1 53 53 ASP CA C 53 55.485 55.485 54.949 0.536 19542
1539 1 6 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.898 -0.176 19542
1540 1 6 . 1 1 53 53 ASP H H 53 8.410 8.410 8.651 -0.241 19542
1541 1 6 . 1 1 54 54 ARG N N 54 111.677 111.677 117.129 -5.452 19542
1542 1 6 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.652 -0.467 19542
1543 1 6 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.548 0.414 19542
1544 1 6 . 1 1 54 54 ARG CB C 54 28.429 28.429 27.285 1.144 19542
1545 1 6 . 1 1 54 54 ARG H H 54 9.306 9.306 8.599 0.707 19542
1546 1 6 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.394 0.167 19542
1547 1 6 . 1 1 55 55 CYS CA C 55 57.814 57.814 59.918 -2.104 19542
1548 1 6 . 1 1 55 55 CYS CB C 55 46.236 46.236 27.224 19.012 19542
1549 1 6 . 1 1 55 55 CYS H H 55 7.995 7.995 7.876 0.119 19542
1550 1 6 . 1 1 56 56 ASN N N 56 121.881 121.881 119.691 2.190 19542
1551 1 6 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.568 0.242 19542
1552 1 6 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.579 -0.213 19542
1553 1 6 . 1 1 56 56 ASN CB C 56 37.837 37.837 36.391 1.446 19542
1554 1 6 . 1 1 56 56 ASN H H 56 8.755 8.755 8.734 0.021 19542
1555 1 7 . 1 1 2 2 LYS N N 2 126.352 126.352 121.443 4.909 19542
1556 1 7 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.359 0.031 19542
1557 1 7 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.511 -0.109 19542
1558 1 7 . 1 1 2 2 LYS CB C 2 29.734 29.734 32.791 -3.057 19542
1559 1 7 . 1 1 2 2 LYS H H 2 8.381 8.381 9.368 -0.987 19542
1560 1 7 . 1 1 3 3 CYS N N 3 117.974 117.974 120.963 -2.989 19542
1561 1 7 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.573 0.386 19542
1562 1 7 . 1 1 3 3 CYS CA C 3 51.272 51.272 58.363 -7.091 19542
1563 1 7 . 1 1 3 3 CYS CB C 3 42.039 42.039 32.244 9.795 19542
1564 1 7 . 1 1 3 3 CYS H H 3 8.394 8.394 8.575 -0.181 19542
1565 1 7 . 1 1 4 4 PHE N N 4 120.016 120.016 121.618 -1.602 19542
1566 1 7 . 1 1 4 4 PHE HA H 4 4.606 4.606 4.811 -0.205 19542
1567 1 7 . 1 1 4 4 PHE CB C 4 39.719 39.719 37.055 2.664 19542
1568 1 7 . 1 1 4 4 PHE H H 4 9.550 9.550 9.312 0.238 19542
1569 1 7 . 1 1 5 5 GLN N N 5 120.517 120.517 121.799 -1.282 19542
1570 1 7 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.391 0.031 19542
1571 1 7 . 1 1 5 5 GLN CA C 5 56.003 56.003 57.558 -1.555 19542
1572 1 7 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.832 2.761 19542
1573 1 7 . 1 1 5 5 GLN H H 5 9.406 9.406 8.061 1.345 19542
1574 1 7 . 1 1 6 6 HIS N N 6 118.478 118.478 118.062 0.416 19542
1575 1 7 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.646 -0.168 19542
1576 1 7 . 1 1 6 6 HIS CA C 6 56.627 56.627 55.952 0.675 19542
1577 1 7 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.753 -2.777 19542
1578 1 7 . 1 1 6 6 HIS H H 6 8.827 8.827 7.719 1.108 19542
1579 1 7 . 1 1 7 7 GLY N N 7 103.072 103.072 108.097 -5.025 19542
1580 1 7 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.680 0.244 19542
1581 1 7 . 1 1 7 7 GLY H H 7 8.440 8.440 8.620 -0.180 19542
1582 1 7 . 1 1 8 8 LYS N N 8 119.909 119.909 120.585 -0.676 19542
1583 1 7 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.870 -0.042 19542
1584 1 7 . 1 1 8 8 LYS CB C 8 35.493 35.493 34.328 1.165 19542
1585 1 7 . 1 1 8 8 LYS H H 8 7.703 7.703 8.027 -0.324 19542
1586 1 7 . 1 1 9 9 VAL N N 9 122.232 122.232 123.461 -1.229 19542
1587 1 7 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.523 0.289 19542
1588 1 7 . 1 1 9 9 VAL CA C 9 63.286 63.286 63.236 0.050 19542
1589 1 7 . 1 1 9 9 VAL CB C 9 26.812 26.812 30.801 -3.989 19542
1590 1 7 . 1 1 9 9 VAL H H 9 8.552 8.552 8.320 0.232 19542
1591 1 7 . 1 1 10 10 VAL N N 10 123.963 123.963 124.446 -0.483 19542
1592 1 7 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.623 -0.017 19542
1593 1 7 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.241 1.151 19542
1594 1 7 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.547 -0.765 19542
1595 1 7 . 1 1 10 10 VAL H H 10 8.920 8.920 8.556 0.364 19542
1596 1 7 . 1 1 11 11 THR N N 11 118.572 118.572 119.409 -0.837 19542
1597 1 7 . 1 1 11 11 THR HA H 11 4.443 4.443 4.438 0.005 19542
1598 1 7 . 1 1 11 11 THR CA C 11 62.719 62.719 62.886 -0.167 19542
1599 1 7 . 1 1 11 11 THR CB C 11 68.689 68.689 67.741 0.948 19542
1600 1 7 . 1 1 11 11 THR H H 11 8.517 8.517 8.171 0.346 19542
1601 1 7 . 1 1 12 12 CYS N N 12 126.835 126.835 126.272 0.563 19542
1602 1 7 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.474 0.197 19542
1603 1 7 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.931 -5.895 19542
1604 1 7 . 1 1 12 12 CYS CB C 12 38.892 38.892 27.795 11.097 19542
1605 1 7 . 1 1 12 12 CYS H H 12 8.970 8.970 8.629 0.341 19542
1606 1 7 . 1 1 13 13 HIS N N 13 121.091 121.091 123.363 -2.272 19542
1607 1 7 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.463 0.186 19542
1608 1 7 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.747 -2.249 19542
1609 1 7 . 1 1 13 13 HIS H H 13 9.015 9.015 8.579 0.436 19542
1610 1 7 . 1 1 14 14 ARG N N 14 120.872 120.872 121.599 -0.727 19542
1611 1 7 . 1 1 14 14 ARG HA H 14 4.043 4.043 3.964 0.079 19542
1612 1 7 . 1 1 14 14 ARG CA C 14 58.962 58.962 58.384 0.578 19542
1613 1 7 . 1 1 14 14 ARG CB C 14 30.014 30.014 29.648 0.365 19542
1614 1 7 . 1 1 14 14 ARG H H 14 8.689 8.689 8.127 0.562 19542
1615 1 7 . 1 1 15 15 ASP N N 15 121.233 121.233 118.099 3.134 19542
1616 1 7 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.715 -0.212 19542
1617 1 7 . 1 1 15 15 ASP CA C 15 54.306 54.306 55.240 -0.934 19542
1618 1 7 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.694 -2.587 19542
1619 1 7 . 1 1 15 15 ASP H H 15 8.907 8.907 7.910 0.997 19542
1620 1 7 . 1 1 16 16 MET N N 16 119.073 119.073 119.028 0.045 19542
1621 1 7 . 1 1 16 16 MET HA H 16 4.415 4.415 4.536 -0.121 19542
1622 1 7 . 1 1 16 16 MET CA C 16 55.995 55.995 55.279 0.716 19542
1623 1 7 . 1 1 16 16 MET CB C 16 32.662 32.662 31.146 1.516 19542
1624 1 7 . 1 1 16 16 MET H H 16 7.811 7.811 7.673 0.138 19542
1625 1 7 . 1 1 17 17 LYS N N 17 120.187 120.187 122.362 -2.175 19542
1626 1 7 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.162 0.105 19542
1627 1 7 . 1 1 17 17 LYS CA C 17 55.889 55.889 57.133 -1.244 19542
1628 1 7 . 1 1 17 17 LYS CB C 17 34.106 34.106 33.315 0.791 19542
1629 1 7 . 1 1 17 17 LYS H H 17 7.763 7.763 8.264 -0.501 19542
1630 1 7 . 1 1 18 18 PHE N N 18 115.631 115.631 116.305 -0.674 19542
1631 1 7 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.124 -0.011 19542
1632 1 7 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.166 0.805 19542
1633 1 7 . 1 1 18 18 PHE CB C 18 43.018 43.018 42.870 0.149 19542
1634 1 7 . 1 1 18 18 PHE H H 18 8.252 8.252 7.927 0.325 19542
1635 1 7 . 1 1 19 19 CYS N N 19 115.508 115.508 120.317 -4.809 19542
1636 1 7 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.287 0.715 19542
1637 1 7 . 1 1 19 19 CYS CA C 19 52.258 52.258 58.040 -5.782 19542
1638 1 7 . 1 1 19 19 CYS CB C 19 38.627 38.627 27.902 10.725 19542
1639 1 7 . 1 1 19 19 CYS H H 19 9.343 9.343 9.386 -0.043 19542
1640 1 7 . 1 1 20 20 TYR N N 20 128.934 128.934 118.735 10.199 19542
1641 1 7 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.952 0.255 19542
1642 1 7 . 1 1 20 20 TYR CA C 20 55.701 55.701 54.893 0.808 19542
1643 1 7 . 1 1 20 20 TYR CB C 20 43.184 43.184 41.613 1.571 19542
1644 1 7 . 1 1 20 20 TYR H H 20 8.871 8.871 9.255 -0.384 19542
1645 1 7 . 1 1 21 21 HIS N N 21 122.079 122.079 123.288 -1.209 19542
1646 1 7 . 1 1 21 21 HIS HA H 21 5.283 5.283 5.032 0.251 19542
1647 1 7 . 1 1 21 21 HIS CA C 21 54.713 54.713 54.269 0.444 19542
1648 1 7 . 1 1 21 21 HIS CB C 21 31.719 31.719 31.994 -0.275 19542
1649 1 7 . 1 1 21 21 HIS H H 21 8.797 8.797 9.093 -0.296 19542
1650 1 7 . 1 1 22 22 ASN N N 22 128.444 128.444 128.375 0.069 19542
1651 1 7 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.135 0.711 19542
1652 1 7 . 1 1 22 22 ASN CA C 22 52.512 52.512 51.896 0.616 19542
1653 1 7 . 1 1 22 22 ASN CB C 22 40.821 40.821 39.498 1.323 19542
1654 1 7 . 1 1 22 22 ASN H H 22 9.823 9.823 9.192 0.631 19542
1655 1 7 . 1 1 23 23 THR N N 23 116.691 116.691 119.091 -2.400 19542
1656 1 7 . 1 1 23 23 THR HA H 23 4.604 4.604 3.871 0.733 19542
1657 1 7 . 1 1 23 23 THR CA C 23 57.003 57.003 64.062 -7.059 19542
1658 1 7 . 1 1 23 23 THR CB C 23 69.344 69.344 69.367 -0.023 19542
1659 1 7 . 1 1 23 23 THR H H 23 8.561 8.561 8.691 -0.130 19542
1660 1 7 . 1 1 24 24 GLY N N 24 110.763 110.763 109.862 0.901 19542
1661 1 7 . 1 1 24 24 GLY CA C 24 44.993 44.993 44.849 0.144 19542
1662 1 7 . 1 1 24 24 GLY H H 24 8.608 8.608 8.443 0.165 19542
1663 1 7 . 1 1 25 25 MET N N 25 120.520 120.520 121.491 -0.971 19542
1664 1 7 . 1 1 25 25 MET HA H 25 4.818 4.818 4.467 0.351 19542
1665 1 7 . 1 1 25 25 MET CA C 25 53.892 53.892 52.282 1.610 19542
1666 1 7 . 1 1 25 25 MET CB C 25 32.399 32.399 31.752 0.647 19542
1667 1 7 . 1 1 25 25 MET H H 25 8.418 8.418 8.119 0.299 19542
1668 1 7 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.264 0.113 19542
1669 1 7 . 1 1 26 26 PRO CA C 26 63.841 63.841 63.026 0.814 19542
1670 1 7 . 1 1 26 26 PRO CB C 26 31.750 31.750 31.253 0.496 19542
1671 1 7 . 1 1 27 27 PHE N N 27 118.056 118.056 122.909 -4.853 19542
1672 1 7 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.726 -0.101 19542
1673 1 7 . 1 1 27 27 PHE CA C 27 57.332 57.332 56.566 0.766 19542
1674 1 7 . 1 1 27 27 PHE CB C 27 39.701 39.701 41.678 -1.977 19542
1675 1 7 . 1 1 27 27 PHE H H 27 7.988 7.988 8.134 -0.146 19542
1676 1 7 . 1 1 28 28 ARG N N 28 121.294 121.294 124.307 -3.013 19542
1677 1 7 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.450 -0.391 19542
1678 1 7 . 1 1 28 28 ARG CA C 28 57.142 57.142 56.431 0.711 19542
1679 1 7 . 1 1 28 28 ARG CB C 28 29.711 29.711 30.730 -1.019 19542
1680 1 7 . 1 1 28 28 ARG H H 28 8.333 8.333 8.877 -0.544 19542
1681 1 7 . 1 1 29 29 ASN N N 29 116.243 116.243 118.984 -2.741 19542
1682 1 7 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.382 0.214 19542
1683 1 7 . 1 1 29 29 ASN CA C 29 53.795 53.795 53.905 -0.110 19542
1684 1 7 . 1 1 29 29 ASN CB C 29 38.239 38.239 38.317 -0.078 19542
1685 1 7 . 1 1 29 29 ASN H H 29 8.356 8.356 8.956 -0.600 19542
1686 1 7 . 1 1 30 30 LEU N N 30 121.660 121.660 119.852 1.808 19542
1687 1 7 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.565 -0.120 19542
1688 1 7 . 1 1 30 30 LEU CA C 30 55.203 55.203 55.163 0.040 19542
1689 1 7 . 1 1 30 30 LEU CB C 30 42.982 42.982 44.525 -1.543 19542
1690 1 7 . 1 1 30 30 LEU H H 30 8.028 8.028 7.551 0.477 19542
1691 1 7 . 1 1 31 31 LYS N N 31 120.928 120.928 125.452 -4.524 19542
1692 1 7 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.589 -0.211 19542
1693 1 7 . 1 1 31 31 LYS CA C 31 56.271 56.271 54.719 1.552 19542
1694 1 7 . 1 1 31 31 LYS CB C 31 32.230 32.230 32.162 0.068 19542
1695 1 7 . 1 1 31 31 LYS H H 31 8.306 8.306 8.493 -0.187 19542
1696 1 7 . 1 1 32 32 LEU N N 32 122.843 122.843 126.547 -3.704 19542
1697 1 7 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.500 -0.054 19542
1698 1 7 . 1 1 32 32 LEU CA C 32 54.484 54.484 54.716 -0.232 19542
1699 1 7 . 1 1 32 32 LEU CB C 32 43.404 43.404 42.073 1.331 19542
1700 1 7 . 1 1 32 32 LEU H H 32 8.027 8.027 8.756 -0.729 19542
1701 1 7 . 1 1 33 33 ILE N N 33 123.311 123.311 127.576 -4.265 19542
1702 1 7 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.423 -0.040 19542
1703 1 7 . 1 1 33 33 ILE CA C 33 60.595 60.595 59.763 0.832 19542
1704 1 7 . 1 1 33 33 ILE CB C 33 38.303 38.303 38.309 -0.007 19542
1705 1 7 . 1 1 33 33 ILE H H 33 8.327 8.327 8.347 -0.020 19542
1706 1 7 . 1 1 34 34 LEU N N 34 128.669 128.669 128.559 0.110 19542
1707 1 7 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.789 0.005 19542
1708 1 7 . 1 1 34 34 LEU CB C 34 42.873 42.873 42.412 0.461 19542
1709 1 7 . 1 1 34 34 LEU H H 34 8.880 8.880 8.713 0.167 19542
1710 1 7 . 1 1 35 35 GLN N N 35 121.600 121.600 121.249 0.351 19542
1711 1 7 . 1 1 35 35 GLN HA H 35 4.588 4.588 5.197 -0.609 19542
1712 1 7 . 1 1 35 35 GLN CA C 35 61.390 61.390 54.387 7.003 19542
1713 1 7 . 1 1 35 35 GLN CB C 35 33.866 33.866 30.885 2.981 19542
1714 1 7 . 1 1 35 35 GLN H H 35 8.210 8.210 8.298 -0.088 19542
1715 1 7 . 1 1 36 36 GLY N N 36 106.726 106.726 109.323 -2.597 19542
1716 1 7 . 1 1 36 36 GLY CA C 36 45.878 45.878 44.004 1.874 19542
1717 1 7 . 1 1 36 36 GLY H H 36 6.121 6.121 7.202 -1.081 19542
1718 1 7 . 1 1 37 37 CYS N N 37 124.584 124.584 118.083 6.501 19542
1719 1 7 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.343 0.531 19542
1720 1 7 . 1 1 37 37 CYS CA C 37 55.955 55.955 58.348 -2.393 19542
1721 1 7 . 1 1 37 37 CYS CB C 37 48.202 48.202 30.034 18.168 19542
1722 1 7 . 1 1 37 37 CYS H H 37 8.505 8.505 8.332 0.173 19542
1723 1 7 . 1 1 38 38 SER N N 38 115.036 115.036 118.265 -3.229 19542
1724 1 7 . 1 1 38 38 SER HA H 38 4.980 4.980 5.060 -0.080 19542
1725 1 7 . 1 1 38 38 SER CA C 38 58.792 58.792 56.568 2.224 19542
1726 1 7 . 1 1 38 38 SER CB C 38 65.971 65.971 65.766 0.205 19542
1727 1 7 . 1 1 38 38 SER H H 38 9.749 9.749 9.420 0.329 19542
1728 1 7 . 1 1 39 39 SER N N 39 117.276 117.276 122.365 -5.089 19542
1729 1 7 . 1 1 39 39 SER HA H 39 4.827 4.827 4.973 -0.146 19542
1730 1 7 . 1 1 39 39 SER CA C 39 60.040 60.040 60.636 -0.596 19542
1731 1 7 . 1 1 39 39 SER CB C 39 63.784 63.784 64.082 -0.298 19542
1732 1 7 . 1 1 39 39 SER H H 39 9.161 9.161 9.027 0.134 19542
1733 1 7 . 1 1 40 40 SER N N 40 115.041 115.041 115.033 0.008 19542
1734 1 7 . 1 1 40 40 SER HA H 40 4.660 4.660 4.754 -0.094 19542
1735 1 7 . 1 1 40 40 SER CA C 40 55.868 55.868 58.001 -2.133 19542
1736 1 7 . 1 1 40 40 SER CB C 40 64.868 64.868 64.789 0.079 19542
1737 1 7 . 1 1 40 40 SER H H 40 7.911 7.911 7.710 0.201 19542
1738 1 7 . 1 1 41 41 CYS N N 41 124.146 124.146 123.856 0.290 19542
1739 1 7 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.399 -0.090 19542
1740 1 7 . 1 1 41 41 CYS CA C 41 57.567 57.567 57.770 -0.203 19542
1741 1 7 . 1 1 41 41 CYS CB C 41 40.000 40.000 28.855 11.145 19542
1742 1 7 . 1 1 41 41 CYS H H 41 8.067 8.067 8.155 -0.088 19542
1743 1 7 . 1 1 42 42 SER N N 42 118.590 118.590 122.056 -3.466 19542
1744 1 7 . 1 1 42 42 SER HA H 42 4.611 4.611 4.413 0.198 19542
1745 1 7 . 1 1 42 42 SER CA C 42 59.020 59.020 57.453 1.567 19542
1746 1 7 . 1 1 42 42 SER CB C 42 64.112 64.112 63.820 0.292 19542
1747 1 7 . 1 1 42 42 SER H H 42 8.491 8.491 8.543 -0.052 19542
1748 1 7 . 1 1 43 43 GLU N N 43 118.830 118.830 128.096 -9.266 19542
1749 1 7 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.008 0.641 19542
1750 1 7 . 1 1 43 43 GLU CA C 43 56.856 56.856 57.358 -0.502 19542
1751 1 7 . 1 1 43 43 GLU CB C 43 29.206 29.206 28.876 0.330 19542
1752 1 7 . 1 1 43 43 GLU H H 43 8.861 8.861 8.760 0.101 19542
1753 1 7 . 1 1 44 44 THR N N 44 117.954 117.954 116.870 1.084 19542
1754 1 7 . 1 1 44 44 THR HA H 44 4.619 4.619 4.662 -0.043 19542
1755 1 7 . 1 1 44 44 THR CB C 44 72.341 72.341 70.955 1.386 19542
1756 1 7 . 1 1 44 44 THR H H 44 9.030 9.030 8.481 0.549 19542
1757 1 7 . 1 1 45 45 GLU N N 45 127.100 127.100 120.187 6.913 19542
1758 1 7 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.121 -0.027 19542
1759 1 7 . 1 1 45 45 GLU CA C 45 58.934 58.934 58.765 0.169 19542
1760 1 7 . 1 1 45 45 GLU CB C 45 27.009 27.009 29.395 -2.386 19542
1761 1 7 . 1 1 45 45 GLU H H 45 8.837 8.837 8.817 0.020 19542
1762 1 7 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.453 0.449 19542
1763 1 7 . 1 1 46 46 ASN CA C 46 53.244 53.244 54.966 -1.722 19542
1764 1 7 . 1 1 46 46 ASN CB C 46 40.053 40.053 38.657 1.396 19542
1765 1 7 . 1 1 46 46 ASN H H 46 8.018 8.018 8.200 -0.182 19542
1766 1 7 . 1 1 47 47 ASN N N 47 120.765 120.765 119.102 1.663 19542
1767 1 7 . 1 1 47 47 ASN HA H 47 5.362 5.362 5.067 0.295 19542
1768 1 7 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.378 1.601 19542
1769 1 7 . 1 1 47 47 ASN CB C 47 41.749 41.749 39.863 1.886 19542
1770 1 7 . 1 1 47 47 ASN H H 47 7.835 7.835 8.126 -0.291 19542
1771 1 7 . 1 1 48 48 LYS N N 48 123.576 123.576 128.679 -5.103 19542
1772 1 7 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.791 0.051 19542
1773 1 7 . 1 1 48 48 LYS CB C 48 34.398 34.398 33.638 0.760 19542
1774 1 7 . 1 1 48 48 LYS H H 48 8.548 8.548 8.684 -0.136 19542
1775 1 7 . 1 1 49 49 CYS N N 49 116.141 116.141 124.962 -8.821 19542
1776 1 7 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.659 -0.106 19542
1777 1 7 . 1 1 49 49 CYS CA C 49 53.386 53.386 57.407 -4.021 19542
1778 1 7 . 1 1 49 49 CYS CB C 49 44.935 44.935 27.206 17.729 19542
1779 1 7 . 1 1 49 49 CYS H H 49 8.873 8.873 8.655 0.218 19542
1780 1 7 . 1 1 50 50 CYS N N 50 118.484 118.484 121.476 -2.992 19542
1781 1 7 . 1 1 50 50 CYS HA H 50 5.265 5.265 4.999 0.266 19542
1782 1 7 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.219 -1.236 19542
1783 1 7 . 1 1 50 50 CYS CB C 50 46.111 46.111 31.218 14.893 19542
1784 1 7 . 1 1 50 50 CYS H H 50 9.389 9.389 9.513 -0.124 19542
1785 1 7 . 1 1 51 51 SER N N 51 115.213 115.213 117.113 -1.900 19542
1786 1 7 . 1 1 51 51 SER HA H 51 5.016 5.016 4.763 0.253 19542
1787 1 7 . 1 1 51 51 SER CA C 51 58.118 58.118 57.125 0.993 19542
1788 1 7 . 1 1 51 51 SER CB C 51 64.457 64.457 62.178 2.279 19542
1789 1 7 . 1 1 51 51 SER H H 51 9.290 9.290 8.685 0.605 19542
1790 1 7 . 1 1 52 52 THR N N 52 112.156 112.156 118.005 -5.849 19542
1791 1 7 . 1 1 52 52 THR HA H 52 4.692 4.692 4.440 0.252 19542
1792 1 7 . 1 1 52 52 THR CA C 52 59.835 59.835 61.492 -1.657 19542
1793 1 7 . 1 1 52 52 THR CB C 52 71.872 71.872 71.762 0.110 19542
1794 1 7 . 1 1 52 52 THR H H 52 7.624 7.624 7.751 -0.127 19542
1795 1 7 . 1 1 53 53 ASP N N 53 119.869 119.869 123.585 -3.716 19542
1796 1 7 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.432 0.538 19542
1797 1 7 . 1 1 53 53 ASP CA C 53 55.485 55.485 56.113 -0.628 19542
1798 1 7 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.927 -0.205 19542
1799 1 7 . 1 1 53 53 ASP H H 53 8.410 8.410 8.533 -0.123 19542
1800 1 7 . 1 1 54 54 ARG N N 54 111.677 111.677 117.229 -5.552 19542
1801 1 7 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.731 -0.546 19542
1802 1 7 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.626 0.336 19542
1803 1 7 . 1 1 54 54 ARG CB C 54 28.429 28.429 27.158 1.271 19542
1804 1 7 . 1 1 54 54 ARG H H 54 9.306 9.306 8.560 0.746 19542
1805 1 7 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.470 0.091 19542
1806 1 7 . 1 1 55 55 CYS CA C 55 57.814 57.814 59.706 -1.892 19542
1807 1 7 . 1 1 55 55 CYS CB C 55 46.236 46.236 26.667 19.569 19542
1808 1 7 . 1 1 55 55 CYS H H 55 7.995 7.995 7.972 0.023 19542
1809 1 7 . 1 1 56 56 ASN N N 56 121.881 121.881 118.001 3.880 19542
1810 1 7 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.701 0.109 19542
1811 1 7 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.781 -0.415 19542
1812 1 7 . 1 1 56 56 ASN CB C 56 37.837 37.837 36.984 0.853 19542
1813 1 7 . 1 1 56 56 ASN H H 56 8.755 8.755 8.624 0.131 19542
1814 1 8 . 1 1 2 2 LYS N N 2 126.352 126.352 122.249 4.103 19542
1815 1 8 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.145 0.245 19542
1816 1 8 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.721 -0.319 19542
1817 1 8 . 1 1 2 2 LYS CB C 2 29.734 29.734 33.370 -3.636 19542
1818 1 8 . 1 1 2 2 LYS H H 2 8.381 8.381 8.222 0.159 19542
1819 1 8 . 1 1 3 3 CYS N N 3 117.974 117.974 120.862 -2.888 19542
1820 1 8 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.492 0.467 19542
1821 1 8 . 1 1 3 3 CYS CA C 3 51.272 51.272 58.327 -7.055 19542
1822 1 8 . 1 1 3 3 CYS CB C 3 42.039 42.039 32.253 9.786 19542
1823 1 8 . 1 1 3 3 CYS H H 3 8.394 8.394 9.080 -0.686 19542
1824 1 8 . 1 1 4 4 PHE N N 4 120.016 120.016 121.140 -1.124 19542
1825 1 8 . 1 1 4 4 PHE HA H 4 4.606 4.606 5.073 -0.467 19542
1826 1 8 . 1 1 4 4 PHE CB C 4 39.719 39.719 37.230 2.489 19542
1827 1 8 . 1 1 4 4 PHE H H 4 9.550 9.550 9.192 0.358 19542
1828 1 8 . 1 1 5 5 GLN N N 5 120.517 120.517 123.202 -2.685 19542
1829 1 8 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.029 0.393 19542
1830 1 8 . 1 1 5 5 GLN CA C 5 56.003 56.003 58.140 -2.137 19542
1831 1 8 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.580 3.014 19542
1832 1 8 . 1 1 5 5 GLN H H 5 9.406 9.406 7.971 1.435 19542
1833 1 8 . 1 1 6 6 HIS N N 6 118.478 118.478 114.055 4.423 19542
1834 1 8 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.681 -0.203 19542
1835 1 8 . 1 1 6 6 HIS CA C 6 56.627 56.627 56.449 0.178 19542
1836 1 8 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.594 -2.618 19542
1837 1 8 . 1 1 6 6 HIS H H 6 8.827 8.827 7.773 1.054 19542
1838 1 8 . 1 1 7 7 GLY N N 7 103.072 103.072 107.436 -4.364 19542
1839 1 8 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.327 0.597 19542
1840 1 8 . 1 1 7 7 GLY H H 7 8.440 8.440 8.305 0.135 19542
1841 1 8 . 1 1 8 8 LYS N N 8 119.909 119.909 120.263 -0.354 19542
1842 1 8 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.846 -0.018 19542
1843 1 8 . 1 1 8 8 LYS CB C 8 35.493 35.493 35.068 0.425 19542
1844 1 8 . 1 1 8 8 LYS H H 8 7.703 7.703 7.784 -0.081 19542
1845 1 8 . 1 1 9 9 VAL N N 9 122.232 122.232 123.172 -0.940 19542
1846 1 8 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.799 0.013 19542
1847 1 8 . 1 1 9 9 VAL CA C 9 63.286 63.286 63.092 0.194 19542
1848 1 8 . 1 1 9 9 VAL CB C 9 26.812 26.812 30.722 -3.910 19542
1849 1 8 . 1 1 9 9 VAL H H 9 8.552 8.552 8.580 -0.028 19542
1850 1 8 . 1 1 10 10 VAL N N 10 123.963 123.963 123.910 0.053 19542
1851 1 8 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.757 -0.151 19542
1852 1 8 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.389 1.003 19542
1853 1 8 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.495 -0.713 19542
1854 1 8 . 1 1 10 10 VAL H H 10 8.920 8.920 8.648 0.272 19542
1855 1 8 . 1 1 11 11 THR N N 11 118.572 118.572 119.333 -0.761 19542
1856 1 8 . 1 1 11 11 THR HA H 11 4.443 4.443 4.568 -0.125 19542
1857 1 8 . 1 1 11 11 THR CA C 11 62.719 62.719 62.858 -0.139 19542
1858 1 8 . 1 1 11 11 THR CB C 11 68.689 68.689 68.821 -0.132 19542
1859 1 8 . 1 1 11 11 THR H H 11 8.517 8.517 8.238 0.279 19542
1860 1 8 . 1 1 12 12 CYS N N 12 126.835 126.835 125.793 1.042 19542
1861 1 8 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.370 0.301 19542
1862 1 8 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.673 -5.637 19542
1863 1 8 . 1 1 12 12 CYS CB C 12 38.892 38.892 27.589 11.303 19542
1864 1 8 . 1 1 12 12 CYS H H 12 8.970 8.970 8.677 0.293 19542
1865 1 8 . 1 1 13 13 HIS N N 13 121.091 121.091 121.324 -0.233 19542
1866 1 8 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.514 0.135 19542
1867 1 8 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.358 -1.860 19542
1868 1 8 . 1 1 13 13 HIS H H 13 9.015 9.015 8.519 0.496 19542
1869 1 8 . 1 1 14 14 ARG N N 14 120.872 120.872 122.013 -1.141 19542
1870 1 8 . 1 1 14 14 ARG HA H 14 4.043 4.043 4.118 -0.075 19542
1871 1 8 . 1 1 14 14 ARG CA C 14 58.962 58.962 57.908 1.054 19542
1872 1 8 . 1 1 14 14 ARG CB C 14 30.014 30.014 29.767 0.246 19542
1873 1 8 . 1 1 14 14 ARG H H 14 8.689 8.689 8.114 0.575 19542
1874 1 8 . 1 1 15 15 ASP N N 15 121.233 121.233 118.225 3.008 19542
1875 1 8 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.902 -0.399 19542
1876 1 8 . 1 1 15 15 ASP CA C 15 54.306 54.306 54.227 0.079 19542
1877 1 8 . 1 1 15 15 ASP CB C 15 39.107 39.107 42.694 -3.587 19542
1878 1 8 . 1 1 15 15 ASP H H 15 8.907 8.907 8.165 0.742 19542
1879 1 8 . 1 1 16 16 MET N N 16 119.073 119.073 119.429 -0.356 19542
1880 1 8 . 1 1 16 16 MET HA H 16 4.415 4.415 4.612 -0.197 19542
1881 1 8 . 1 1 16 16 MET CA C 16 55.995 55.995 54.898 1.097 19542
1882 1 8 . 1 1 16 16 MET CB C 16 32.662 32.662 32.245 0.417 19542
1883 1 8 . 1 1 16 16 MET H H 16 7.811 7.811 7.798 0.013 19542
1884 1 8 . 1 1 17 17 LYS N N 17 120.187 120.187 123.791 -3.604 19542
1885 1 8 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.283 -0.016 19542
1886 1 8 . 1 1 17 17 LYS CA C 17 55.889 55.889 56.462 -0.573 19542
1887 1 8 . 1 1 17 17 LYS CB C 17 34.106 34.106 34.543 -0.437 19542
1888 1 8 . 1 1 17 17 LYS H H 17 7.763 7.763 8.491 -0.728 19542
1889 1 8 . 1 1 18 18 PHE N N 18 115.631 115.631 117.221 -1.590 19542
1890 1 8 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.086 0.027 19542
1891 1 8 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.430 0.541 19542
1892 1 8 . 1 1 18 18 PHE CB C 18 43.018 43.018 42.990 0.028 19542
1893 1 8 . 1 1 18 18 PHE H H 18 8.252 8.252 8.365 -0.113 19542
1894 1 8 . 1 1 19 19 CYS N N 19 115.508 115.508 120.210 -4.702 19542
1895 1 8 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.189 0.813 19542
1896 1 8 . 1 1 19 19 CYS CA C 19 52.258 52.258 58.024 -5.766 19542
1897 1 8 . 1 1 19 19 CYS CB C 19 38.627 38.627 28.104 10.523 19542
1898 1 8 . 1 1 19 19 CYS H H 19 9.343 9.343 9.445 -0.102 19542
1899 1 8 . 1 1 20 20 TYR N N 20 128.934 128.934 119.013 9.921 19542
1900 1 8 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.759 0.448 19542
1901 1 8 . 1 1 20 20 TYR CA C 20 55.701 55.701 54.875 0.826 19542
1902 1 8 . 1 1 20 20 TYR CB C 20 43.184 43.184 41.278 1.906 19542
1903 1 8 . 1 1 20 20 TYR H H 20 8.871 8.871 9.110 -0.238 19542
1904 1 8 . 1 1 21 21 HIS N N 21 122.079 122.079 122.831 -0.752 19542
1905 1 8 . 1 1 21 21 HIS HA H 21 5.283 5.283 4.914 0.369 19542
1906 1 8 . 1 1 21 21 HIS CA C 21 54.713 54.713 54.377 0.336 19542
1907 1 8 . 1 1 21 21 HIS CB C 21 31.719 31.719 32.196 -0.477 19542
1908 1 8 . 1 1 21 21 HIS H H 21 8.797 8.797 9.375 -0.578 19542
1909 1 8 . 1 1 22 22 ASN N N 22 128.444 128.444 127.875 0.569 19542
1910 1 8 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.180 0.666 19542
1911 1 8 . 1 1 22 22 ASN CA C 22 52.512 52.512 51.912 0.600 19542
1912 1 8 . 1 1 22 22 ASN CB C 22 40.821 40.821 39.709 1.113 19542
1913 1 8 . 1 1 22 22 ASN H H 22 9.823 9.823 8.912 0.911 19542
1914 1 8 . 1 1 23 23 THR N N 23 116.691 116.691 117.836 -1.145 19542
1915 1 8 . 1 1 23 23 THR HA H 23 4.604 4.604 4.056 0.548 19542
1916 1 8 . 1 1 23 23 THR CA C 23 57.003 57.003 64.272 -7.269 19542
1917 1 8 . 1 1 23 23 THR CB C 23 69.344 69.344 69.376 -0.032 19542
1918 1 8 . 1 1 23 23 THR H H 23 8.561 8.561 8.301 0.260 19542
1919 1 8 . 1 1 24 24 GLY N N 24 110.763 110.763 111.466 -0.703 19542
1920 1 8 . 1 1 24 24 GLY CA C 24 44.993 44.993 45.280 -0.287 19542
1921 1 8 . 1 1 24 24 GLY H H 24 8.608 8.608 8.462 0.146 19542
1922 1 8 . 1 1 25 25 MET N N 25 120.520 120.520 122.714 -2.194 19542
1923 1 8 . 1 1 25 25 MET HA H 25 4.818 4.818 4.657 0.161 19542
1924 1 8 . 1 1 25 25 MET CA C 25 53.892 53.892 52.475 1.417 19542
1925 1 8 . 1 1 25 25 MET CB C 25 32.399 32.399 33.818 -1.419 19542
1926 1 8 . 1 1 25 25 MET H H 25 8.418 8.418 8.188 0.230 19542
1927 1 8 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.497 -0.120 19542
1928 1 8 . 1 1 26 26 PRO CA C 26 63.841 63.841 62.591 1.250 19542
1929 1 8 . 1 1 26 26 PRO CB C 26 31.750 31.750 31.842 -0.092 19542
1930 1 8 . 1 1 27 27 PHE N N 27 118.056 118.056 123.834 -5.778 19542
1931 1 8 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.782 -0.157 19542
1932 1 8 . 1 1 27 27 PHE CA C 27 57.332 57.332 56.506 0.826 19542
1933 1 8 . 1 1 27 27 PHE CB C 27 39.701 39.701 42.035 -2.334 19542
1934 1 8 . 1 1 27 27 PHE H H 27 7.988 7.988 8.027 -0.039 19542
1935 1 8 . 1 1 28 28 ARG N N 28 121.294 121.294 123.842 -2.548 19542
1936 1 8 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.235 -0.176 19542
1937 1 8 . 1 1 28 28 ARG CA C 28 57.142 57.142 57.703 -0.561 19542
1938 1 8 . 1 1 28 28 ARG CB C 28 29.711 29.711 30.286 -0.575 19542
1939 1 8 . 1 1 28 28 ARG H H 28 8.333 8.333 8.998 -0.665 19542
1940 1 8 . 1 1 29 29 ASN N N 29 116.243 116.243 116.106 0.137 19542
1941 1 8 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.398 0.198 19542
1942 1 8 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.097 -0.302 19542
1943 1 8 . 1 1 29 29 ASN CB C 29 38.239 38.239 37.699 0.540 19542
1944 1 8 . 1 1 29 29 ASN H H 29 8.356 8.356 8.892 -0.536 19542
1945 1 8 . 1 1 30 30 LEU N N 30 121.660 121.660 119.979 1.681 19542
1946 1 8 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.631 -0.186 19542
1947 1 8 . 1 1 30 30 LEU CA C 30 55.203 55.203 55.149 0.054 19542
1948 1 8 . 1 1 30 30 LEU CB C 30 42.982 42.982 43.728 -0.746 19542
1949 1 8 . 1 1 30 30 LEU H H 30 8.028 8.028 7.720 0.308 19542
1950 1 8 . 1 1 31 31 LYS N N 31 120.928 120.928 126.781 -5.853 19542
1951 1 8 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.385 -0.007 19542
1952 1 8 . 1 1 31 31 LYS CA C 31 56.271 56.271 55.698 0.573 19542
1953 1 8 . 1 1 31 31 LYS CB C 31 32.230 32.230 32.092 0.138 19542
1954 1 8 . 1 1 31 31 LYS H H 31 8.306 8.306 8.448 -0.142 19542
1955 1 8 . 1 1 32 32 LEU N N 32 122.843 122.843 127.134 -4.291 19542
1956 1 8 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.366 0.080 19542
1957 1 8 . 1 1 32 32 LEU CA C 32 54.484 54.484 54.831 -0.347 19542
1958 1 8 . 1 1 32 32 LEU CB C 32 43.404 43.404 42.528 0.876 19542
1959 1 8 . 1 1 32 32 LEU H H 32 8.027 8.027 8.309 -0.282 19542
1960 1 8 . 1 1 33 33 ILE N N 33 123.311 123.311 127.858 -4.547 19542
1961 1 8 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.403 -0.020 19542
1962 1 8 . 1 1 33 33 ILE CA C 33 60.595 60.595 59.699 0.896 19542
1963 1 8 . 1 1 33 33 ILE CB C 33 38.303 38.303 37.788 0.516 19542
1964 1 8 . 1 1 33 33 ILE H H 33 8.327 8.327 8.407 -0.080 19542
1965 1 8 . 1 1 34 34 LEU N N 34 128.669 128.669 129.045 -0.376 19542
1966 1 8 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.750 0.044 19542
1967 1 8 . 1 1 34 34 LEU CB C 34 42.873 42.873 42.082 0.791 19542
1968 1 8 . 1 1 34 34 LEU H H 34 8.880 8.880 8.914 -0.034 19542
1969 1 8 . 1 1 35 35 GLN N N 35 121.600 121.600 120.201 1.399 19542
1970 1 8 . 1 1 35 35 GLN HA H 35 4.588 4.588 4.886 -0.298 19542
1971 1 8 . 1 1 35 35 GLN CA C 35 61.390 61.390 55.229 6.161 19542
1972 1 8 . 1 1 35 35 GLN CB C 35 33.866 33.866 30.034 3.833 19542
1973 1 8 . 1 1 35 35 GLN H H 35 8.210 8.210 8.388 -0.178 19542
1974 1 8 . 1 1 36 36 GLY N N 36 106.726 106.726 109.678 -2.952 19542
1975 1 8 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.268 2.610 19542
1976 1 8 . 1 1 36 36 GLY H H 36 6.121 6.121 7.839 -1.718 19542
1977 1 8 . 1 1 37 37 CYS N N 37 124.584 124.584 118.333 6.251 19542
1978 1 8 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.244 0.630 19542
1979 1 8 . 1 1 37 37 CYS CA C 37 55.955 55.955 57.719 -1.764 19542
1980 1 8 . 1 1 37 37 CYS CB C 37 48.202 48.202 29.811 18.391 19542
1981 1 8 . 1 1 37 37 CYS H H 37 8.505 8.505 8.426 0.079 19542
1982 1 8 . 1 1 38 38 SER N N 38 115.036 115.036 117.499 -2.463 19542
1983 1 8 . 1 1 38 38 SER HA H 38 4.980 4.980 5.099 -0.119 19542
1984 1 8 . 1 1 38 38 SER CA C 38 58.792 58.792 56.501 2.291 19542
1985 1 8 . 1 1 38 38 SER CB C 38 65.971 65.971 65.018 0.953 19542
1986 1 8 . 1 1 38 38 SER H H 38 9.749 9.749 9.275 0.474 19542
1987 1 8 . 1 1 39 39 SER N N 39 117.276 117.276 116.699 0.577 19542
1988 1 8 . 1 1 39 39 SER HA H 39 4.827 4.827 5.047 -0.220 19542
1989 1 8 . 1 1 39 39 SER CA C 39 60.040 60.040 58.913 1.127 19542
1990 1 8 . 1 1 39 39 SER CB C 39 63.784 63.784 63.820 -0.036 19542
1991 1 8 . 1 1 39 39 SER H H 39 9.161 9.161 8.883 0.278 19542
1992 1 8 . 1 1 40 40 SER N N 40 115.041 115.041 114.316 0.725 19542
1993 1 8 . 1 1 40 40 SER HA H 40 4.660 4.660 4.774 -0.114 19542
1994 1 8 . 1 1 40 40 SER CA C 40 55.868 55.868 57.516 -1.648 19542
1995 1 8 . 1 1 40 40 SER CB C 40 64.868 64.868 65.918 -1.050 19542
1996 1 8 . 1 1 40 40 SER H H 40 7.911 7.911 7.706 0.205 19542
1997 1 8 . 1 1 41 41 CYS N N 41 124.146 124.146 118.872 5.274 19542
1998 1 8 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.563 -0.254 19542
1999 1 8 . 1 1 41 41 CYS CA C 41 57.567 57.567 56.667 0.900 19542
2000 1 8 . 1 1 41 41 CYS CB C 41 40.000 40.000 28.823 11.177 19542
2001 1 8 . 1 1 41 41 CYS H H 41 8.067 8.067 7.938 0.129 19542
2002 1 8 . 1 1 42 42 SER N N 42 118.590 118.590 118.705 -0.115 19542
2003 1 8 . 1 1 42 42 SER HA H 42 4.611 4.611 4.520 0.091 19542
2004 1 8 . 1 1 42 42 SER CA C 42 59.020 59.020 57.999 1.020 19542
2005 1 8 . 1 1 42 42 SER CB C 42 64.112 64.112 64.099 0.013 19542
2006 1 8 . 1 1 42 42 SER H H 42 8.491 8.491 8.277 0.214 19542
2007 1 8 . 1 1 43 43 GLU N N 43 118.830 118.830 119.020 -0.190 19542
2008 1 8 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.248 0.401 19542
2009 1 8 . 1 1 43 43 GLU CA C 43 56.856 56.856 57.111 -0.256 19542
2010 1 8 . 1 1 43 43 GLU CB C 43 29.206 29.206 29.673 -0.467 19542
2011 1 8 . 1 1 43 43 GLU H H 43 8.861 8.861 8.502 0.359 19542
2012 1 8 . 1 1 44 44 THR N N 44 117.954 117.954 114.711 3.243 19542
2013 1 8 . 1 1 44 44 THR HA H 44 4.619 4.619 4.451 0.168 19542
2014 1 8 . 1 1 44 44 THR CB C 44 72.341 72.341 70.494 1.847 19542
2015 1 8 . 1 1 44 44 THR H H 44 9.030 9.030 7.617 1.413 19542
2016 1 8 . 1 1 45 45 GLU N N 45 127.100 127.100 125.890 1.210 19542
2017 1 8 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.251 -0.157 19542
2018 1 8 . 1 1 45 45 GLU CA C 45 58.934 58.934 58.392 0.542 19542
2019 1 8 . 1 1 45 45 GLU CB C 45 27.009 27.009 29.924 -2.915 19542
2020 1 8 . 1 1 45 45 GLU H H 45 8.837 8.837 8.825 0.012 19542
2021 1 8 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.341 0.561 19542
2022 1 8 . 1 1 46 46 ASN CA C 46 53.244 53.244 56.249 -3.005 19542
2023 1 8 . 1 1 46 46 ASN CB C 46 40.053 40.053 39.054 0.999 19542
2024 1 8 . 1 1 46 46 ASN H H 46 8.018 8.018 7.941 0.077 19542
2025 1 8 . 1 1 47 47 ASN N N 47 120.765 120.765 117.160 3.605 19542
2026 1 8 . 1 1 47 47 ASN HA H 47 5.362 5.362 5.294 0.068 19542
2027 1 8 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.266 1.713 19542
2028 1 8 . 1 1 47 47 ASN CB C 47 41.749 41.749 39.736 2.013 19542
2029 1 8 . 1 1 47 47 ASN H H 47 7.835 7.835 7.930 -0.095 19542
2030 1 8 . 1 1 48 48 LYS N N 48 123.576 123.576 125.742 -2.166 19542
2031 1 8 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.672 0.170 19542
2032 1 8 . 1 1 48 48 LYS CB C 48 34.398 34.398 34.124 0.274 19542
2033 1 8 . 1 1 48 48 LYS H H 48 8.548 8.548 8.819 -0.271 19542
2034 1 8 . 1 1 49 49 CYS N N 49 116.141 116.141 117.478 -1.337 19542
2035 1 8 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.803 -0.250 19542
2036 1 8 . 1 1 49 49 CYS CA C 49 53.386 53.386 55.895 -2.509 19542
2037 1 8 . 1 1 49 49 CYS CB C 49 44.935 44.935 28.908 16.027 19542
2038 1 8 . 1 1 49 49 CYS H H 49 8.873 8.873 8.498 0.375 19542
2039 1 8 . 1 1 50 50 CYS N N 50 118.484 118.484 121.987 -3.503 19542
2040 1 8 . 1 1 50 50 CYS HA H 50 5.265 5.265 4.964 0.301 19542
2041 1 8 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.867 -1.884 19542
2042 1 8 . 1 1 50 50 CYS CB C 50 46.111 46.111 30.482 15.629 19542
2043 1 8 . 1 1 50 50 CYS H H 50 9.389 9.389 9.282 0.107 19542
2044 1 8 . 1 1 51 51 SER N N 51 115.213 115.213 116.030 -0.817 19542
2045 1 8 . 1 1 51 51 SER HA H 51 5.016 5.016 4.847 0.169 19542
2046 1 8 . 1 1 51 51 SER CA C 51 58.118 58.118 57.927 0.191 19542
2047 1 8 . 1 1 51 51 SER CB C 51 64.457 64.457 63.190 1.267 19542
2048 1 8 . 1 1 51 51 SER H H 51 9.290 9.290 8.581 0.709 19542
2049 1 8 . 1 1 52 52 THR N N 52 112.156 112.156 117.941 -5.785 19542
2050 1 8 . 1 1 52 52 THR HA H 52 4.692 4.692 4.498 0.194 19542
2051 1 8 . 1 1 52 52 THR CA C 52 59.835 59.835 61.751 -1.916 19542
2052 1 8 . 1 1 52 52 THR CB C 52 71.872 71.872 72.209 -0.337 19542
2053 1 8 . 1 1 52 52 THR H H 52 7.624 7.624 7.352 0.272 19542
2054 1 8 . 1 1 53 53 ASP N N 53 119.869 119.869 122.223 -2.354 19542
2055 1 8 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.333 0.637 19542
2056 1 8 . 1 1 53 53 ASP CA C 53 55.485 55.485 55.579 -0.094 19542
2057 1 8 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.926 -0.204 19542
2058 1 8 . 1 1 53 53 ASP H H 53 8.410 8.410 8.710 -0.300 19542
2059 1 8 . 1 1 54 54 ARG N N 54 111.677 111.677 120.094 -8.417 19542
2060 1 8 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.538 -0.353 19542
2061 1 8 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.589 0.373 19542
2062 1 8 . 1 1 54 54 ARG CB C 54 28.429 28.429 27.135 1.294 19542
2063 1 8 . 1 1 54 54 ARG H H 54 9.306 9.306 8.559 0.747 19542
2064 1 8 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.513 0.048 19542
2065 1 8 . 1 1 55 55 CYS CA C 55 57.814 57.814 59.538 -1.724 19542
2066 1 8 . 1 1 55 55 CYS CB C 55 46.236 46.236 27.259 18.977 19542
2067 1 8 . 1 1 55 55 CYS H H 55 7.995 7.995 7.901 0.094 19542
2068 1 8 . 1 1 56 56 ASN N N 56 121.881 121.881 119.299 2.582 19542
2069 1 8 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.705 0.105 19542
2070 1 8 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.631 -0.265 19542
2071 1 8 . 1 1 56 56 ASN CB C 56 37.837 37.837 36.590 1.247 19542
2072 1 8 . 1 1 56 56 ASN H H 56 8.755 8.755 8.720 0.035 19542
2073 1 9 . 1 1 2 2 LYS N N 2 126.352 126.352 121.947 4.405 19542
2074 1 9 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.480 -0.090 19542
2075 1 9 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.295 0.107 19542
2076 1 9 . 1 1 2 2 LYS CB C 2 29.734 29.734 33.047 -3.313 19542
2077 1 9 . 1 1 2 2 LYS H H 2 8.381 8.381 9.158 -0.777 19542
2078 1 9 . 1 1 3 3 CYS N N 3 117.974 117.974 120.796 -2.822 19542
2079 1 9 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.505 0.454 19542
2080 1 9 . 1 1 3 3 CYS CA C 3 51.272 51.272 58.187 -6.915 19542
2081 1 9 . 1 1 3 3 CYS CB C 3 42.039 42.039 32.202 9.837 19542
2082 1 9 . 1 1 3 3 CYS H H 3 8.394 8.394 8.527 -0.133 19542
2083 1 9 . 1 1 4 4 PHE N N 4 120.016 120.016 120.761 -0.745 19542
2084 1 9 . 1 1 4 4 PHE HA H 4 4.606 4.606 4.934 -0.329 19542
2085 1 9 . 1 1 4 4 PHE CB C 4 39.719 39.719 36.785 2.934 19542
2086 1 9 . 1 1 4 4 PHE H H 4 9.550 9.550 9.211 0.339 19542
2087 1 9 . 1 1 5 5 GLN N N 5 120.517 120.517 122.519 -2.002 19542
2088 1 9 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.293 0.129 19542
2089 1 9 . 1 1 5 5 GLN CA C 5 56.003 56.003 57.670 -1.667 19542
2090 1 9 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.676 2.918 19542
2091 1 9 . 1 1 5 5 GLN H H 5 9.406 9.406 7.980 1.426 19542
2092 1 9 . 1 1 6 6 HIS N N 6 118.478 118.478 117.782 0.696 19542
2093 1 9 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.657 -0.179 19542
2094 1 9 . 1 1 6 6 HIS CA C 6 56.627 56.627 56.101 0.526 19542
2095 1 9 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.362 -2.386 19542
2096 1 9 . 1 1 6 6 HIS H H 6 8.827 8.827 7.516 1.311 19542
2097 1 9 . 1 1 7 7 GLY N N 7 103.072 103.072 106.246 -3.174 19542
2098 1 9 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.223 0.701 19542
2099 1 9 . 1 1 7 7 GLY H H 7 8.440 8.440 8.472 -0.032 19542
2100 1 9 . 1 1 8 8 LYS N N 8 119.909 119.909 120.902 -0.993 19542
2101 1 9 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.828 0.000 19542
2102 1 9 . 1 1 8 8 LYS CB C 8 35.493 35.493 34.586 0.907 19542
2103 1 9 . 1 1 8 8 LYS H H 8 7.703 7.703 7.892 -0.189 19542
2104 1 9 . 1 1 9 9 VAL N N 9 122.232 122.232 122.285 -0.053 19542
2105 1 9 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.763 0.049 19542
2106 1 9 . 1 1 9 9 VAL CA C 9 63.286 63.286 63.003 0.283 19542
2107 1 9 . 1 1 9 9 VAL CB C 9 26.812 26.812 30.448 -3.636 19542
2108 1 9 . 1 1 9 9 VAL H H 9 8.552 8.552 8.487 0.065 19542
2109 1 9 . 1 1 10 10 VAL N N 10 123.963 123.963 125.615 -1.652 19542
2110 1 9 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.712 -0.106 19542
2111 1 9 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.637 0.755 19542
2112 1 9 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.130 -0.348 19542
2113 1 9 . 1 1 10 10 VAL H H 10 8.920 8.920 8.696 0.224 19542
2114 1 9 . 1 1 11 11 THR N N 11 118.572 118.572 120.319 -1.747 19542
2115 1 9 . 1 1 11 11 THR HA H 11 4.443 4.443 4.556 -0.113 19542
2116 1 9 . 1 1 11 11 THR CA C 11 62.719 62.719 62.723 -0.004 19542
2117 1 9 . 1 1 11 11 THR CB C 11 68.689 68.689 68.451 0.238 19542
2118 1 9 . 1 1 11 11 THR H H 11 8.517 8.517 8.137 0.380 19542
2119 1 9 . 1 1 12 12 CYS N N 12 126.835 126.835 126.161 0.674 19542
2120 1 9 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.498 0.173 19542
2121 1 9 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.945 -5.909 19542
2122 1 9 . 1 1 12 12 CYS CB C 12 38.892 38.892 27.239 11.653 19542
2123 1 9 . 1 1 12 12 CYS H H 12 8.970 8.970 8.605 0.365 19542
2124 1 9 . 1 1 13 13 HIS N N 13 121.091 121.091 122.893 -1.802 19542
2125 1 9 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.525 0.124 19542
2126 1 9 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.218 -1.720 19542
2127 1 9 . 1 1 13 13 HIS H H 13 9.015 9.015 8.678 0.337 19542
2128 1 9 . 1 1 14 14 ARG N N 14 120.872 120.872 119.838 1.034 19542
2129 1 9 . 1 1 14 14 ARG HA H 14 4.043 4.043 4.114 -0.071 19542
2130 1 9 . 1 1 14 14 ARG CA C 14 58.962 58.962 57.812 1.150 19542
2131 1 9 . 1 1 14 14 ARG CB C 14 30.014 30.014 29.980 0.034 19542
2132 1 9 . 1 1 14 14 ARG H H 14 8.689 8.689 8.096 0.593 19542
2133 1 9 . 1 1 15 15 ASP N N 15 121.233 121.233 118.302 2.931 19542
2134 1 9 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.561 -0.058 19542
2135 1 9 . 1 1 15 15 ASP CA C 15 54.306 54.306 56.216 -1.910 19542
2136 1 9 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.373 -2.265 19542
2137 1 9 . 1 1 15 15 ASP H H 15 8.907 8.907 7.765 1.142 19542
2138 1 9 . 1 1 16 16 MET N N 16 119.073 119.073 118.704 0.369 19542
2139 1 9 . 1 1 16 16 MET HA H 16 4.415 4.415 4.663 -0.248 19542
2140 1 9 . 1 1 16 16 MET CA C 16 55.995 55.995 54.832 1.163 19542
2141 1 9 . 1 1 16 16 MET CB C 16 32.662 32.662 31.283 1.379 19542
2142 1 9 . 1 1 16 16 MET H H 16 7.811 7.811 7.574 0.237 19542
2143 1 9 . 1 1 17 17 LYS N N 17 120.187 120.187 122.543 -2.356 19542
2144 1 9 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.252 0.015 19542
2145 1 9 . 1 1 17 17 LYS CA C 17 55.889 55.889 56.727 -0.838 19542
2146 1 9 . 1 1 17 17 LYS CB C 17 34.106 34.106 33.337 0.769 19542
2147 1 9 . 1 1 17 17 LYS H H 17 7.763 7.763 8.300 -0.537 19542
2148 1 9 . 1 1 18 18 PHE N N 18 115.631 115.631 117.995 -2.364 19542
2149 1 9 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.102 0.011 19542
2150 1 9 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.522 0.449 19542
2151 1 9 . 1 1 18 18 PHE CB C 18 43.018 43.018 42.700 0.318 19542
2152 1 9 . 1 1 18 18 PHE H H 18 8.252 8.252 8.059 0.193 19542
2153 1 9 . 1 1 19 19 CYS N N 19 115.508 115.508 121.745 -6.237 19542
2154 1 9 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.309 0.693 19542
2155 1 9 . 1 1 19 19 CYS CA C 19 52.258 52.258 57.959 -5.701 19542
2156 1 9 . 1 1 19 19 CYS CB C 19 38.627 38.627 27.958 10.669 19542
2157 1 9 . 1 1 19 19 CYS H H 19 9.343 9.343 9.390 -0.047 19542
2158 1 9 . 1 1 20 20 TYR N N 20 128.934 128.934 118.924 10.010 19542
2159 1 9 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.797 0.410 19542
2160 1 9 . 1 1 20 20 TYR CA C 20 55.701 55.701 54.911 0.790 19542
2161 1 9 . 1 1 20 20 TYR CB C 20 43.184 43.184 41.187 1.997 19542
2162 1 9 . 1 1 20 20 TYR H H 20 8.871 8.871 9.225 -0.354 19542
2163 1 9 . 1 1 21 21 HIS N N 21 122.079 122.079 123.186 -1.107 19542
2164 1 9 . 1 1 21 21 HIS HA H 21 5.283 5.283 4.860 0.423 19542
2165 1 9 . 1 1 21 21 HIS CA C 21 54.713 54.713 53.940 0.773 19542
2166 1 9 . 1 1 21 21 HIS CB C 21 31.719 31.719 31.530 0.189 19542
2167 1 9 . 1 1 21 21 HIS H H 21 8.797 8.797 9.321 -0.524 19542
2168 1 9 . 1 1 22 22 ASN N N 22 128.444 128.444 128.779 -0.335 19542
2169 1 9 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.153 0.693 19542
2170 1 9 . 1 1 22 22 ASN CA C 22 52.512 52.512 52.465 0.047 19542
2171 1 9 . 1 1 22 22 ASN CB C 22 40.821 40.821 40.195 0.626 19542
2172 1 9 . 1 1 22 22 ASN H H 22 9.823 9.823 9.032 0.791 19542
2173 1 9 . 1 1 23 23 THR N N 23 116.691 116.691 119.722 -3.031 19542
2174 1 9 . 1 1 23 23 THR HA H 23 4.604 4.604 4.807 -0.203 19542
2175 1 9 . 1 1 23 23 THR CA C 23 57.003 57.003 59.750 -2.747 19542
2176 1 9 . 1 1 23 23 THR CB C 23 69.344 69.344 70.468 -1.124 19542
2177 1 9 . 1 1 23 23 THR H H 23 8.561 8.561 7.282 1.279 19542
2178 1 9 . 1 1 24 24 GLY N N 24 110.763 110.763 108.609 2.154 19542
2179 1 9 . 1 1 24 24 GLY CA C 24 44.993 44.993 45.511 -0.518 19542
2180 1 9 . 1 1 24 24 GLY H H 24 8.608 8.608 8.289 0.319 19542
2181 1 9 . 1 1 25 25 MET N N 25 120.520 120.520 119.713 0.807 19542
2182 1 9 . 1 1 25 25 MET HA H 25 4.818 4.818 4.676 0.142 19542
2183 1 9 . 1 1 25 25 MET CA C 25 53.892 53.892 52.170 1.722 19542
2184 1 9 . 1 1 25 25 MET CB C 25 32.399 32.399 34.696 -2.297 19542
2185 1 9 . 1 1 25 25 MET H H 25 8.418 8.418 7.301 1.117 19542
2186 1 9 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.271 0.106 19542
2187 1 9 . 1 1 26 26 PRO CA C 26 63.841 63.841 62.871 0.970 19542
2188 1 9 . 1 1 26 26 PRO CB C 26 31.750 31.750 31.000 0.750 19542
2189 1 9 . 1 1 27 27 PHE N N 27 118.056 118.056 123.609 -5.553 19542
2190 1 9 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.580 0.045 19542
2191 1 9 . 1 1 27 27 PHE CA C 27 57.332 57.332 56.435 0.897 19542
2192 1 9 . 1 1 27 27 PHE CB C 27 39.701 39.701 39.969 -0.268 19542
2193 1 9 . 1 1 27 27 PHE H H 27 7.988 7.988 7.619 0.369 19542
2194 1 9 . 1 1 28 28 ARG N N 28 121.294 121.294 124.219 -2.925 19542
2195 1 9 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.276 -0.217 19542
2196 1 9 . 1 1 28 28 ARG CA C 28 57.142 57.142 56.348 0.794 19542
2197 1 9 . 1 1 28 28 ARG CB C 28 29.711 29.711 29.518 0.193 19542
2198 1 9 . 1 1 28 28 ARG H H 28 8.333 8.333 8.941 -0.608 19542
2199 1 9 . 1 1 29 29 ASN N N 29 116.243 116.243 115.977 0.266 19542
2200 1 9 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.354 0.242 19542
2201 1 9 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.253 -0.458 19542
2202 1 9 . 1 1 29 29 ASN CB C 29 38.239 38.239 37.499 0.739 19542
2203 1 9 . 1 1 29 29 ASN H H 29 8.356 8.356 8.939 -0.583 19542
2204 1 9 . 1 1 30 30 LEU N N 30 121.660 121.660 119.348 2.312 19542
2205 1 9 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.634 -0.189 19542
2206 1 9 . 1 1 30 30 LEU CA C 30 55.203 55.203 55.012 0.191 19542
2207 1 9 . 1 1 30 30 LEU CB C 30 42.982 42.982 44.806 -1.823 19542
2208 1 9 . 1 1 30 30 LEU H H 30 8.028 8.028 7.429 0.599 19542
2209 1 9 . 1 1 31 31 LYS N N 31 120.928 120.928 125.423 -4.495 19542
2210 1 9 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.560 -0.182 19542
2211 1 9 . 1 1 31 31 LYS CA C 31 56.271 56.271 55.172 1.099 19542
2212 1 9 . 1 1 31 31 LYS CB C 31 32.230 32.230 33.452 -1.222 19542
2213 1 9 . 1 1 31 31 LYS H H 31 8.306 8.306 8.409 -0.103 19542
2214 1 9 . 1 1 32 32 LEU N N 32 122.843 122.843 127.803 -4.960 19542
2215 1 9 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.486 -0.040 19542
2216 1 9 . 1 1 32 32 LEU CA C 32 54.484 54.484 54.961 -0.476 19542
2217 1 9 . 1 1 32 32 LEU CB C 32 43.404 43.404 42.813 0.591 19542
2218 1 9 . 1 1 32 32 LEU H H 32 8.027 8.027 8.915 -0.888 19542
2219 1 9 . 1 1 33 33 ILE N N 33 123.311 123.311 127.611 -4.300 19542
2220 1 9 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.490 -0.107 19542
2221 1 9 . 1 1 33 33 ILE CA C 33 60.595 60.595 59.857 0.738 19542
2222 1 9 . 1 1 33 33 ILE CB C 33 38.303 38.303 37.125 1.178 19542
2223 1 9 . 1 1 33 33 ILE H H 33 8.327 8.327 8.259 0.068 19542
2224 1 9 . 1 1 34 34 LEU N N 34 128.669 128.669 129.634 -0.965 19542
2225 1 9 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.748 0.046 19542
2226 1 9 . 1 1 34 34 LEU CB C 34 42.873 42.873 40.824 2.050 19542
2227 1 9 . 1 1 34 34 LEU H H 34 8.880 8.880 8.556 0.324 19542
2228 1 9 . 1 1 35 35 GLN N N 35 121.600 121.600 120.503 1.097 19542
2229 1 9 . 1 1 35 35 GLN HA H 35 4.588 4.588 5.096 -0.508 19542
2230 1 9 . 1 1 35 35 GLN CA C 35 61.390 61.390 55.155 6.235 19542
2231 1 9 . 1 1 35 35 GLN CB C 35 33.866 33.866 30.618 3.248 19542
2232 1 9 . 1 1 35 35 GLN H H 35 8.210 8.210 7.658 0.552 19542
2233 1 9 . 1 1 36 36 GLY N N 36 106.726 106.726 109.609 -2.883 19542
2234 1 9 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.647 2.231 19542
2235 1 9 . 1 1 36 36 GLY H H 36 6.121 6.121 7.669 -1.548 19542
2236 1 9 . 1 1 37 37 CYS N N 37 124.584 124.584 119.158 5.426 19542
2237 1 9 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.397 0.477 19542
2238 1 9 . 1 1 37 37 CYS CA C 37 55.955 55.955 58.164 -2.209 19542
2239 1 9 . 1 1 37 37 CYS CB C 37 48.202 48.202 30.165 18.037 19542
2240 1 9 . 1 1 37 37 CYS H H 37 8.505 8.505 8.539 -0.034 19542
2241 1 9 . 1 1 38 38 SER N N 38 115.036 115.036 118.342 -3.306 19542
2242 1 9 . 1 1 38 38 SER HA H 38 4.980 4.980 5.005 -0.025 19542
2243 1 9 . 1 1 38 38 SER CA C 38 58.792 58.792 57.447 1.345 19542
2244 1 9 . 1 1 38 38 SER CB C 38 65.971 65.971 66.252 -0.281 19542
2245 1 9 . 1 1 38 38 SER H H 38 9.749 9.749 9.446 0.303 19542
2246 1 9 . 1 1 39 39 SER N N 39 117.276 117.276 118.706 -1.430 19542
2247 1 9 . 1 1 39 39 SER HA H 39 4.827 4.827 4.919 -0.092 19542
2248 1 9 . 1 1 39 39 SER CA C 39 60.040 60.040 59.377 0.663 19542
2249 1 9 . 1 1 39 39 SER CB C 39 63.784 63.784 63.650 0.134 19542
2250 1 9 . 1 1 39 39 SER H H 39 9.161 9.161 8.782 0.379 19542
2251 1 9 . 1 1 40 40 SER N N 40 115.041 115.041 115.382 -0.341 19542
2252 1 9 . 1 1 40 40 SER HA H 40 4.660 4.660 4.629 0.031 19542
2253 1 9 . 1 1 40 40 SER CA C 40 55.868 55.868 56.772 -0.903 19542
2254 1 9 . 1 1 40 40 SER CB C 40 64.868 64.868 65.528 -0.660 19542
2255 1 9 . 1 1 40 40 SER H H 40 7.911 7.911 7.610 0.301 19542
2256 1 9 . 1 1 41 41 CYS N N 41 124.146 124.146 120.082 4.064 19542
2257 1 9 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.515 -0.206 19542
2258 1 9 . 1 1 41 41 CYS CA C 41 57.567 57.567 57.401 0.166 19542
2259 1 9 . 1 1 41 41 CYS CB C 41 40.000 40.000 28.336 11.664 19542
2260 1 9 . 1 1 41 41 CYS H H 41 8.067 8.067 8.318 -0.251 19542
2261 1 9 . 1 1 42 42 SER N N 42 118.590 118.590 123.620 -5.030 19542
2262 1 9 . 1 1 42 42 SER HA H 42 4.611 4.611 4.388 0.223 19542
2263 1 9 . 1 1 42 42 SER CA C 42 59.020 59.020 57.351 1.669 19542
2264 1 9 . 1 1 42 42 SER CB C 42 64.112 64.112 62.437 1.675 19542
2265 1 9 . 1 1 42 42 SER H H 42 8.491 8.491 8.718 -0.227 19542
2266 1 9 . 1 1 43 43 GLU N N 43 118.830 118.830 124.998 -6.168 19542
2267 1 9 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.216 0.433 19542
2268 1 9 . 1 1 43 43 GLU CA C 43 56.856 56.856 56.562 0.294 19542
2269 1 9 . 1 1 43 43 GLU CB C 43 29.206 29.206 28.516 0.690 19542
2270 1 9 . 1 1 43 43 GLU H H 43 8.861 8.861 8.111 0.750 19542
2271 1 9 . 1 1 44 44 THR N N 44 117.954 117.954 116.253 1.701 19542
2272 1 9 . 1 1 44 44 THR HA H 44 4.619 4.619 4.505 0.114 19542
2273 1 9 . 1 1 44 44 THR CB C 44 72.341 72.341 70.842 1.499 19542
2274 1 9 . 1 1 44 44 THR H H 44 9.030 9.030 7.763 1.267 19542
2275 1 9 . 1 1 45 45 GLU N N 45 127.100 127.100 119.855 7.245 19542
2276 1 9 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.231 -0.137 19542
2277 1 9 . 1 1 45 45 GLU CA C 45 58.934 58.934 58.028 0.906 19542
2278 1 9 . 1 1 45 45 GLU CB C 45 27.009 27.009 30.067 -3.058 19542
2279 1 9 . 1 1 45 45 GLU H H 45 8.837 8.837 8.731 0.106 19542
2280 1 9 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.533 0.369 19542
2281 1 9 . 1 1 46 46 ASN CA C 46 53.244 53.244 54.271 -1.027 19542
2282 1 9 . 1 1 46 46 ASN CB C 46 40.053 40.053 38.824 1.229 19542
2283 1 9 . 1 1 46 46 ASN H H 46 8.018 8.018 8.123 -0.105 19542
2284 1 9 . 1 1 47 47 ASN N N 47 120.765 120.765 119.176 1.589 19542
2285 1 9 . 1 1 47 47 ASN HA H 47 5.362 5.362 5.029 0.333 19542
2286 1 9 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.720 1.259 19542
2287 1 9 . 1 1 47 47 ASN CB C 47 41.749 41.749 38.956 2.793 19542
2288 1 9 . 1 1 47 47 ASN H H 47 7.835 7.835 7.518 0.317 19542
2289 1 9 . 1 1 48 48 LYS N N 48 123.576 123.576 126.969 -3.393 19542
2290 1 9 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.678 0.164 19542
2291 1 9 . 1 1 48 48 LYS CB C 48 34.398 34.398 33.168 1.230 19542
2292 1 9 . 1 1 48 48 LYS H H 48 8.548 8.548 8.551 -0.003 19542
2293 1 9 . 1 1 49 49 CYS N N 49 116.141 116.141 120.615 -4.474 19542
2294 1 9 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.899 -0.346 19542
2295 1 9 . 1 1 49 49 CYS CA C 49 53.386 53.386 55.922 -2.536 19542
2296 1 9 . 1 1 49 49 CYS CB C 49 44.935 44.935 27.711 17.224 19542
2297 1 9 . 1 1 49 49 CYS H H 49 8.873 8.873 8.752 0.121 19542
2298 1 9 . 1 1 50 50 CYS N N 50 118.484 118.484 121.947 -3.463 19542
2299 1 9 . 1 1 50 50 CYS HA H 50 5.265 5.265 4.955 0.310 19542
2300 1 9 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.113 -1.130 19542
2301 1 9 . 1 1 50 50 CYS CB C 50 46.111 46.111 30.918 15.193 19542
2302 1 9 . 1 1 50 50 CYS H H 50 9.389 9.389 9.391 -0.002 19542
2303 1 9 . 1 1 51 51 SER N N 51 115.213 115.213 115.695 -0.482 19542
2304 1 9 . 1 1 51 51 SER HA H 51 5.016 5.016 4.691 0.325 19542
2305 1 9 . 1 1 51 51 SER CA C 51 58.118 58.118 57.730 0.388 19542
2306 1 9 . 1 1 51 51 SER CB C 51 64.457 64.457 63.106 1.351 19542
2307 1 9 . 1 1 51 51 SER H H 51 9.290 9.290 8.539 0.751 19542
2308 1 9 . 1 1 52 52 THR N N 52 112.156 112.156 118.978 -6.822 19542
2309 1 9 . 1 1 52 52 THR HA H 52 4.692 4.692 4.493 0.199 19542
2310 1 9 . 1 1 52 52 THR CA C 52 59.835 59.835 61.299 -1.464 19542
2311 1 9 . 1 1 52 52 THR CB C 52 71.872 71.872 71.341 0.531 19542
2312 1 9 . 1 1 52 52 THR H H 52 7.624 7.624 7.299 0.325 19542
2313 1 9 . 1 1 53 53 ASP N N 53 119.869 119.869 123.618 -3.749 19542
2314 1 9 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.426 0.544 19542
2315 1 9 . 1 1 53 53 ASP CA C 53 55.485 55.485 55.907 -0.422 19542
2316 1 9 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.699 0.023 19542
2317 1 9 . 1 1 53 53 ASP H H 53 8.410 8.410 8.674 -0.264 19542
2318 1 9 . 1 1 54 54 ARG N N 54 111.677 111.677 118.570 -6.893 19542
2319 1 9 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.680 -0.495 19542
2320 1 9 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.285 0.677 19542
2321 1 9 . 1 1 54 54 ARG CB C 54 28.429 28.429 27.061 1.368 19542
2322 1 9 . 1 1 54 54 ARG H H 54 9.306 9.306 8.437 0.869 19542
2323 1 9 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.445 0.116 19542
2324 1 9 . 1 1 55 55 CYS CA C 55 57.814 57.814 59.352 -1.538 19542
2325 1 9 . 1 1 55 55 CYS CB C 55 46.236 46.236 27.595 18.641 19542
2326 1 9 . 1 1 55 55 CYS H H 55 7.995 7.995 7.997 -0.002 19542
2327 1 9 . 1 1 56 56 ASN N N 56 121.881 121.881 120.393 1.488 19542
2328 1 9 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.686 0.124 19542
2329 1 9 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.460 -0.094 19542
2330 1 9 . 1 1 56 56 ASN CB C 56 37.837 37.837 36.502 1.335 19542
2331 1 9 . 1 1 56 56 ASN H H 56 8.755 8.755 8.650 0.105 19542
2332 1 10 . 1 1 2 2 LYS N N 2 126.352 126.352 120.901 5.451 19542
2333 1 10 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.265 0.125 19542
2334 1 10 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.798 -0.397 19542
2335 1 10 . 1 1 2 2 LYS CB C 2 29.734 29.734 33.034 -3.300 19542
2336 1 10 . 1 1 2 2 LYS H H 2 8.381 8.381 8.328 0.053 19542
2337 1 10 . 1 1 3 3 CYS N N 3 117.974 117.974 120.823 -2.849 19542
2338 1 10 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.678 0.281 19542
2339 1 10 . 1 1 3 3 CYS CA C 3 51.272 51.272 57.517 -6.245 19542
2340 1 10 . 1 1 3 3 CYS CB C 3 42.039 42.039 31.681 10.358 19542
2341 1 10 . 1 1 3 3 CYS H H 3 8.394 8.394 8.782 -0.388 19542
2342 1 10 . 1 1 4 4 PHE N N 4 120.016 120.016 120.821 -0.805 19542
2343 1 10 . 1 1 4 4 PHE HA H 4 4.606 4.606 4.991 -0.385 19542
2344 1 10 . 1 1 4 4 PHE CB C 4 39.719 39.719 36.919 2.800 19542
2345 1 10 . 1 1 4 4 PHE H H 4 9.550 9.550 9.376 0.174 19542
2346 1 10 . 1 1 5 5 GLN N N 5 120.517 120.517 123.470 -2.953 19542
2347 1 10 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.263 0.159 19542
2348 1 10 . 1 1 5 5 GLN CA C 5 56.003 56.003 58.278 -2.275 19542
2349 1 10 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.387 3.207 19542
2350 1 10 . 1 1 5 5 GLN H H 5 9.406 9.406 7.913 1.493 19542
2351 1 10 . 1 1 6 6 HIS N N 6 118.478 118.478 117.034 1.444 19542
2352 1 10 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.533 -0.055 19542
2353 1 10 . 1 1 6 6 HIS CA C 6 56.627 56.627 57.201 -0.574 19542
2354 1 10 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.200 -2.224 19542
2355 1 10 . 1 1 6 6 HIS H H 6 8.827 8.827 7.734 1.093 19542
2356 1 10 . 1 1 7 7 GLY N N 7 103.072 103.072 105.415 -2.343 19542
2357 1 10 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.212 0.712 19542
2358 1 10 . 1 1 7 7 GLY H H 7 8.440 8.440 8.583 -0.143 19542
2359 1 10 . 1 1 8 8 LYS N N 8 119.909 119.909 120.961 -1.052 19542
2360 1 10 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.802 0.026 19542
2361 1 10 . 1 1 8 8 LYS CB C 8 35.493 35.493 35.303 0.190 19542
2362 1 10 . 1 1 8 8 LYS H H 8 7.703 7.703 8.074 -0.371 19542
2363 1 10 . 1 1 9 9 VAL N N 9 122.232 122.232 123.818 -1.586 19542
2364 1 10 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.629 0.183 19542
2365 1 10 . 1 1 9 9 VAL CA C 9 63.286 63.286 63.017 0.268 19542
2366 1 10 . 1 1 9 9 VAL CB C 9 26.812 26.812 30.873 -4.061 19542
2367 1 10 . 1 1 9 9 VAL H H 9 8.552 8.552 8.517 0.035 19542
2368 1 10 . 1 1 10 10 VAL N N 10 123.963 123.963 124.663 -0.700 19542
2369 1 10 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.705 -0.099 19542
2370 1 10 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.239 1.153 19542
2371 1 10 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.452 -0.670 19542
2372 1 10 . 1 1 10 10 VAL H H 10 8.920 8.920 8.707 0.213 19542
2373 1 10 . 1 1 11 11 THR N N 11 118.572 118.572 119.239 -0.667 19542
2374 1 10 . 1 1 11 11 THR HA H 11 4.443 4.443 4.494 -0.051 19542
2375 1 10 . 1 1 11 11 THR CA C 11 62.719 62.719 62.952 -0.233 19542
2376 1 10 . 1 1 11 11 THR CB C 11 68.689 68.689 69.177 -0.488 19542
2377 1 10 . 1 1 11 11 THR H H 11 8.517 8.517 8.265 0.252 19542
2378 1 10 . 1 1 12 12 CYS N N 12 126.835 126.835 125.917 0.918 19542
2379 1 10 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.499 0.172 19542
2380 1 10 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.206 -5.170 19542
2381 1 10 . 1 1 12 12 CYS CB C 12 38.892 38.892 27.719 11.173 19542
2382 1 10 . 1 1 12 12 CYS H H 12 8.970 8.970 8.813 0.157 19542
2383 1 10 . 1 1 13 13 HIS N N 13 121.091 121.091 121.486 -0.395 19542
2384 1 10 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.550 0.099 19542
2385 1 10 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.162 -1.664 19542
2386 1 10 . 1 1 13 13 HIS H H 13 9.015 9.015 8.604 0.411 19542
2387 1 10 . 1 1 14 14 ARG N N 14 120.872 120.872 122.431 -1.559 19542
2388 1 10 . 1 1 14 14 ARG HA H 14 4.043 4.043 4.031 0.012 19542
2389 1 10 . 1 1 14 14 ARG CA C 14 58.962 58.962 58.185 0.777 19542
2390 1 10 . 1 1 14 14 ARG CB C 14 30.014 30.014 29.624 0.390 19542
2391 1 10 . 1 1 14 14 ARG H H 14 8.689 8.689 8.192 0.497 19542
2392 1 10 . 1 1 15 15 ASP N N 15 121.233 121.233 118.820 2.413 19542
2393 1 10 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.686 -0.183 19542
2394 1 10 . 1 1 15 15 ASP CA C 15 54.306 54.306 55.256 -0.950 19542
2395 1 10 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.464 -2.357 19542
2396 1 10 . 1 1 15 15 ASP H H 15 8.907 8.907 7.883 1.024 19542
2397 1 10 . 1 1 16 16 MET N N 16 119.073 119.073 119.646 -0.573 19542
2398 1 10 . 1 1 16 16 MET HA H 16 4.415 4.415 4.503 -0.088 19542
2399 1 10 . 1 1 16 16 MET CA C 16 55.995 55.995 55.389 0.606 19542
2400 1 10 . 1 1 16 16 MET CB C 16 32.662 32.662 32.538 0.124 19542
2401 1 10 . 1 1 16 16 MET H H 16 7.811 7.811 7.779 0.032 19542
2402 1 10 . 1 1 17 17 LYS N N 17 120.187 120.187 123.019 -2.832 19542
2403 1 10 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.308 -0.041 19542
2404 1 10 . 1 1 17 17 LYS CA C 17 55.889 55.889 56.223 -0.334 19542
2405 1 10 . 1 1 17 17 LYS CB C 17 34.106 34.106 35.141 -1.035 19542
2406 1 10 . 1 1 17 17 LYS H H 17 7.763 7.763 8.705 -0.942 19542
2407 1 10 . 1 1 18 18 PHE N N 18 115.631 115.631 117.301 -1.670 19542
2408 1 10 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.091 0.022 19542
2409 1 10 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.345 0.626 19542
2410 1 10 . 1 1 18 18 PHE CB C 18 43.018 43.018 42.826 0.192 19542
2411 1 10 . 1 1 18 18 PHE H H 18 8.252 8.252 8.424 -0.172 19542
2412 1 10 . 1 1 19 19 CYS N N 19 115.508 115.508 119.942 -4.434 19542
2413 1 10 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.287 0.715 19542
2414 1 10 . 1 1 19 19 CYS CA C 19 52.258 52.258 57.947 -5.689 19542
2415 1 10 . 1 1 19 19 CYS CB C 19 38.627 38.627 27.423 11.204 19542
2416 1 10 . 1 1 19 19 CYS H H 19 9.343 9.343 9.399 -0.056 19542
2417 1 10 . 1 1 20 20 TYR N N 20 128.934 128.934 118.111 10.823 19542
2418 1 10 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.902 0.305 19542
2419 1 10 . 1 1 20 20 TYR CA C 20 55.701 55.701 54.890 0.811 19542
2420 1 10 . 1 1 20 20 TYR CB C 20 43.184 43.184 41.504 1.680 19542
2421 1 10 . 1 1 20 20 TYR H H 20 8.871 8.871 9.139 -0.268 19542
2422 1 10 . 1 1 21 21 HIS N N 21 122.079 122.079 123.138 -1.059 19542
2423 1 10 . 1 1 21 21 HIS HA H 21 5.283 5.283 5.000 0.283 19542
2424 1 10 . 1 1 21 21 HIS CA C 21 54.713 54.713 54.235 0.478 19542
2425 1 10 . 1 1 21 21 HIS CB C 21 31.719 31.719 31.880 -0.161 19542
2426 1 10 . 1 1 21 21 HIS H H 21 8.797 8.797 9.189 -0.392 19542
2427 1 10 . 1 1 22 22 ASN N N 22 128.444 128.444 128.025 0.419 19542
2428 1 10 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.766 0.080 19542
2429 1 10 . 1 1 22 22 ASN CA C 22 52.512 52.512 53.090 -0.578 19542
2430 1 10 . 1 1 22 22 ASN CB C 22 40.821 40.821 41.155 -0.334 19542
2431 1 10 . 1 1 22 22 ASN H H 22 9.823 9.823 9.139 0.684 19542
2432 1 10 . 1 1 23 23 THR N N 23 116.691 116.691 118.516 -1.825 19542
2433 1 10 . 1 1 23 23 THR HA H 23 4.604 4.604 4.648 -0.044 19542
2434 1 10 . 1 1 23 23 THR CA C 23 57.003 57.003 60.094 -3.091 19542
2435 1 10 . 1 1 23 23 THR CB C 23 69.344 69.344 70.097 -0.753 19542
2436 1 10 . 1 1 23 23 THR H H 23 8.561 8.561 8.276 0.285 19542
2437 1 10 . 1 1 24 24 GLY N N 24 110.763 110.763 108.951 1.812 19542
2438 1 10 . 1 1 24 24 GLY CA C 24 44.993 44.993 45.841 -0.848 19542
2439 1 10 . 1 1 24 24 GLY H H 24 8.608 8.608 8.468 0.140 19542
2440 1 10 . 1 1 25 25 MET N N 25 120.520 120.520 120.954 -0.434 19542
2441 1 10 . 1 1 25 25 MET HA H 25 4.818 4.818 4.752 0.066 19542
2442 1 10 . 1 1 25 25 MET CA C 25 53.892 53.892 52.828 1.064 19542
2443 1 10 . 1 1 25 25 MET CB C 25 32.399 32.399 34.914 -2.515 19542
2444 1 10 . 1 1 25 25 MET H H 25 8.418 8.418 7.928 0.490 19542
2445 1 10 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.582 -0.205 19542
2446 1 10 . 1 1 26 26 PRO CA C 26 63.841 63.841 62.709 1.132 19542
2447 1 10 . 1 1 26 26 PRO CB C 26 31.750 31.750 32.294 -0.544 19542
2448 1 10 . 1 1 27 27 PHE N N 27 118.056 118.056 121.080 -3.024 19542
2449 1 10 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.764 -0.139 19542
2450 1 10 . 1 1 27 27 PHE CA C 27 57.332 57.332 56.637 0.695 19542
2451 1 10 . 1 1 27 27 PHE CB C 27 39.701 39.701 41.920 -2.219 19542
2452 1 10 . 1 1 27 27 PHE H H 27 7.988 7.988 8.203 -0.215 19542
2453 1 10 . 1 1 28 28 ARG N N 28 121.294 121.294 124.810 -3.516 19542
2454 1 10 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.163 -0.104 19542
2455 1 10 . 1 1 28 28 ARG CA C 28 57.142 57.142 57.629 -0.487 19542
2456 1 10 . 1 1 28 28 ARG CB C 28 29.711 29.711 29.725 -0.014 19542
2457 1 10 . 1 1 28 28 ARG H H 28 8.333 8.333 9.007 -0.674 19542
2458 1 10 . 1 1 29 29 ASN N N 29 116.243 116.243 116.695 -0.452 19542
2459 1 10 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.366 0.230 19542
2460 1 10 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.200 -0.405 19542
2461 1 10 . 1 1 29 29 ASN CB C 29 38.239 38.239 37.624 0.615 19542
2462 1 10 . 1 1 29 29 ASN H H 29 8.356 8.356 8.939 -0.583 19542
2463 1 10 . 1 1 30 30 LEU N N 30 121.660 121.660 121.223 0.437 19542
2464 1 10 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.603 -0.158 19542
2465 1 10 . 1 1 30 30 LEU CA C 30 55.203 55.203 54.418 0.785 19542
2466 1 10 . 1 1 30 30 LEU CB C 30 42.982 42.982 43.197 -0.215 19542
2467 1 10 . 1 1 30 30 LEU H H 30 8.028 8.028 7.616 0.412 19542
2468 1 10 . 1 1 31 31 LYS N N 31 120.928 120.928 127.748 -6.820 19542
2469 1 10 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.372 0.006 19542
2470 1 10 . 1 1 31 31 LYS CA C 31 56.271 56.271 55.356 0.915 19542
2471 1 10 . 1 1 31 31 LYS CB C 31 32.230 32.230 31.363 0.867 19542
2472 1 10 . 1 1 31 31 LYS H H 31 8.306 8.306 8.610 -0.304 19542
2473 1 10 . 1 1 32 32 LEU N N 32 122.843 122.843 127.091 -4.248 19542
2474 1 10 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.499 -0.053 19542
2475 1 10 . 1 1 32 32 LEU CA C 32 54.484 54.484 54.910 -0.426 19542
2476 1 10 . 1 1 32 32 LEU CB C 32 43.404 43.404 42.593 0.811 19542
2477 1 10 . 1 1 32 32 LEU H H 32 8.027 8.027 8.177 -0.150 19542
2478 1 10 . 1 1 33 33 ILE N N 33 123.311 123.311 127.644 -4.333 19542
2479 1 10 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.457 -0.074 19542
2480 1 10 . 1 1 33 33 ILE CA C 33 60.595 60.595 59.446 1.149 19542
2481 1 10 . 1 1 33 33 ILE CB C 33 38.303 38.303 37.712 0.591 19542
2482 1 10 . 1 1 33 33 ILE H H 33 8.327 8.327 8.292 0.035 19542
2483 1 10 . 1 1 34 34 LEU N N 34 128.669 128.669 129.539 -0.870 19542
2484 1 10 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.744 0.050 19542
2485 1 10 . 1 1 34 34 LEU CB C 34 42.873 42.873 41.149 1.724 19542
2486 1 10 . 1 1 34 34 LEU H H 34 8.880 8.880 8.582 0.298 19542
2487 1 10 . 1 1 35 35 GLN N N 35 121.600 121.600 119.892 1.708 19542
2488 1 10 . 1 1 35 35 GLN HA H 35 4.588 4.588 5.118 -0.530 19542
2489 1 10 . 1 1 35 35 GLN CA C 35 61.390 61.390 54.935 6.455 19542
2490 1 10 . 1 1 35 35 GLN CB C 35 33.866 33.866 31.198 2.668 19542
2491 1 10 . 1 1 35 35 GLN H H 35 8.210 8.210 7.591 0.619 19542
2492 1 10 . 1 1 36 36 GLY N N 36 106.726 106.726 109.781 -3.055 19542
2493 1 10 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.386 2.492 19542
2494 1 10 . 1 1 36 36 GLY H H 36 6.121 6.121 7.608 -1.487 19542
2495 1 10 . 1 1 37 37 CYS N N 37 124.584 124.584 118.218 6.366 19542
2496 1 10 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.436 0.438 19542
2497 1 10 . 1 1 37 37 CYS CA C 37 55.955 55.955 57.624 -1.669 19542
2498 1 10 . 1 1 37 37 CYS CB C 37 48.202 48.202 29.735 18.467 19542
2499 1 10 . 1 1 37 37 CYS H H 37 8.505 8.505 8.549 -0.044 19542
2500 1 10 . 1 1 38 38 SER N N 38 115.036 115.036 117.623 -2.587 19542
2501 1 10 . 1 1 38 38 SER HA H 38 4.980 4.980 5.120 -0.140 19542
2502 1 10 . 1 1 38 38 SER CA C 38 58.792 58.792 56.319 2.473 19542
2503 1 10 . 1 1 38 38 SER CB C 38 65.971 65.971 64.855 1.116 19542
2504 1 10 . 1 1 38 38 SER H H 38 9.749 9.749 9.428 0.321 19542
2505 1 10 . 1 1 39 39 SER N N 39 117.276 117.276 120.319 -3.043 19542
2506 1 10 . 1 1 39 39 SER HA H 39 4.827 4.827 4.921 -0.094 19542
2507 1 10 . 1 1 39 39 SER CA C 39 60.040 60.040 60.305 -0.265 19542
2508 1 10 . 1 1 39 39 SER CB C 39 63.784 63.784 63.663 0.121 19542
2509 1 10 . 1 1 39 39 SER H H 39 9.161 9.161 8.788 0.373 19542
2510 1 10 . 1 1 40 40 SER N N 40 115.041 115.041 115.616 -0.575 19542
2511 1 10 . 1 1 40 40 SER HA H 40 4.660 4.660 4.800 -0.140 19542
2512 1 10 . 1 1 40 40 SER CA C 40 55.868 55.868 57.608 -1.740 19542
2513 1 10 . 1 1 40 40 SER CB C 40 64.868 64.868 65.452 -0.584 19542
2514 1 10 . 1 1 40 40 SER H H 40 7.911 7.911 7.670 0.241 19542
2515 1 10 . 1 1 41 41 CYS N N 41 124.146 124.146 120.677 3.469 19542
2516 1 10 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.490 -0.181 19542
2517 1 10 . 1 1 41 41 CYS CA C 41 57.567 57.567 57.098 0.469 19542
2518 1 10 . 1 1 41 41 CYS CB C 41 40.000 40.000 28.490 11.510 19542
2519 1 10 . 1 1 41 41 CYS H H 41 8.067 8.067 8.390 -0.323 19542
2520 1 10 . 1 1 42 42 SER N N 42 118.590 118.590 118.955 -0.365 19542
2521 1 10 . 1 1 42 42 SER HA H 42 4.611 4.611 4.509 0.102 19542
2522 1 10 . 1 1 42 42 SER CA C 42 59.020 59.020 57.214 1.806 19542
2523 1 10 . 1 1 42 42 SER CB C 42 64.112 64.112 64.279 -0.167 19542
2524 1 10 . 1 1 42 42 SER H H 42 8.491 8.491 8.452 0.039 19542
2525 1 10 . 1 1 43 43 GLU N N 43 118.830 118.830 121.321 -2.491 19542
2526 1 10 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.407 0.242 19542
2527 1 10 . 1 1 43 43 GLU CA C 43 56.856 56.856 56.438 0.418 19542
2528 1 10 . 1 1 43 43 GLU CB C 43 29.206 29.206 29.671 -0.465 19542
2529 1 10 . 1 1 43 43 GLU H H 43 8.861 8.861 8.642 0.219 19542
2530 1 10 . 1 1 44 44 THR N N 44 117.954 117.954 116.062 1.892 19542
2531 1 10 . 1 1 44 44 THR HA H 44 4.619 4.619 4.374 0.245 19542
2532 1 10 . 1 1 44 44 THR CB C 44 72.341 72.341 69.650 2.692 19542
2533 1 10 . 1 1 44 44 THR H H 44 9.030 9.030 7.377 1.653 19542
2534 1 10 . 1 1 45 45 GLU N N 45 127.100 127.100 127.709 -0.609 19542
2535 1 10 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.222 -0.128 19542
2536 1 10 . 1 1 45 45 GLU CA C 45 58.934 58.934 57.636 1.298 19542
2537 1 10 . 1 1 45 45 GLU CB C 45 27.009 27.009 29.470 -2.461 19542
2538 1 10 . 1 1 45 45 GLU H H 45 8.837 8.837 8.833 0.004 19542
2539 1 10 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.569 0.333 19542
2540 1 10 . 1 1 46 46 ASN CA C 46 53.244 53.244 54.218 -0.974 19542
2541 1 10 . 1 1 46 46 ASN CB C 46 40.053 40.053 39.592 0.461 19542
2542 1 10 . 1 1 46 46 ASN H H 46 8.018 8.018 7.872 0.146 19542
2543 1 10 . 1 1 47 47 ASN N N 47 120.765 120.765 118.326 2.439 19542
2544 1 10 . 1 1 47 47 ASN HA H 47 5.362 5.362 5.087 0.275 19542
2545 1 10 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.568 1.411 19542
2546 1 10 . 1 1 47 47 ASN CB C 47 41.749 41.749 40.287 1.462 19542
2547 1 10 . 1 1 47 47 ASN H H 47 7.835 7.835 7.366 0.469 19542
2548 1 10 . 1 1 48 48 LYS N N 48 123.576 123.576 127.288 -3.712 19542
2549 1 10 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.545 0.297 19542
2550 1 10 . 1 1 48 48 LYS CB C 48 34.398 34.398 33.567 0.831 19542
2551 1 10 . 1 1 48 48 LYS H H 48 8.548 8.548 8.850 -0.302 19542
2552 1 10 . 1 1 49 49 CYS N N 49 116.141 116.141 122.296 -6.155 19542
2553 1 10 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.693 -0.140 19542
2554 1 10 . 1 1 49 49 CYS CA C 49 53.386 53.386 57.446 -4.060 19542
2555 1 10 . 1 1 49 49 CYS CB C 49 44.935 44.935 28.006 16.929 19542
2556 1 10 . 1 1 49 49 CYS H H 49 8.873 8.873 8.687 0.186 19542
2557 1 10 . 1 1 50 50 CYS N N 50 118.484 118.484 122.324 -3.840 19542
2558 1 10 . 1 1 50 50 CYS HA H 50 5.265 5.265 4.982 0.283 19542
2559 1 10 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.074 -1.091 19542
2560 1 10 . 1 1 50 50 CYS CB C 50 46.111 46.111 30.781 15.330 19542
2561 1 10 . 1 1 50 50 CYS H H 50 9.389 9.389 9.483 -0.094 19542
2562 1 10 . 1 1 51 51 SER N N 51 115.213 115.213 117.253 -2.040 19542
2563 1 10 . 1 1 51 51 SER HA H 51 5.016 5.016 4.910 0.106 19542
2564 1 10 . 1 1 51 51 SER CA C 51 58.118 58.118 57.390 0.728 19542
2565 1 10 . 1 1 51 51 SER CB C 51 64.457 64.457 62.685 1.772 19542
2566 1 10 . 1 1 51 51 SER H H 51 9.290 9.290 8.741 0.549 19542
2567 1 10 . 1 1 52 52 THR N N 52 112.156 112.156 117.598 -5.442 19542
2568 1 10 . 1 1 52 52 THR HA H 52 4.692 4.692 4.578 0.114 19542
2569 1 10 . 1 1 52 52 THR CA C 52 59.835 59.835 61.409 -1.574 19542
2570 1 10 . 1 1 52 52 THR CB C 52 71.872 71.872 71.879 -0.007 19542
2571 1 10 . 1 1 52 52 THR H H 52 7.624 7.624 7.573 0.051 19542
2572 1 10 . 1 1 53 53 ASP N N 53 119.869 119.869 121.072 -1.203 19542
2573 1 10 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.475 0.495 19542
2574 1 10 . 1 1 53 53 ASP CA C 53 55.485 55.485 54.842 0.643 19542
2575 1 10 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.961 -0.239 19542
2576 1 10 . 1 1 53 53 ASP H H 53 8.410 8.410 8.467 -0.057 19542
2577 1 10 . 1 1 54 54 ARG N N 54 111.677 111.677 117.874 -6.197 19542
2578 1 10 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.715 -0.530 19542
2579 1 10 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.555 0.407 19542
2580 1 10 . 1 1 54 54 ARG CB C 54 28.429 28.429 27.473 0.956 19542
2581 1 10 . 1 1 54 54 ARG H H 54 9.306 9.306 8.698 0.608 19542
2582 1 10 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.442 0.119 19542
2583 1 10 . 1 1 55 55 CYS CA C 55 57.814 57.814 59.330 -1.516 19542
2584 1 10 . 1 1 55 55 CYS CB C 55 46.236 46.236 27.648 18.588 19542
2585 1 10 . 1 1 55 55 CYS H H 55 7.995 7.995 7.817 0.178 19542
2586 1 10 . 1 1 56 56 ASN N N 56 121.881 121.881 119.899 1.982 19542
2587 1 10 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.695 0.115 19542
2588 1 10 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.668 -0.302 19542
2589 1 10 . 1 1 56 56 ASN CB C 56 37.837 37.837 36.462 1.375 19542
2590 1 10 . 1 1 56 56 ASN H H 56 8.755 8.755 8.768 -0.013 19542
2591 1 11 . 1 1 2 2 LYS N N 2 126.352 126.352 121.160 5.192 19542
2592 1 11 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.369 0.021 19542
2593 1 11 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.490 -0.088 19542
2594 1 11 . 1 1 2 2 LYS CB C 2 29.734 29.734 33.069 -3.335 19542
2595 1 11 . 1 1 2 2 LYS H H 2 8.381 8.381 9.378 -0.997 19542
2596 1 11 . 1 1 3 3 CYS N N 3 117.974 117.974 120.787 -2.813 19542
2597 1 11 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.610 0.349 19542
2598 1 11 . 1 1 3 3 CYS CA C 3 51.272 51.272 57.519 -6.247 19542
2599 1 11 . 1 1 3 3 CYS CB C 3 42.039 42.039 31.565 10.474 19542
2600 1 11 . 1 1 3 3 CYS H H 3 8.394 8.394 8.670 -0.276 19542
2601 1 11 . 1 1 4 4 PHE N N 4 120.016 120.016 120.722 -0.706 19542
2602 1 11 . 1 1 4 4 PHE HA H 4 4.606 4.606 4.936 -0.330 19542
2603 1 11 . 1 1 4 4 PHE CB C 4 39.719 39.719 37.300 2.419 19542
2604 1 11 . 1 1 4 4 PHE H H 4 9.550 9.550 9.162 0.388 19542
2605 1 11 . 1 1 5 5 GLN N N 5 120.517 120.517 123.425 -2.908 19542
2606 1 11 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.217 0.205 19542
2607 1 11 . 1 1 5 5 GLN CA C 5 56.003 56.003 57.635 -1.632 19542
2608 1 11 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.696 2.898 19542
2609 1 11 . 1 1 5 5 GLN H H 5 9.406 9.406 7.866 1.540 19542
2610 1 11 . 1 1 6 6 HIS N N 6 118.478 118.478 115.963 2.515 19542
2611 1 11 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.698 -0.220 19542
2612 1 11 . 1 1 6 6 HIS CA C 6 56.627 56.627 55.826 0.801 19542
2613 1 11 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.355 -2.379 19542
2614 1 11 . 1 1 6 6 HIS H H 6 8.827 8.827 7.439 1.388 19542
2615 1 11 . 1 1 7 7 GLY N N 7 103.072 103.072 104.620 -1.548 19542
2616 1 11 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.407 0.517 19542
2617 1 11 . 1 1 7 7 GLY H H 7 8.440 8.440 8.532 -0.092 19542
2618 1 11 . 1 1 8 8 LYS N N 8 119.909 119.909 120.403 -0.494 19542
2619 1 11 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.863 -0.035 19542
2620 1 11 . 1 1 8 8 LYS CB C 8 35.493 35.493 35.179 0.314 19542
2621 1 11 . 1 1 8 8 LYS H H 8 7.703 7.703 7.863 -0.160 19542
2622 1 11 . 1 1 9 9 VAL N N 9 122.232 122.232 121.567 0.665 19542
2623 1 11 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.919 -0.107 19542
2624 1 11 . 1 1 9 9 VAL CA C 9 63.286 63.286 62.109 1.177 19542
2625 1 11 . 1 1 9 9 VAL CB C 9 26.812 26.812 30.373 -3.561 19542
2626 1 11 . 1 1 9 9 VAL H H 9 8.552 8.552 8.421 0.131 19542
2627 1 11 . 1 1 10 10 VAL N N 10 123.963 123.963 125.882 -1.919 19542
2628 1 11 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.688 -0.082 19542
2629 1 11 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.421 0.971 19542
2630 1 11 . 1 1 10 10 VAL CB C 10 34.782 34.782 34.823 -0.041 19542
2631 1 11 . 1 1 10 10 VAL H H 10 8.920 8.920 8.633 0.287 19542
2632 1 11 . 1 1 11 11 THR N N 11 118.572 118.572 120.138 -1.566 19542
2633 1 11 . 1 1 11 11 THR HA H 11 4.443 4.443 4.387 0.056 19542
2634 1 11 . 1 1 11 11 THR CA C 11 62.719 62.719 62.883 -0.164 19542
2635 1 11 . 1 1 11 11 THR CB C 11 68.689 68.689 68.689 -0.000 19542
2636 1 11 . 1 1 11 11 THR H H 11 8.517 8.517 8.119 0.398 19542
2637 1 11 . 1 1 12 12 CYS N N 12 126.835 126.835 126.421 0.414 19542
2638 1 11 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.512 0.159 19542
2639 1 11 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.256 -5.220 19542
2640 1 11 . 1 1 12 12 CYS CB C 12 38.892 38.892 27.798 11.094 19542
2641 1 11 . 1 1 12 12 CYS H H 12 8.970 8.970 8.660 0.310 19542
2642 1 11 . 1 1 13 13 HIS N N 13 121.091 121.091 122.941 -1.850 19542
2643 1 11 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.532 0.117 19542
2644 1 11 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.203 -1.705 19542
2645 1 11 . 1 1 13 13 HIS H H 13 9.015 9.015 8.579 0.436 19542
2646 1 11 . 1 1 14 14 ARG N N 14 120.872 120.872 119.514 1.358 19542
2647 1 11 . 1 1 14 14 ARG HA H 14 4.043 4.043 3.895 0.148 19542
2648 1 11 . 1 1 14 14 ARG CA C 14 58.962 58.962 58.491 0.471 19542
2649 1 11 . 1 1 14 14 ARG CB C 14 30.014 30.014 29.918 0.096 19542
2650 1 11 . 1 1 14 14 ARG H H 14 8.689 8.689 7.638 1.051 19542
2651 1 11 . 1 1 15 15 ASP N N 15 121.233 121.233 119.033 2.200 19542
2652 1 11 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.536 -0.033 19542
2653 1 11 . 1 1 15 15 ASP CA C 15 54.306 54.306 56.371 -2.065 19542
2654 1 11 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.233 -2.126 19542
2655 1 11 . 1 1 15 15 ASP H H 15 8.907 8.907 7.720 1.187 19542
2656 1 11 . 1 1 16 16 MET N N 16 119.073 119.073 118.108 0.965 19542
2657 1 11 . 1 1 16 16 MET HA H 16 4.415 4.415 4.589 -0.174 19542
2658 1 11 . 1 1 16 16 MET CA C 16 55.995 55.995 54.802 1.193 19542
2659 1 11 . 1 1 16 16 MET CB C 16 32.662 32.662 32.105 0.557 19542
2660 1 11 . 1 1 16 16 MET H H 16 7.811 7.811 7.625 0.186 19542
2661 1 11 . 1 1 17 17 LYS N N 17 120.187 120.187 122.638 -2.451 19542
2662 1 11 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.129 0.138 19542
2663 1 11 . 1 1 17 17 LYS CA C 17 55.889 55.889 56.660 -0.771 19542
2664 1 11 . 1 1 17 17 LYS CB C 17 34.106 34.106 33.472 0.634 19542
2665 1 11 . 1 1 17 17 LYS H H 17 7.763 7.763 8.592 -0.829 19542
2666 1 11 . 1 1 18 18 PHE N N 18 115.631 115.631 117.220 -1.589 19542
2667 1 11 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.165 -0.052 19542
2668 1 11 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.199 0.772 19542
2669 1 11 . 1 1 18 18 PHE CB C 18 43.018 43.018 42.700 0.318 19542
2670 1 11 . 1 1 18 18 PHE H H 18 8.252 8.252 8.106 0.146 19542
2671 1 11 . 1 1 19 19 CYS N N 19 115.508 115.508 120.408 -4.900 19542
2672 1 11 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.035 0.967 19542
2673 1 11 . 1 1 19 19 CYS CA C 19 52.258 52.258 58.389 -6.131 19542
2674 1 11 . 1 1 19 19 CYS CB C 19 38.627 38.627 27.276 11.351 19542
2675 1 11 . 1 1 19 19 CYS H H 19 9.343 9.343 9.381 -0.038 19542
2676 1 11 . 1 1 20 20 TYR N N 20 128.934 128.934 118.484 10.450 19542
2677 1 11 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.835 0.372 19542
2678 1 11 . 1 1 20 20 TYR CA C 20 55.701 55.701 55.128 0.573 19542
2679 1 11 . 1 1 20 20 TYR CB C 20 43.184 43.184 41.264 1.921 19542
2680 1 11 . 1 1 20 20 TYR H H 20 8.871 8.871 9.211 -0.340 19542
2681 1 11 . 1 1 21 21 HIS N N 21 122.079 122.079 123.918 -1.839 19542
2682 1 11 . 1 1 21 21 HIS HA H 21 5.283 5.283 4.852 0.431 19542
2683 1 11 . 1 1 21 21 HIS CA C 21 54.713 54.713 54.421 0.292 19542
2684 1 11 . 1 1 21 21 HIS CB C 21 31.719 31.719 31.277 0.442 19542
2685 1 11 . 1 1 21 21 HIS H H 21 8.797 8.797 9.288 -0.491 19542
2686 1 11 . 1 1 22 22 ASN N N 22 128.444 128.444 126.099 2.345 19542
2687 1 11 . 1 1 22 22 ASN HA H 22 5.846 5.846 4.968 0.878 19542
2688 1 11 . 1 1 22 22 ASN CA C 22 52.512 52.512 52.518 -0.006 19542
2689 1 11 . 1 1 22 22 ASN CB C 22 40.821 40.821 41.710 -0.889 19542
2690 1 11 . 1 1 22 22 ASN H H 22 9.823 9.823 8.943 0.880 19542
2691 1 11 . 1 1 23 23 THR N N 23 116.691 116.691 116.422 0.269 19542
2692 1 11 . 1 1 23 23 THR HA H 23 4.604 4.604 4.648 -0.044 19542
2693 1 11 . 1 1 23 23 THR CA C 23 57.003 57.003 60.598 -3.595 19542
2694 1 11 . 1 1 23 23 THR CB C 23 69.344 69.344 70.341 -0.997 19542
2695 1 11 . 1 1 23 23 THR H H 23 8.561 8.561 8.246 0.315 19542
2696 1 11 . 1 1 24 24 GLY N N 24 110.763 110.763 108.342 2.421 19542
2697 1 11 . 1 1 24 24 GLY CA C 24 44.993 44.993 44.843 0.150 19542
2698 1 11 . 1 1 24 24 GLY H H 24 8.608 8.608 8.276 0.332 19542
2699 1 11 . 1 1 25 25 MET N N 25 120.520 120.520 121.113 -0.593 19542
2700 1 11 . 1 1 25 25 MET HA H 25 4.818 4.818 4.505 0.313 19542
2701 1 11 . 1 1 25 25 MET CA C 25 53.892 53.892 52.662 1.230 19542
2702 1 11 . 1 1 25 25 MET CB C 25 32.399 32.399 32.986 -0.587 19542
2703 1 11 . 1 1 25 25 MET H H 25 8.418 8.418 7.941 0.477 19542
2704 1 11 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.277 0.100 19542
2705 1 11 . 1 1 26 26 PRO CA C 26 63.841 63.841 62.799 1.042 19542
2706 1 11 . 1 1 26 26 PRO CB C 26 31.750 31.750 30.957 0.793 19542
2707 1 11 . 1 1 27 27 PHE N N 27 118.056 118.056 123.375 -5.319 19542
2708 1 11 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.702 -0.077 19542
2709 1 11 . 1 1 27 27 PHE CA C 27 57.332 57.332 55.953 1.379 19542
2710 1 11 . 1 1 27 27 PHE CB C 27 39.701 39.701 41.034 -1.333 19542
2711 1 11 . 1 1 27 27 PHE H H 27 7.988 7.988 7.723 0.265 19542
2712 1 11 . 1 1 28 28 ARG N N 28 121.294 121.294 124.769 -3.475 19542
2713 1 11 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.166 -0.107 19542
2714 1 11 . 1 1 28 28 ARG CA C 28 57.142 57.142 57.918 -0.776 19542
2715 1 11 . 1 1 28 28 ARG CB C 28 29.711 29.711 30.191 -0.480 19542
2716 1 11 . 1 1 28 28 ARG H H 28 8.333 8.333 9.043 -0.710 19542
2717 1 11 . 1 1 29 29 ASN N N 29 116.243 116.243 115.376 0.867 19542
2718 1 11 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.431 0.165 19542
2719 1 11 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.547 -0.752 19542
2720 1 11 . 1 1 29 29 ASN CB C 29 38.239 38.239 37.802 0.437 19542
2721 1 11 . 1 1 29 29 ASN H H 29 8.356 8.356 8.844 -0.488 19542
2722 1 11 . 1 1 30 30 LEU N N 30 121.660 121.660 121.467 0.193 19542
2723 1 11 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.608 -0.163 19542
2724 1 11 . 1 1 30 30 LEU CA C 30 55.203 55.203 54.390 0.813 19542
2725 1 11 . 1 1 30 30 LEU CB C 30 42.982 42.982 42.432 0.550 19542
2726 1 11 . 1 1 30 30 LEU H H 30 8.028 8.028 7.698 0.330 19542
2727 1 11 . 1 1 31 31 LYS N N 31 120.928 120.928 127.073 -6.145 19542
2728 1 11 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.448 -0.070 19542
2729 1 11 . 1 1 31 31 LYS CA C 31 56.271 56.271 54.781 1.490 19542
2730 1 11 . 1 1 31 31 LYS CB C 31 32.230 32.230 30.857 1.373 19542
2731 1 11 . 1 1 31 31 LYS H H 31 8.306 8.306 8.616 -0.310 19542
2732 1 11 . 1 1 32 32 LEU N N 32 122.843 122.843 122.601 0.242 19542
2733 1 11 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.729 -0.283 19542
2734 1 11 . 1 1 32 32 LEU CA C 32 54.484 54.484 55.000 -0.516 19542
2735 1 11 . 1 1 32 32 LEU CB C 32 43.404 43.404 42.470 0.934 19542
2736 1 11 . 1 1 32 32 LEU H H 32 8.027 8.027 7.974 0.053 19542
2737 1 11 . 1 1 33 33 ILE N N 33 123.311 123.311 125.632 -2.321 19542
2738 1 11 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.560 -0.177 19542
2739 1 11 . 1 1 33 33 ILE CA C 33 60.595 60.595 59.493 1.102 19542
2740 1 11 . 1 1 33 33 ILE CB C 33 38.303 38.303 39.137 -0.834 19542
2741 1 11 . 1 1 33 33 ILE H H 33 8.327 8.327 8.514 -0.187 19542
2742 1 11 . 1 1 34 34 LEU N N 34 128.669 128.669 128.876 -0.207 19542
2743 1 11 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.805 -0.011 19542
2744 1 11 . 1 1 34 34 LEU CB C 34 42.873 42.873 41.949 0.924 19542
2745 1 11 . 1 1 34 34 LEU H H 34 8.880 8.880 9.148 -0.268 19542
2746 1 11 . 1 1 35 35 GLN N N 35 121.600 121.600 121.110 0.490 19542
2747 1 11 . 1 1 35 35 GLN HA H 35 4.588 4.588 4.996 -0.408 19542
2748 1 11 . 1 1 35 35 GLN CA C 35 61.390 61.390 55.060 6.330 19542
2749 1 11 . 1 1 35 35 GLN CB C 35 33.866 33.866 29.821 4.045 19542
2750 1 11 . 1 1 35 35 GLN H H 35 8.210 8.210 8.487 -0.277 19542
2751 1 11 . 1 1 36 36 GLY N N 36 106.726 106.726 110.211 -3.485 19542
2752 1 11 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.381 2.497 19542
2753 1 11 . 1 1 36 36 GLY H H 36 6.121 6.121 7.493 -1.372 19542
2754 1 11 . 1 1 37 37 CYS N N 37 124.584 124.584 118.495 6.089 19542
2755 1 11 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.333 0.541 19542
2756 1 11 . 1 1 37 37 CYS CA C 37 55.955 55.955 58.220 -2.265 19542
2757 1 11 . 1 1 37 37 CYS CB C 37 48.202 48.202 29.840 18.362 19542
2758 1 11 . 1 1 37 37 CYS H H 37 8.505 8.505 8.590 -0.085 19542
2759 1 11 . 1 1 38 38 SER N N 38 115.036 115.036 119.058 -4.022 19542
2760 1 11 . 1 1 38 38 SER HA H 38 4.980 4.980 4.960 0.020 19542
2761 1 11 . 1 1 38 38 SER CA C 38 58.792 58.792 56.716 2.076 19542
2762 1 11 . 1 1 38 38 SER CB C 38 65.971 65.971 65.321 0.650 19542
2763 1 11 . 1 1 38 38 SER H H 38 9.749 9.749 9.339 0.410 19542
2764 1 11 . 1 1 39 39 SER N N 39 117.276 117.276 121.294 -4.018 19542
2765 1 11 . 1 1 39 39 SER HA H 39 4.827 4.827 5.045 -0.218 19542
2766 1 11 . 1 1 39 39 SER CA C 39 60.040 60.040 59.991 0.049 19542
2767 1 11 . 1 1 39 39 SER CB C 39 63.784 63.784 64.322 -0.538 19542
2768 1 11 . 1 1 39 39 SER H H 39 9.161 9.161 8.998 0.163 19542
2769 1 11 . 1 1 40 40 SER N N 40 115.041 115.041 115.529 -0.488 19542
2770 1 11 . 1 1 40 40 SER HA H 40 4.660 4.660 4.783 -0.123 19542
2771 1 11 . 1 1 40 40 SER CA C 40 55.868 55.868 57.291 -1.423 19542
2772 1 11 . 1 1 40 40 SER CB C 40 64.868 64.868 64.942 -0.074 19542
2773 1 11 . 1 1 40 40 SER H H 40 7.911 7.911 7.652 0.259 19542
2774 1 11 . 1 1 41 41 CYS N N 41 124.146 124.146 124.391 -0.245 19542
2775 1 11 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.262 0.047 19542
2776 1 11 . 1 1 41 41 CYS CA C 41 57.567 57.567 58.294 -0.727 19542
2777 1 11 . 1 1 41 41 CYS CB C 41 40.000 40.000 28.041 11.959 19542
2778 1 11 . 1 1 41 41 CYS H H 41 8.067 8.067 8.149 -0.082 19542
2779 1 11 . 1 1 42 42 SER N N 42 118.590 118.590 120.206 -1.616 19542
2780 1 11 . 1 1 42 42 SER HA H 42 4.611 4.611 4.496 0.115 19542
2781 1 11 . 1 1 42 42 SER CA C 42 59.020 59.020 57.226 1.794 19542
2782 1 11 . 1 1 42 42 SER CB C 42 64.112 64.112 63.632 0.480 19542
2783 1 11 . 1 1 42 42 SER H H 42 8.491 8.491 8.668 -0.177 19542
2784 1 11 . 1 1 43 43 GLU N N 43 118.830 118.830 127.346 -8.516 19542
2785 1 11 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.100 0.549 19542
2786 1 11 . 1 1 43 43 GLU CA C 43 56.856 56.856 56.833 0.023 19542
2787 1 11 . 1 1 43 43 GLU CB C 43 29.206 29.206 28.469 0.737 19542
2788 1 11 . 1 1 43 43 GLU H H 43 8.861 8.861 8.735 0.126 19542
2789 1 11 . 1 1 44 44 THR N N 44 117.954 117.954 118.948 -0.994 19542
2790 1 11 . 1 1 44 44 THR HA H 44 4.619 4.619 4.482 0.137 19542
2791 1 11 . 1 1 44 44 THR CB C 44 72.341 72.341 70.458 1.883 19542
2792 1 11 . 1 1 44 44 THR H H 44 9.030 9.030 7.879 1.151 19542
2793 1 11 . 1 1 45 45 GLU N N 45 127.100 127.100 119.319 7.781 19542
2794 1 11 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.341 -0.247 19542
2795 1 11 . 1 1 45 45 GLU CA C 45 58.934 58.934 58.061 0.873 19542
2796 1 11 . 1 1 45 45 GLU CB C 45 27.009 27.009 30.011 -3.002 19542
2797 1 11 . 1 1 45 45 GLU H H 45 8.837 8.837 8.657 0.180 19542
2798 1 11 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.585 0.317 19542
2799 1 11 . 1 1 46 46 ASN CA C 46 53.244 53.244 53.362 -0.118 19542
2800 1 11 . 1 1 46 46 ASN CB C 46 40.053 40.053 38.869 1.184 19542
2801 1 11 . 1 1 46 46 ASN H H 46 8.018 8.018 8.145 -0.127 19542
2802 1 11 . 1 1 47 47 ASN N N 47 120.765 120.765 118.221 2.544 19542
2803 1 11 . 1 1 47 47 ASN HA H 47 5.362 5.362 4.750 0.612 19542
2804 1 11 . 1 1 47 47 ASN CA C 47 53.979 53.979 53.392 0.587 19542
2805 1 11 . 1 1 47 47 ASN CB C 47 41.749 41.749 38.591 3.158 19542
2806 1 11 . 1 1 47 47 ASN H H 47 7.835 7.835 7.900 -0.065 19542
2807 1 11 . 1 1 48 48 LYS N N 48 123.576 123.576 127.890 -4.314 19542
2808 1 11 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.523 0.319 19542
2809 1 11 . 1 1 48 48 LYS CB C 48 34.398 34.398 33.502 0.896 19542
2810 1 11 . 1 1 48 48 LYS H H 48 8.548 8.548 8.486 0.062 19542
2811 1 11 . 1 1 49 49 CYS N N 49 116.141 116.141 123.162 -7.021 19542
2812 1 11 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.838 -0.285 19542
2813 1 11 . 1 1 49 49 CYS CA C 49 53.386 53.386 57.648 -4.262 19542
2814 1 11 . 1 1 49 49 CYS CB C 49 44.935 44.935 28.284 16.651 19542
2815 1 11 . 1 1 49 49 CYS H H 49 8.873 8.873 8.715 0.158 19542
2816 1 11 . 1 1 50 50 CYS N N 50 118.484 118.484 122.617 -4.133 19542
2817 1 11 . 1 1 50 50 CYS HA H 50 5.265 5.265 5.260 0.005 19542
2818 1 11 . 1 1 50 50 CYS CA C 50 55.983 55.983 56.893 -0.910 19542
2819 1 11 . 1 1 50 50 CYS CB C 50 46.111 46.111 31.100 15.011 19542
2820 1 11 . 1 1 50 50 CYS H H 50 9.389 9.389 9.485 -0.096 19542
2821 1 11 . 1 1 51 51 SER N N 51 115.213 115.213 117.156 -1.943 19542
2822 1 11 . 1 1 51 51 SER HA H 51 5.016 5.016 4.875 0.141 19542
2823 1 11 . 1 1 51 51 SER CA C 51 58.118 58.118 58.134 -0.016 19542
2824 1 11 . 1 1 51 51 SER CB C 51 64.457 64.457 62.570 1.887 19542
2825 1 11 . 1 1 51 51 SER H H 51 9.290 9.290 8.602 0.688 19542
2826 1 11 . 1 1 52 52 THR N N 52 112.156 112.156 114.419 -2.263 19542
2827 1 11 . 1 1 52 52 THR HA H 52 4.692 4.692 4.540 0.152 19542
2828 1 11 . 1 1 52 52 THR CA C 52 59.835 59.835 60.398 -0.563 19542
2829 1 11 . 1 1 52 52 THR CB C 52 71.872 71.872 71.738 0.134 19542
2830 1 11 . 1 1 52 52 THR H H 52 7.624 7.624 7.339 0.285 19542
2831 1 11 . 1 1 53 53 ASP N N 53 119.869 119.869 123.496 -3.627 19542
2832 1 11 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.386 0.584 19542
2833 1 11 . 1 1 53 53 ASP CA C 53 55.485 55.485 56.172 -0.687 19542
2834 1 11 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.462 0.260 19542
2835 1 11 . 1 1 53 53 ASP H H 53 8.410 8.410 8.639 -0.229 19542
2836 1 11 . 1 1 54 54 ARG N N 54 111.677 111.677 116.332 -4.655 19542
2837 1 11 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.544 -0.359 19542
2838 1 11 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.781 0.181 19542
2839 1 11 . 1 1 54 54 ARG CB C 54 28.429 28.429 27.243 1.186 19542
2840 1 11 . 1 1 54 54 ARG H H 54 9.306 9.306 8.666 0.640 19542
2841 1 11 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.425 0.136 19542
2842 1 11 . 1 1 55 55 CYS CA C 55 57.814 57.814 59.329 -1.515 19542
2843 1 11 . 1 1 55 55 CYS CB C 55 46.236 46.236 26.686 19.550 19542
2844 1 11 . 1 1 55 55 CYS H H 55 7.995 7.995 7.910 0.085 19542
2845 1 11 . 1 1 56 56 ASN N N 56 121.881 121.881 117.965 3.916 19542
2846 1 11 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.650 0.160 19542
2847 1 11 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.632 -0.266 19542
2848 1 11 . 1 1 56 56 ASN CB C 56 37.837 37.837 37.239 0.598 19542
2849 1 11 . 1 1 56 56 ASN H H 56 8.755 8.755 8.478 0.277 19542
2850 1 12 . 1 1 2 2 LYS N N 2 126.352 126.352 121.916 4.436 19542
2851 1 12 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.495 -0.105 19542
2852 1 12 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.567 -0.165 19542
2853 1 12 . 1 1 2 2 LYS CB C 2 29.734 29.734 32.996 -3.262 19542
2854 1 12 . 1 1 2 2 LYS H H 2 8.381 8.381 8.312 0.069 19542
2855 1 12 . 1 1 3 3 CYS N N 3 117.974 117.974 120.748 -2.774 19542
2856 1 12 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.563 0.396 19542
2857 1 12 . 1 1 3 3 CYS CA C 3 51.272 51.272 58.232 -6.960 19542
2858 1 12 . 1 1 3 3 CYS CB C 3 42.039 42.039 32.323 9.716 19542
2859 1 12 . 1 1 3 3 CYS H H 3 8.394 8.394 8.840 -0.446 19542
2860 1 12 . 1 1 4 4 PHE N N 4 120.016 120.016 121.036 -1.020 19542
2861 1 12 . 1 1 4 4 PHE HA H 4 4.606 4.606 5.071 -0.465 19542
2862 1 12 . 1 1 4 4 PHE CB C 4 39.719 39.719 37.084 2.635 19542
2863 1 12 . 1 1 4 4 PHE H H 4 9.550 9.550 9.146 0.404 19542
2864 1 12 . 1 1 5 5 GLN N N 5 120.517 120.517 123.117 -2.600 19542
2865 1 12 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.593 -0.171 19542
2866 1 12 . 1 1 5 5 GLN CA C 5 56.003 56.003 57.743 -1.740 19542
2867 1 12 . 1 1 5 5 GLN CB C 5 32.594 32.594 30.007 2.587 19542
2868 1 12 . 1 1 5 5 GLN H H 5 9.406 9.406 7.940 1.466 19542
2869 1 12 . 1 1 6 6 HIS N N 6 118.478 118.478 116.818 1.660 19542
2870 1 12 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.620 -0.142 19542
2871 1 12 . 1 1 6 6 HIS CA C 6 56.627 56.627 56.125 0.502 19542
2872 1 12 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.384 -2.408 19542
2873 1 12 . 1 1 6 6 HIS H H 6 8.827 8.827 7.680 1.147 19542
2874 1 12 . 1 1 7 7 GLY N N 7 103.072 103.072 107.851 -4.779 19542
2875 1 12 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.569 0.355 19542
2876 1 12 . 1 1 7 7 GLY H H 7 8.440 8.440 8.632 -0.192 19542
2877 1 12 . 1 1 8 8 LYS N N 8 119.909 119.909 121.900 -1.991 19542
2878 1 12 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.593 0.235 19542
2879 1 12 . 1 1 8 8 LYS CB C 8 35.493 35.493 33.508 1.985 19542
2880 1 12 . 1 1 8 8 LYS H H 8 7.703 7.703 8.080 -0.377 19542
2881 1 12 . 1 1 9 9 VAL N N 9 122.232 122.232 122.291 -0.059 19542
2882 1 12 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.940 -0.128 19542
2883 1 12 . 1 1 9 9 VAL CA C 9 63.286 63.286 62.626 0.660 19542
2884 1 12 . 1 1 9 9 VAL CB C 9 26.812 26.812 29.943 -3.131 19542
2885 1 12 . 1 1 9 9 VAL H H 9 8.552 8.552 8.471 0.081 19542
2886 1 12 . 1 1 10 10 VAL N N 10 123.963 123.963 125.627 -1.664 19542
2887 1 12 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.582 0.024 19542
2888 1 12 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.368 1.024 19542
2889 1 12 . 1 1 10 10 VAL CB C 10 34.782 34.782 34.600 0.182 19542
2890 1 12 . 1 1 10 10 VAL H H 10 8.920 8.920 8.900 0.020 19542
2891 1 12 . 1 1 11 11 THR N N 11 118.572 118.572 119.246 -0.674 19542
2892 1 12 . 1 1 11 11 THR HA H 11 4.443 4.443 4.684 -0.241 19542
2893 1 12 . 1 1 11 11 THR CA C 11 62.719 62.719 62.256 0.463 19542
2894 1 12 . 1 1 11 11 THR CB C 11 68.689 68.689 68.487 0.202 19542
2895 1 12 . 1 1 11 11 THR H H 11 8.517 8.517 8.292 0.225 19542
2896 1 12 . 1 1 12 12 CYS N N 12 126.835 126.835 126.058 0.777 19542
2897 1 12 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.405 0.266 19542
2898 1 12 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.708 -5.671 19542
2899 1 12 . 1 1 12 12 CYS CB C 12 38.892 38.892 27.382 11.510 19542
2900 1 12 . 1 1 12 12 CYS H H 12 8.970 8.970 8.827 0.143 19542
2901 1 12 . 1 1 13 13 HIS N N 13 121.091 121.091 121.103 -0.012 19542
2902 1 12 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.449 0.200 19542
2903 1 12 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.052 -1.554 19542
2904 1 12 . 1 1 13 13 HIS H H 13 9.015 9.015 8.481 0.534 19542
2905 1 12 . 1 1 14 14 ARG N N 14 120.872 120.872 122.087 -1.215 19542
2906 1 12 . 1 1 14 14 ARG HA H 14 4.043 4.043 3.884 0.159 19542
2907 1 12 . 1 1 14 14 ARG CA C 14 58.962 58.962 59.012 -0.050 19542
2908 1 12 . 1 1 14 14 ARG CB C 14 30.014 30.014 29.920 0.094 19542
2909 1 12 . 1 1 14 14 ARG H H 14 8.689 8.689 8.314 0.375 19542
2910 1 12 . 1 1 15 15 ASP N N 15 121.233 121.233 116.823 4.410 19542
2911 1 12 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.588 -0.085 19542
2912 1 12 . 1 1 15 15 ASP CA C 15 54.306 54.306 55.023 -0.717 19542
2913 1 12 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.156 -2.049 19542
2914 1 12 . 1 1 15 15 ASP H H 15 8.907 8.907 7.280 1.627 19542
2915 1 12 . 1 1 16 16 MET N N 16 119.073 119.073 118.047 1.026 19542
2916 1 12 . 1 1 16 16 MET HA H 16 4.415 4.415 4.681 -0.266 19542
2917 1 12 . 1 1 16 16 MET CA C 16 55.995 55.995 54.202 1.794 19542
2918 1 12 . 1 1 16 16 MET CB C 16 32.662 32.662 31.835 0.827 19542
2919 1 12 . 1 1 16 16 MET H H 16 7.811 7.811 7.489 0.322 19542
2920 1 12 . 1 1 17 17 LYS N N 17 120.187 120.187 121.034 -0.847 19542
2921 1 12 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.113 0.154 19542
2922 1 12 . 1 1 17 17 LYS CA C 17 55.889 55.889 57.411 -1.522 19542
2923 1 12 . 1 1 17 17 LYS CB C 17 34.106 34.106 33.119 0.987 19542
2924 1 12 . 1 1 17 17 LYS H H 17 7.763 7.763 8.153 -0.390 19542
2925 1 12 . 1 1 18 18 PHE N N 18 115.631 115.631 116.708 -1.077 19542
2926 1 12 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.200 -0.087 19542
2927 1 12 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.424 0.547 19542
2928 1 12 . 1 1 18 18 PHE CB C 18 43.018 43.018 43.278 -0.260 19542
2929 1 12 . 1 1 18 18 PHE H H 18 8.252 8.252 8.114 0.138 19542
2930 1 12 . 1 1 19 19 CYS N N 19 115.508 115.508 118.955 -3.447 19542
2931 1 12 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.543 0.459 19542
2932 1 12 . 1 1 19 19 CYS CA C 19 52.258 52.258 57.750 -5.492 19542
2933 1 12 . 1 1 19 19 CYS CB C 19 38.627 38.627 29.191 9.436 19542
2934 1 12 . 1 1 19 19 CYS H H 19 9.343 9.343 9.477 -0.134 19542
2935 1 12 . 1 1 20 20 TYR N N 20 128.934 128.934 117.759 11.175 19542
2936 1 12 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.861 0.346 19542
2937 1 12 . 1 1 20 20 TYR CA C 20 55.701 55.701 54.849 0.852 19542
2938 1 12 . 1 1 20 20 TYR CB C 20 43.184 43.184 41.336 1.849 19542
2939 1 12 . 1 1 20 20 TYR H H 20 8.871 8.871 9.108 -0.237 19542
2940 1 12 . 1 1 21 21 HIS N N 21 122.079 122.079 121.489 0.590 19542
2941 1 12 . 1 1 21 21 HIS HA H 21 5.283 5.283 4.867 0.416 19542
2942 1 12 . 1 1 21 21 HIS CA C 21 54.713 54.713 55.107 -0.394 19542
2943 1 12 . 1 1 21 21 HIS CB C 21 31.719 31.719 32.113 -0.394 19542
2944 1 12 . 1 1 21 21 HIS H H 21 8.797 8.797 9.268 -0.471 19542
2945 1 12 . 1 1 22 22 ASN N N 22 128.444 128.444 128.060 0.384 19542
2946 1 12 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.553 0.293 19542
2947 1 12 . 1 1 22 22 ASN CA C 22 52.512 52.512 52.795 -0.283 19542
2948 1 12 . 1 1 22 22 ASN CB C 22 40.821 40.821 39.817 1.004 19542
2949 1 12 . 1 1 22 22 ASN H H 22 9.823 9.823 8.338 1.485 19542
2950 1 12 . 1 1 23 23 THR N N 23 116.691 116.691 119.085 -2.394 19542
2951 1 12 . 1 1 23 23 THR HA H 23 4.604 4.604 4.626 -0.022 19542
2952 1 12 . 1 1 23 23 THR CA C 23 57.003 57.003 60.869 -3.866 19542
2953 1 12 . 1 1 23 23 THR CB C 23 69.344 69.344 69.936 -0.592 19542
2954 1 12 . 1 1 23 23 THR H H 23 8.561 8.561 8.696 -0.135 19542
2955 1 12 . 1 1 24 24 GLY N N 24 110.763 110.763 110.849 -0.086 19542
2956 1 12 . 1 1 24 24 GLY CA C 24 44.993 44.993 45.312 -0.319 19542
2957 1 12 . 1 1 24 24 GLY H H 24 8.608 8.608 8.563 0.045 19542
2958 1 12 . 1 1 25 25 MET N N 25 120.520 120.520 122.544 -2.024 19542
2959 1 12 . 1 1 25 25 MET HA H 25 4.818 4.818 4.776 0.042 19542
2960 1 12 . 1 1 25 25 MET CA C 25 53.892 53.892 54.198 -0.306 19542
2961 1 12 . 1 1 25 25 MET CB C 25 32.399 32.399 31.990 0.409 19542
2962 1 12 . 1 1 25 25 MET H H 25 8.418 8.418 8.018 0.400 19542
2963 1 12 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.559 -0.182 19542
2964 1 12 . 1 1 26 26 PRO CA C 26 63.841 63.841 62.560 1.281 19542
2965 1 12 . 1 1 26 26 PRO CB C 26 31.750 31.750 32.510 -0.760 19542
2966 1 12 . 1 1 27 27 PHE N N 27 118.056 118.056 119.770 -1.714 19542
2967 1 12 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.714 -0.089 19542
2968 1 12 . 1 1 27 27 PHE CA C 27 57.332 57.332 57.028 0.304 19542
2969 1 12 . 1 1 27 27 PHE CB C 27 39.701 39.701 41.963 -2.262 19542
2970 1 12 . 1 1 27 27 PHE H H 27 7.988 7.988 8.200 -0.212 19542
2971 1 12 . 1 1 28 28 ARG N N 28 121.294 121.294 123.070 -1.776 19542
2972 1 12 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.582 -0.523 19542
2973 1 12 . 1 1 28 28 ARG CA C 28 57.142 57.142 55.900 1.242 19542
2974 1 12 . 1 1 28 28 ARG CB C 28 29.711 29.711 31.062 -1.351 19542
2975 1 12 . 1 1 28 28 ARG H H 28 8.333 8.333 8.783 -0.450 19542
2976 1 12 . 1 1 29 29 ASN N N 29 116.243 116.243 117.086 -0.843 19542
2977 1 12 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.372 0.224 19542
2978 1 12 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.206 -0.411 19542
2979 1 12 . 1 1 29 29 ASN CB C 29 38.239 38.239 37.788 0.451 19542
2980 1 12 . 1 1 29 29 ASN H H 29 8.356 8.356 8.979 -0.623 19542
2981 1 12 . 1 1 30 30 LEU N N 30 121.660 121.660 117.639 4.021 19542
2982 1 12 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.422 0.023 19542
2983 1 12 . 1 1 30 30 LEU CA C 30 55.203 55.203 54.590 0.613 19542
2984 1 12 . 1 1 30 30 LEU CB C 30 42.982 42.982 44.437 -1.455 19542
2985 1 12 . 1 1 30 30 LEU H H 30 8.028 8.028 7.337 0.691 19542
2986 1 12 . 1 1 31 31 LYS N N 31 120.928 120.928 124.224 -3.296 19542
2987 1 12 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.541 -0.163 19542
2988 1 12 . 1 1 31 31 LYS CA C 31 56.271 56.271 54.912 1.359 19542
2989 1 12 . 1 1 31 31 LYS CB C 31 32.230 32.230 32.258 -0.028 19542
2990 1 12 . 1 1 31 31 LYS H H 31 8.306 8.306 8.372 -0.066 19542
2991 1 12 . 1 1 32 32 LEU N N 32 122.843 122.843 125.935 -3.092 19542
2992 1 12 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.212 0.234 19542
2993 1 12 . 1 1 32 32 LEU CA C 32 54.484 54.484 54.236 0.248 19542
2994 1 12 . 1 1 32 32 LEU CB C 32 43.404 43.404 41.861 1.543 19542
2995 1 12 . 1 1 32 32 LEU H H 32 8.027 8.027 7.881 0.146 19542
2996 1 12 . 1 1 33 33 ILE N N 33 123.311 123.311 129.272 -5.961 19542
2997 1 12 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.301 0.082 19542
2998 1 12 . 1 1 33 33 ILE CA C 33 60.595 60.595 59.540 1.055 19542
2999 1 12 . 1 1 33 33 ILE CB C 33 38.303 38.303 39.126 -0.823 19542
3000 1 12 . 1 1 33 33 ILE H H 33 8.327 8.327 8.123 0.204 19542
3001 1 12 . 1 1 34 34 LEU N N 34 128.669 128.669 131.522 -2.853 19542
3002 1 12 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.451 0.343 19542
3003 1 12 . 1 1 34 34 LEU CB C 34 42.873 42.873 40.539 2.333 19542
3004 1 12 . 1 1 34 34 LEU H H 34 8.880 8.880 8.668 0.212 19542
3005 1 12 . 1 1 35 35 GLN N N 35 121.600 121.600 120.672 0.928 19542
3006 1 12 . 1 1 35 35 GLN HA H 35 4.588 4.588 5.126 -0.538 19542
3007 1 12 . 1 1 35 35 GLN CA C 35 61.390 61.390 53.921 7.469 19542
3008 1 12 . 1 1 35 35 GLN CB C 35 33.866 33.866 30.662 3.204 19542
3009 1 12 . 1 1 35 35 GLN H H 35 8.210 8.210 7.896 0.314 19542
3010 1 12 . 1 1 36 36 GLY N N 36 106.726 106.726 109.941 -3.215 19542
3011 1 12 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.875 2.003 19542
3012 1 12 . 1 1 36 36 GLY H H 36 6.121 6.121 7.109 -0.988 19542
3013 1 12 . 1 1 37 37 CYS N N 37 124.584 124.584 119.260 5.324 19542
3014 1 12 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.360 0.514 19542
3015 1 12 . 1 1 37 37 CYS CA C 37 55.955 55.955 57.897 -1.942 19542
3016 1 12 . 1 1 37 37 CYS CB C 37 48.202 48.202 29.633 18.569 19542
3017 1 12 . 1 1 37 37 CYS H H 37 8.505 8.505 8.604 -0.099 19542
3018 1 12 . 1 1 38 38 SER N N 38 115.036 115.036 117.908 -2.872 19542
3019 1 12 . 1 1 38 38 SER HA H 38 4.980 4.980 4.934 0.046 19542
3020 1 12 . 1 1 38 38 SER CA C 38 58.792 58.792 56.846 1.946 19542
3021 1 12 . 1 1 38 38 SER CB C 38 65.971 65.971 66.566 -0.595 19542
3022 1 12 . 1 1 38 38 SER H H 38 9.749 9.749 9.335 0.414 19542
3023 1 12 . 1 1 39 39 SER N N 39 117.276 117.276 118.953 -1.677 19542
3024 1 12 . 1 1 39 39 SER HA H 39 4.827 4.827 5.001 -0.174 19542
3025 1 12 . 1 1 39 39 SER CA C 39 60.040 60.040 58.998 1.042 19542
3026 1 12 . 1 1 39 39 SER CB C 39 63.784 63.784 63.785 -0.001 19542
3027 1 12 . 1 1 39 39 SER H H 39 9.161 9.161 9.008 0.153 19542
3028 1 12 . 1 1 40 40 SER N N 40 115.041 115.041 114.551 0.490 19542
3029 1 12 . 1 1 40 40 SER HA H 40 4.660 4.660 4.792 -0.132 19542
3030 1 12 . 1 1 40 40 SER CA C 40 55.868 55.868 56.832 -0.964 19542
3031 1 12 . 1 1 40 40 SER CB C 40 64.868 64.868 65.988 -1.120 19542
3032 1 12 . 1 1 40 40 SER H H 40 7.911 7.911 7.742 0.169 19542
3033 1 12 . 1 1 41 41 CYS N N 41 124.146 124.146 120.385 3.761 19542
3034 1 12 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.326 -0.017 19542
3035 1 12 . 1 1 41 41 CYS CA C 41 57.567 57.567 57.621 -0.054 19542
3036 1 12 . 1 1 41 41 CYS CB C 41 40.000 40.000 26.384 13.616 19542
3037 1 12 . 1 1 41 41 CYS H H 41 8.067 8.067 8.151 -0.084 19542
3038 1 12 . 1 1 42 42 SER N N 42 118.590 118.590 123.743 -5.153 19542
3039 1 12 . 1 1 42 42 SER HA H 42 4.611 4.611 4.487 0.124 19542
3040 1 12 . 1 1 42 42 SER CA C 42 59.020 59.020 57.289 1.731 19542
3041 1 12 . 1 1 42 42 SER CB C 42 64.112 64.112 63.361 0.750 19542
3042 1 12 . 1 1 42 42 SER H H 42 8.491 8.491 8.639 -0.148 19542
3043 1 12 . 1 1 43 43 GLU N N 43 118.830 118.830 127.125 -8.295 19542
3044 1 12 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.288 0.361 19542
3045 1 12 . 1 1 43 43 GLU CA C 43 56.856 56.856 56.909 -0.053 19542
3046 1 12 . 1 1 43 43 GLU CB C 43 29.206 29.206 29.289 -0.083 19542
3047 1 12 . 1 1 43 43 GLU H H 43 8.861 8.861 8.605 0.256 19542
3048 1 12 . 1 1 44 44 THR N N 44 117.954 117.954 116.902 1.052 19542
3049 1 12 . 1 1 44 44 THR HA H 44 4.619 4.619 4.707 -0.088 19542
3050 1 12 . 1 1 44 44 THR CB C 44 72.341 72.341 70.950 1.391 19542
3051 1 12 . 1 1 44 44 THR H H 44 9.030 9.030 8.274 0.756 19542
3052 1 12 . 1 1 45 45 GLU N N 45 127.100 127.100 119.829 7.271 19542
3053 1 12 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.198 -0.104 19542
3054 1 12 . 1 1 45 45 GLU CA C 45 58.934 58.934 58.386 0.547 19542
3055 1 12 . 1 1 45 45 GLU CB C 45 27.009 27.009 29.883 -2.874 19542
3056 1 12 . 1 1 45 45 GLU H H 45 8.837 8.837 8.886 -0.049 19542
3057 1 12 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.949 -0.047 19542
3058 1 12 . 1 1 46 46 ASN CA C 46 53.244 53.244 54.679 -1.435 19542
3059 1 12 . 1 1 46 46 ASN CB C 46 40.053 40.053 39.541 0.512 19542
3060 1 12 . 1 1 46 46 ASN H H 46 8.018 8.018 8.039 -0.021 19542
3061 1 12 . 1 1 47 47 ASN N N 47 120.765 120.765 118.384 2.381 19542
3062 1 12 . 1 1 47 47 ASN HA H 47 5.362 5.362 5.138 0.224 19542
3063 1 12 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.706 1.273 19542
3064 1 12 . 1 1 47 47 ASN CB C 47 41.749 41.749 39.482 2.267 19542
3065 1 12 . 1 1 47 47 ASN H H 47 7.835 7.835 8.246 -0.411 19542
3066 1 12 . 1 1 48 48 LYS N N 48 123.576 123.576 127.895 -4.319 19542
3067 1 12 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.855 -0.013 19542
3068 1 12 . 1 1 48 48 LYS CB C 48 34.398 34.398 34.133 0.265 19542
3069 1 12 . 1 1 48 48 LYS H H 48 8.548 8.548 8.792 -0.244 19542
3070 1 12 . 1 1 49 49 CYS N N 49 116.141 116.141 120.104 -3.963 19542
3071 1 12 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.901 -0.348 19542
3072 1 12 . 1 1 49 49 CYS CA C 49 53.386 53.386 55.739 -2.353 19542
3073 1 12 . 1 1 49 49 CYS CB C 49 44.935 44.935 27.442 17.493 19542
3074 1 12 . 1 1 49 49 CYS H H 49 8.873 8.873 8.767 0.106 19542
3075 1 12 . 1 1 50 50 CYS N N 50 118.484 118.484 120.905 -2.421 19542
3076 1 12 . 1 1 50 50 CYS HA H 50 5.265 5.265 4.931 0.334 19542
3077 1 12 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.524 -1.541 19542
3078 1 12 . 1 1 50 50 CYS CB C 50 46.111 46.111 31.165 14.946 19542
3079 1 12 . 1 1 50 50 CYS H H 50 9.389 9.389 9.454 -0.065 19542
3080 1 12 . 1 1 51 51 SER N N 51 115.213 115.213 116.973 -1.760 19542
3081 1 12 . 1 1 51 51 SER HA H 51 5.016 5.016 4.768 0.248 19542
3082 1 12 . 1 1 51 51 SER CA C 51 58.118 58.118 58.426 -0.308 19542
3083 1 12 . 1 1 51 51 SER CB C 51 64.457 64.457 63.296 1.161 19542
3084 1 12 . 1 1 51 51 SER H H 51 9.290 9.290 8.748 0.542 19542
3085 1 12 . 1 1 52 52 THR N N 52 112.156 112.156 114.476 -2.320 19542
3086 1 12 . 1 1 52 52 THR HA H 52 4.692 4.692 4.574 0.118 19542
3087 1 12 . 1 1 52 52 THR CA C 52 59.835 59.835 60.765 -0.930 19542
3088 1 12 . 1 1 52 52 THR CB C 52 71.872 71.872 70.953 0.919 19542
3089 1 12 . 1 1 52 52 THR H H 52 7.624 7.624 7.330 0.294 19542
3090 1 12 . 1 1 53 53 ASP N N 53 119.869 119.869 122.637 -2.768 19542
3091 1 12 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.368 0.602 19542
3092 1 12 . 1 1 53 53 ASP CA C 53 55.485 55.485 55.467 0.018 19542
3093 1 12 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.597 0.125 19542
3094 1 12 . 1 1 53 53 ASP H H 53 8.410 8.410 8.669 -0.259 19542
3095 1 12 . 1 1 54 54 ARG N N 54 111.677 111.677 120.612 -8.935 19542
3096 1 12 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.545 -0.360 19542
3097 1 12 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.049 0.913 19542
3098 1 12 . 1 1 54 54 ARG CB C 54 28.429 28.429 26.877 1.552 19542
3099 1 12 . 1 1 54 54 ARG H H 54 9.306 9.306 8.749 0.557 19542
3100 1 12 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.384 0.177 19542
3101 1 12 . 1 1 55 55 CYS CA C 55 57.814 57.814 59.365 -1.551 19542
3102 1 12 . 1 1 55 55 CYS CB C 55 46.236 46.236 27.811 18.424 19542
3103 1 12 . 1 1 55 55 CYS H H 55 7.995 7.995 8.052 -0.057 19542
3104 1 12 . 1 1 56 56 ASN N N 56 121.881 121.881 120.382 1.499 19542
3105 1 12 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.544 0.266 19542
3106 1 12 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.584 -0.218 19542
3107 1 12 . 1 1 56 56 ASN CB C 56 37.837 37.837 36.478 1.359 19542
3108 1 12 . 1 1 56 56 ASN H H 56 8.755 8.755 8.596 0.159 19542
3109 1 13 . 1 1 2 2 LYS N N 2 126.352 126.352 121.198 5.154 19542
3110 1 13 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.238 0.152 19542
3111 1 13 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.469 -0.067 19542
3112 1 13 . 1 1 2 2 LYS CB C 2 29.734 29.734 33.440 -3.706 19542
3113 1 13 . 1 1 2 2 LYS H H 2 8.381 8.381 9.192 -0.811 19542
3114 1 13 . 1 1 3 3 CYS N N 3 117.974 117.974 120.669 -2.695 19542
3115 1 13 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.437 0.522 19542
3116 1 13 . 1 1 3 3 CYS CA C 3 51.272 51.272 58.263 -6.991 19542
3117 1 13 . 1 1 3 3 CYS CB C 3 42.039 42.039 32.183 9.856 19542
3118 1 13 . 1 1 3 3 CYS H H 3 8.394 8.394 8.519 -0.125 19542
3119 1 13 . 1 1 4 4 PHE N N 4 120.016 120.016 121.080 -1.064 19542
3120 1 13 . 1 1 4 4 PHE HA H 4 4.606 4.606 4.873 -0.267 19542
3121 1 13 . 1 1 4 4 PHE CB C 4 39.719 39.719 37.111 2.608 19542
3122 1 13 . 1 1 4 4 PHE H H 4 9.550 9.550 9.071 0.479 19542
3123 1 13 . 1 1 5 5 GLN N N 5 120.517 120.517 122.910 -2.393 19542
3124 1 13 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.432 -0.010 19542
3125 1 13 . 1 1 5 5 GLN CA C 5 56.003 56.003 57.464 -1.461 19542
3126 1 13 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.835 2.759 19542
3127 1 13 . 1 1 5 5 GLN H H 5 9.406 9.406 7.795 1.611 19542
3128 1 13 . 1 1 6 6 HIS N N 6 118.478 118.478 116.722 1.756 19542
3129 1 13 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.712 -0.234 19542
3130 1 13 . 1 1 6 6 HIS CA C 6 56.627 56.627 55.636 0.991 19542
3131 1 13 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.482 -2.506 19542
3132 1 13 . 1 1 6 6 HIS H H 6 8.827 8.827 7.418 1.409 19542
3133 1 13 . 1 1 7 7 GLY N N 7 103.072 103.072 106.048 -2.976 19542
3134 1 13 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.923 0.001 19542
3135 1 13 . 1 1 7 7 GLY H H 7 8.440 8.440 8.616 -0.176 19542
3136 1 13 . 1 1 8 8 LYS N N 8 119.909 119.909 120.850 -0.941 19542
3137 1 13 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.852 -0.024 19542
3138 1 13 . 1 1 8 8 LYS CB C 8 35.493 35.493 35.129 0.364 19542
3139 1 13 . 1 1 8 8 LYS H H 8 7.703 7.703 7.783 -0.080 19542
3140 1 13 . 1 1 9 9 VAL N N 9 122.232 122.232 121.847 0.385 19542
3141 1 13 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.880 -0.068 19542
3142 1 13 . 1 1 9 9 VAL CA C 9 63.286 63.286 62.963 0.323 19542
3143 1 13 . 1 1 9 9 VAL CB C 9 26.812 26.812 31.053 -4.242 19542
3144 1 13 . 1 1 9 9 VAL H H 9 8.552 8.552 8.470 0.082 19542
3145 1 13 . 1 1 10 10 VAL N N 10 123.963 123.963 124.887 -0.924 19542
3146 1 13 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.631 -0.025 19542
3147 1 13 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.316 1.076 19542
3148 1 13 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.154 -0.371 19542
3149 1 13 . 1 1 10 10 VAL H H 10 8.920 8.920 8.620 0.300 19542
3150 1 13 . 1 1 11 11 THR N N 11 118.572 118.572 119.523 -0.951 19542
3151 1 13 . 1 1 11 11 THR HA H 11 4.443 4.443 4.354 0.089 19542
3152 1 13 . 1 1 11 11 THR CA C 11 62.719 62.719 62.276 0.444 19542
3153 1 13 . 1 1 11 11 THR CB C 11 68.689 68.689 68.528 0.161 19542
3154 1 13 . 1 1 11 11 THR H H 11 8.517 8.517 8.144 0.373 19542
3155 1 13 . 1 1 12 12 CYS N N 12 126.835 126.835 125.700 1.135 19542
3156 1 13 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.451 0.220 19542
3157 1 13 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.981 -5.945 19542
3158 1 13 . 1 1 12 12 CYS CB C 12 38.892 38.892 27.399 11.493 19542
3159 1 13 . 1 1 12 12 CYS H H 12 8.970 8.970 8.220 0.750 19542
3160 1 13 . 1 1 13 13 HIS N N 13 121.091 121.091 122.632 -1.541 19542
3161 1 13 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.451 0.198 19542
3162 1 13 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.361 -1.863 19542
3163 1 13 . 1 1 13 13 HIS H H 13 9.015 9.015 8.457 0.558 19542
3164 1 13 . 1 1 14 14 ARG N N 14 120.872 120.872 120.907 -0.035 19542
3165 1 13 . 1 1 14 14 ARG HA H 14 4.043 4.043 3.896 0.147 19542
3166 1 13 . 1 1 14 14 ARG CA C 14 58.962 58.962 59.076 -0.114 19542
3167 1 13 . 1 1 14 14 ARG CB C 14 30.014 30.014 30.000 0.014 19542
3168 1 13 . 1 1 14 14 ARG H H 14 8.689 8.689 8.100 0.589 19542
3169 1 13 . 1 1 15 15 ASP N N 15 121.233 121.233 118.446 2.787 19542
3170 1 13 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.607 -0.104 19542
3171 1 13 . 1 1 15 15 ASP CA C 15 54.306 54.306 56.301 -1.995 19542
3172 1 13 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.093 -1.986 19542
3173 1 13 . 1 1 15 15 ASP H H 15 8.907 8.907 7.894 1.013 19542
3174 1 13 . 1 1 16 16 MET N N 16 119.073 119.073 118.410 0.663 19542
3175 1 13 . 1 1 16 16 MET HA H 16 4.415 4.415 4.718 -0.303 19542
3176 1 13 . 1 1 16 16 MET CA C 16 55.995 55.995 54.533 1.462 19542
3177 1 13 . 1 1 16 16 MET CB C 16 32.662 32.662 31.597 1.065 19542
3178 1 13 . 1 1 16 16 MET H H 16 7.811 7.811 7.787 0.024 19542
3179 1 13 . 1 1 17 17 LYS N N 17 120.187 120.187 122.072 -1.885 19542
3180 1 13 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.181 0.086 19542
3181 1 13 . 1 1 17 17 LYS CA C 17 55.889 55.889 56.737 -0.848 19542
3182 1 13 . 1 1 17 17 LYS CB C 17 34.106 34.106 33.373 0.733 19542
3183 1 13 . 1 1 17 17 LYS H H 17 7.763 7.763 8.258 -0.495 19542
3184 1 13 . 1 1 18 18 PHE N N 18 115.631 115.631 118.198 -2.567 19542
3185 1 13 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.203 -0.090 19542
3186 1 13 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.147 0.824 19542
3187 1 13 . 1 1 18 18 PHE CB C 18 43.018 43.018 41.602 1.416 19542
3188 1 13 . 1 1 18 18 PHE H H 18 8.252 8.252 8.046 0.206 19542
3189 1 13 . 1 1 19 19 CYS N N 19 115.508 115.508 123.433 -7.925 19542
3190 1 13 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.089 0.913 19542
3191 1 13 . 1 1 19 19 CYS CA C 19 52.258 52.258 58.483 -6.225 19542
3192 1 13 . 1 1 19 19 CYS CB C 19 38.627 38.627 26.543 12.084 19542
3193 1 13 . 1 1 19 19 CYS H H 19 9.343 9.343 9.183 0.160 19542
3194 1 13 . 1 1 20 20 TYR N N 20 128.934 128.934 120.559 8.375 19542
3195 1 13 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.720 0.487 19542
3196 1 13 . 1 1 20 20 TYR CA C 20 55.701 55.701 54.697 1.004 19542
3197 1 13 . 1 1 20 20 TYR CB C 20 43.184 43.184 41.134 2.050 19542
3198 1 13 . 1 1 20 20 TYR H H 20 8.871 8.871 8.951 -0.080 19542
3199 1 13 . 1 1 21 21 HIS N N 21 122.079 122.079 122.639 -0.560 19542
3200 1 13 . 1 1 21 21 HIS HA H 21 5.283 5.283 5.042 0.241 19542
3201 1 13 . 1 1 21 21 HIS CA C 21 54.713 54.713 54.390 0.323 19542
3202 1 13 . 1 1 21 21 HIS CB C 21 31.719 31.719 31.852 -0.133 19542
3203 1 13 . 1 1 21 21 HIS H H 21 8.797 8.797 9.169 -0.372 19542
3204 1 13 . 1 1 22 22 ASN N N 22 128.444 128.444 128.445 -0.001 19542
3205 1 13 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.128 0.718 19542
3206 1 13 . 1 1 22 22 ASN CA C 22 52.512 52.512 52.269 0.243 19542
3207 1 13 . 1 1 22 22 ASN CB C 22 40.821 40.821 39.524 1.297 19542
3208 1 13 . 1 1 22 22 ASN H H 22 9.823 9.823 9.385 0.438 19542
3209 1 13 . 1 1 23 23 THR N N 23 116.691 116.691 121.981 -5.290 19542
3210 1 13 . 1 1 23 23 THR HA H 23 4.604 4.604 4.660 -0.056 19542
3211 1 13 . 1 1 23 23 THR CA C 23 57.003 57.003 62.713 -5.710 19542
3212 1 13 . 1 1 23 23 THR CB C 23 69.344 69.344 69.176 0.168 19542
3213 1 13 . 1 1 23 23 THR H H 23 8.561 8.561 8.046 0.515 19542
3214 1 13 . 1 1 24 24 GLY N N 24 110.763 110.763 109.117 1.646 19542
3215 1 13 . 1 1 24 24 GLY CA C 24 44.993 44.993 45.049 -0.056 19542
3216 1 13 . 1 1 24 24 GLY H H 24 8.608 8.608 8.225 0.383 19542
3217 1 13 . 1 1 25 25 MET N N 25 120.520 120.520 121.714 -1.194 19542
3218 1 13 . 1 1 25 25 MET HA H 25 4.818 4.818 4.689 0.129 19542
3219 1 13 . 1 1 25 25 MET CA C 25 53.892 53.892 53.666 0.226 19542
3220 1 13 . 1 1 25 25 MET CB C 25 32.399 32.399 32.592 -0.193 19542
3221 1 13 . 1 1 25 25 MET H H 25 8.418 8.418 8.298 0.120 19542
3222 1 13 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.477 -0.100 19542
3223 1 13 . 1 1 26 26 PRO CA C 26 63.841 63.841 63.040 0.801 19542
3224 1 13 . 1 1 26 26 PRO CB C 26 31.750 31.750 31.317 0.433 19542
3225 1 13 . 1 1 27 27 PHE N N 27 118.056 118.056 123.817 -5.761 19542
3226 1 13 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.651 -0.026 19542
3227 1 13 . 1 1 27 27 PHE CA C 27 57.332 57.332 56.941 0.391 19542
3228 1 13 . 1 1 27 27 PHE CB C 27 39.701 39.701 41.638 -1.937 19542
3229 1 13 . 1 1 27 27 PHE H H 27 7.988 7.988 8.162 -0.174 19542
3230 1 13 . 1 1 28 28 ARG N N 28 121.294 121.294 122.939 -1.645 19542
3231 1 13 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.444 -0.385 19542
3232 1 13 . 1 1 28 28 ARG CA C 28 57.142 57.142 56.340 0.802 19542
3233 1 13 . 1 1 28 28 ARG CB C 28 29.711 29.711 30.579 -0.868 19542
3234 1 13 . 1 1 28 28 ARG H H 28 8.333 8.333 8.736 -0.403 19542
3235 1 13 . 1 1 29 29 ASN N N 29 116.243 116.243 118.465 -2.222 19542
3236 1 13 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.355 0.241 19542
3237 1 13 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.280 -0.485 19542
3238 1 13 . 1 1 29 29 ASN CB C 29 38.239 38.239 38.583 -0.344 19542
3239 1 13 . 1 1 29 29 ASN H H 29 8.356 8.356 9.029 -0.673 19542
3240 1 13 . 1 1 30 30 LEU N N 30 121.660 121.660 120.238 1.422 19542
3241 1 13 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.529 -0.084 19542
3242 1 13 . 1 1 30 30 LEU CA C 30 55.203 55.203 54.212 0.991 19542
3243 1 13 . 1 1 30 30 LEU CB C 30 42.982 42.982 43.414 -0.432 19542
3244 1 13 . 1 1 30 30 LEU H H 30 8.028 8.028 7.381 0.647 19542
3245 1 13 . 1 1 31 31 LYS N N 31 120.928 120.928 126.271 -5.343 19542
3246 1 13 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.512 -0.134 19542
3247 1 13 . 1 1 31 31 LYS CA C 31 56.271 56.271 54.472 1.799 19542
3248 1 13 . 1 1 31 31 LYS CB C 31 32.230 32.230 31.989 0.241 19542
3249 1 13 . 1 1 31 31 LYS H H 31 8.306 8.306 8.581 -0.275 19542
3250 1 13 . 1 1 32 32 LEU N N 32 122.843 122.843 127.510 -4.667 19542
3251 1 13 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.397 0.049 19542
3252 1 13 . 1 1 32 32 LEU CA C 32 54.484 54.484 54.853 -0.369 19542
3253 1 13 . 1 1 32 32 LEU CB C 32 43.404 43.404 42.608 0.796 19542
3254 1 13 . 1 1 32 32 LEU H H 32 8.027 8.027 8.636 -0.609 19542
3255 1 13 . 1 1 33 33 ILE N N 33 123.311 123.311 126.479 -3.168 19542
3256 1 13 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.543 -0.160 19542
3257 1 13 . 1 1 33 33 ILE CA C 33 60.595 60.595 59.571 1.024 19542
3258 1 13 . 1 1 33 33 ILE CB C 33 38.303 38.303 37.156 1.147 19542
3259 1 13 . 1 1 33 33 ILE H H 33 8.327 8.327 8.421 -0.094 19542
3260 1 13 . 1 1 34 34 LEU N N 34 128.669 128.669 129.493 -0.824 19542
3261 1 13 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.806 -0.012 19542
3262 1 13 . 1 1 34 34 LEU CB C 34 42.873 42.873 41.474 1.399 19542
3263 1 13 . 1 1 34 34 LEU H H 34 8.880 8.880 8.360 0.520 19542
3264 1 13 . 1 1 35 35 GLN N N 35 121.600 121.600 121.114 0.486 19542
3265 1 13 . 1 1 35 35 GLN HA H 35 4.588 4.588 5.130 -0.542 19542
3266 1 13 . 1 1 35 35 GLN CA C 35 61.390 61.390 55.082 6.308 19542
3267 1 13 . 1 1 35 35 GLN CB C 35 33.866 33.866 30.437 3.429 19542
3268 1 13 . 1 1 35 35 GLN H H 35 8.210 8.210 7.960 0.251 19542
3269 1 13 . 1 1 36 36 GLY N N 36 106.726 106.726 109.924 -3.198 19542
3270 1 13 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.684 2.194 19542
3271 1 13 . 1 1 36 36 GLY H H 36 6.121 6.121 7.388 -1.267 19542
3272 1 13 . 1 1 37 37 CYS N N 37 124.584 124.584 119.225 5.359 19542
3273 1 13 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.329 0.545 19542
3274 1 13 . 1 1 37 37 CYS CA C 37 55.955 55.955 58.017 -2.062 19542
3275 1 13 . 1 1 37 37 CYS CB C 37 48.202 48.202 30.302 17.900 19542
3276 1 13 . 1 1 37 37 CYS H H 37 8.505 8.505 8.553 -0.048 19542
3277 1 13 . 1 1 38 38 SER N N 38 115.036 115.036 118.898 -3.862 19542
3278 1 13 . 1 1 38 38 SER HA H 38 4.980 4.980 5.054 -0.074 19542
3279 1 13 . 1 1 38 38 SER CA C 38 58.792 58.792 56.624 2.168 19542
3280 1 13 . 1 1 38 38 SER CB C 38 65.971 65.971 65.748 0.223 19542
3281 1 13 . 1 1 38 38 SER H H 38 9.749 9.749 9.394 0.355 19542
3282 1 13 . 1 1 39 39 SER N N 39 117.276 117.276 120.703 -3.427 19542
3283 1 13 . 1 1 39 39 SER HA H 39 4.827 4.827 4.767 0.060 19542
3284 1 13 . 1 1 39 39 SER CA C 39 60.040 60.040 61.406 -1.365 19542
3285 1 13 . 1 1 39 39 SER CB C 39 63.784 63.784 63.649 0.135 19542
3286 1 13 . 1 1 39 39 SER H H 39 9.161 9.161 8.856 0.305 19542
3287 1 13 . 1 1 40 40 SER N N 40 115.041 115.041 115.021 0.020 19542
3288 1 13 . 1 1 40 40 SER HA H 40 4.660 4.660 4.738 -0.078 19542
3289 1 13 . 1 1 40 40 SER CA C 40 55.868 55.868 56.884 -1.016 19542
3290 1 13 . 1 1 40 40 SER CB C 40 64.868 64.868 65.631 -0.763 19542
3291 1 13 . 1 1 40 40 SER H H 40 7.911 7.911 7.958 -0.047 19542
3292 1 13 . 1 1 41 41 CYS N N 41 124.146 124.146 121.548 2.598 19542
3293 1 13 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.310 -0.001 19542
3294 1 13 . 1 1 41 41 CYS CA C 41 57.567 57.567 58.774 -1.207 19542
3295 1 13 . 1 1 41 41 CYS CB C 41 40.000 40.000 27.139 12.861 19542
3296 1 13 . 1 1 41 41 CYS H H 41 8.067 8.067 8.023 0.044 19542
3297 1 13 . 1 1 42 42 SER N N 42 118.590 118.590 120.171 -1.581 19542
3298 1 13 . 1 1 42 42 SER HA H 42 4.611 4.611 4.391 0.220 19542
3299 1 13 . 1 1 42 42 SER CA C 42 59.020 59.020 57.644 1.376 19542
3300 1 13 . 1 1 42 42 SER CB C 42 64.112 64.112 63.811 0.301 19542
3301 1 13 . 1 1 42 42 SER H H 42 8.491 8.491 8.620 -0.129 19542
3302 1 13 . 1 1 43 43 GLU N N 43 118.830 118.830 128.431 -9.601 19542
3303 1 13 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.347 0.302 19542
3304 1 13 . 1 1 43 43 GLU CA C 43 56.856 56.856 56.406 0.450 19542
3305 1 13 . 1 1 43 43 GLU CB C 43 29.206 29.206 29.706 -0.500 19542
3306 1 13 . 1 1 43 43 GLU H H 43 8.861 8.861 8.738 0.123 19542
3307 1 13 . 1 1 44 44 THR N N 44 117.954 117.954 117.452 0.502 19542
3308 1 13 . 1 1 44 44 THR HA H 44 4.619 4.619 4.370 0.249 19542
3309 1 13 . 1 1 44 44 THR CB C 44 72.341 72.341 70.163 2.178 19542
3310 1 13 . 1 1 44 44 THR H H 44 9.030 9.030 7.850 1.180 19542
3311 1 13 . 1 1 45 45 GLU N N 45 127.100 127.100 125.196 1.904 19542
3312 1 13 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.149 -0.055 19542
3313 1 13 . 1 1 45 45 GLU CA C 45 58.934 58.934 58.587 0.347 19542
3314 1 13 . 1 1 45 45 GLU CB C 45 27.009 27.009 29.568 -2.559 19542
3315 1 13 . 1 1 45 45 GLU H H 45 8.837 8.837 8.855 -0.018 19542
3316 1 13 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.465 0.437 19542
3317 1 13 . 1 1 46 46 ASN CA C 46 53.244 53.244 54.958 -1.714 19542
3318 1 13 . 1 1 46 46 ASN CB C 46 40.053 40.053 39.358 0.695 19542
3319 1 13 . 1 1 46 46 ASN H H 46 8.018 8.018 7.684 0.334 19542
3320 1 13 . 1 1 47 47 ASN N N 47 120.765 120.765 117.719 3.046 19542
3321 1 13 . 1 1 47 47 ASN HA H 47 5.362 5.362 5.416 -0.054 19542
3322 1 13 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.381 1.598 19542
3323 1 13 . 1 1 47 47 ASN CB C 47 41.749 41.749 40.613 1.136 19542
3324 1 13 . 1 1 47 47 ASN H H 47 7.835 7.835 7.427 0.408 19542
3325 1 13 . 1 1 48 48 LYS N N 48 123.576 123.576 126.570 -2.994 19542
3326 1 13 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.650 0.192 19542
3327 1 13 . 1 1 48 48 LYS CB C 48 34.398 34.398 34.883 -0.485 19542
3328 1 13 . 1 1 48 48 LYS H H 48 8.548 8.548 8.827 -0.279 19542
3329 1 13 . 1 1 49 49 CYS N N 49 116.141 116.141 118.979 -2.838 19542
3330 1 13 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.717 -0.164 19542
3331 1 13 . 1 1 49 49 CYS CA C 49 53.386 53.386 57.744 -4.358 19542
3332 1 13 . 1 1 49 49 CYS CB C 49 44.935 44.935 29.285 15.650 19542
3333 1 13 . 1 1 49 49 CYS H H 49 8.873 8.873 8.491 0.382 19542
3334 1 13 . 1 1 50 50 CYS N N 50 118.484 118.484 121.801 -3.317 19542
3335 1 13 . 1 1 50 50 CYS HA H 50 5.265 5.265 5.009 0.256 19542
3336 1 13 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.416 -1.433 19542
3337 1 13 . 1 1 50 50 CYS CB C 50 46.111 46.111 30.838 15.273 19542
3338 1 13 . 1 1 50 50 CYS H H 50 9.389 9.389 9.399 -0.010 19542
3339 1 13 . 1 1 51 51 SER N N 51 115.213 115.213 115.592 -0.379 19542
3340 1 13 . 1 1 51 51 SER HA H 51 5.016 5.016 4.875 0.141 19542
3341 1 13 . 1 1 51 51 SER CA C 51 58.118 58.118 57.649 0.469 19542
3342 1 13 . 1 1 51 51 SER CB C 51 64.457 64.457 63.635 0.822 19542
3343 1 13 . 1 1 51 51 SER H H 51 9.290 9.290 8.524 0.766 19542
3344 1 13 . 1 1 52 52 THR N N 52 112.156 112.156 118.844 -6.688 19542
3345 1 13 . 1 1 52 52 THR HA H 52 4.692 4.692 4.499 0.193 19542
3346 1 13 . 1 1 52 52 THR CA C 52 59.835 59.835 61.816 -1.981 19542
3347 1 13 . 1 1 52 52 THR CB C 52 71.872 71.872 71.946 -0.074 19542
3348 1 13 . 1 1 52 52 THR H H 52 7.624 7.624 7.346 0.278 19542
3349 1 13 . 1 1 53 53 ASP N N 53 119.869 119.869 123.344 -3.475 19542
3350 1 13 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.448 0.522 19542
3351 1 13 . 1 1 53 53 ASP CA C 53 55.485 55.485 55.999 -0.514 19542
3352 1 13 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.795 -0.073 19542
3353 1 13 . 1 1 53 53 ASP H H 53 8.410 8.410 8.642 -0.232 19542
3354 1 13 . 1 1 54 54 ARG N N 54 111.677 111.677 118.615 -6.938 19542
3355 1 13 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.444 -0.259 19542
3356 1 13 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.198 0.764 19542
3357 1 13 . 1 1 54 54 ARG CB C 54 28.429 28.429 26.898 1.531 19542
3358 1 13 . 1 1 54 54 ARG H H 54 9.306 9.306 8.526 0.780 19542
3359 1 13 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.463 0.098 19542
3360 1 13 . 1 1 55 55 CYS CA C 55 57.814 57.814 58.840 -1.026 19542
3361 1 13 . 1 1 55 55 CYS CB C 55 46.236 46.236 27.670 18.566 19542
3362 1 13 . 1 1 55 55 CYS H H 55 7.995 7.995 7.769 0.226 19542
3363 1 13 . 1 1 56 56 ASN N N 56 121.881 121.881 120.396 1.485 19542
3364 1 13 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.667 0.143 19542
3365 1 13 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.494 -0.128 19542
3366 1 13 . 1 1 56 56 ASN CB C 56 37.837 37.837 36.446 1.391 19542
3367 1 13 . 1 1 56 56 ASN H H 56 8.755 8.755 8.584 0.171 19542
3368 1 14 . 1 1 2 2 LYS N N 2 126.352 126.352 122.103 4.249 19542
3369 1 14 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.321 0.069 19542
3370 1 14 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.506 -0.104 19542
3371 1 14 . 1 1 2 2 LYS CB C 2 29.734 29.734 33.003 -3.269 19542
3372 1 14 . 1 1 2 2 LYS H H 2 8.381 8.381 8.110 0.271 19542
3373 1 14 . 1 1 3 3 CYS N N 3 117.974 117.974 120.560 -2.586 19542
3374 1 14 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.517 0.442 19542
3375 1 14 . 1 1 3 3 CYS CA C 3 51.272 51.272 58.424 -7.152 19542
3376 1 14 . 1 1 3 3 CYS CB C 3 42.039 42.039 32.418 9.621 19542
3377 1 14 . 1 1 3 3 CYS H H 3 8.394 8.394 8.665 -0.271 19542
3378 1 14 . 1 1 4 4 PHE N N 4 120.016 120.016 121.468 -1.452 19542
3379 1 14 . 1 1 4 4 PHE HA H 4 4.606 4.606 5.017 -0.411 19542
3380 1 14 . 1 1 4 4 PHE CB C 4 39.719 39.719 37.408 2.311 19542
3381 1 14 . 1 1 4 4 PHE H H 4 9.550 9.550 9.345 0.205 19542
3382 1 14 . 1 1 5 5 GLN N N 5 120.517 120.517 123.503 -2.986 19542
3383 1 14 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.261 0.161 19542
3384 1 14 . 1 1 5 5 GLN CA C 5 56.003 56.003 57.600 -1.597 19542
3385 1 14 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.705 2.889 19542
3386 1 14 . 1 1 5 5 GLN H H 5 9.406 9.406 7.970 1.436 19542
3387 1 14 . 1 1 6 6 HIS N N 6 118.478 118.478 118.833 -0.355 19542
3388 1 14 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.556 -0.078 19542
3389 1 14 . 1 1 6 6 HIS CA C 6 56.627 56.627 55.604 1.023 19542
3390 1 14 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.222 -2.246 19542
3391 1 14 . 1 1 6 6 HIS H H 6 8.827 8.827 7.653 1.174 19542
3392 1 14 . 1 1 7 7 GLY N N 7 103.072 103.072 107.117 -4.045 19542
3393 1 14 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.694 0.230 19542
3394 1 14 . 1 1 7 7 GLY H H 7 8.440 8.440 8.578 -0.138 19542
3395 1 14 . 1 1 8 8 LYS N N 8 119.909 119.909 121.059 -1.150 19542
3396 1 14 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.873 -0.045 19542
3397 1 14 . 1 1 8 8 LYS CB C 8 35.493 35.493 34.283 1.210 19542
3398 1 14 . 1 1 8 8 LYS H H 8 7.703 7.703 7.764 -0.061 19542
3399 1 14 . 1 1 9 9 VAL N N 9 122.232 122.232 121.779 0.453 19542
3400 1 14 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.720 0.092 19542
3401 1 14 . 1 1 9 9 VAL CA C 9 63.286 63.286 62.961 0.325 19542
3402 1 14 . 1 1 9 9 VAL CB C 9 26.812 26.812 30.418 -3.606 19542
3403 1 14 . 1 1 9 9 VAL H H 9 8.552 8.552 8.349 0.203 19542
3404 1 14 . 1 1 10 10 VAL N N 10 123.963 123.963 124.964 -1.001 19542
3405 1 14 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.715 -0.109 19542
3406 1 14 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.125 1.267 19542
3407 1 14 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.077 -0.295 19542
3408 1 14 . 1 1 10 10 VAL H H 10 8.920 8.920 8.505 0.415 19542
3409 1 14 . 1 1 11 11 THR N N 11 118.572 118.572 119.553 -0.981 19542
3410 1 14 . 1 1 11 11 THR HA H 11 4.443 4.443 4.589 -0.146 19542
3411 1 14 . 1 1 11 11 THR CA C 11 62.719 62.719 62.564 0.155 19542
3412 1 14 . 1 1 11 11 THR CB C 11 68.689 68.689 68.333 0.356 19542
3413 1 14 . 1 1 11 11 THR H H 11 8.517 8.517 8.240 0.277 19542
3414 1 14 . 1 1 12 12 CYS N N 12 126.835 126.835 126.090 0.745 19542
3415 1 14 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.518 0.153 19542
3416 1 14 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.742 -5.706 19542
3417 1 14 . 1 1 12 12 CYS CB C 12 38.892 38.892 27.936 10.956 19542
3418 1 14 . 1 1 12 12 CYS H H 12 8.970 8.970 8.512 0.458 19542
3419 1 14 . 1 1 13 13 HIS N N 13 121.091 121.091 122.080 -0.989 19542
3420 1 14 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.481 0.168 19542
3421 1 14 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.460 -1.962 19542
3422 1 14 . 1 1 13 13 HIS H H 13 9.015 9.015 8.570 0.445 19542
3423 1 14 . 1 1 14 14 ARG N N 14 120.872 120.872 120.181 0.691 19542
3424 1 14 . 1 1 14 14 ARG HA H 14 4.043 4.043 4.028 0.015 19542
3425 1 14 . 1 1 14 14 ARG CA C 14 58.962 58.962 57.317 1.645 19542
3426 1 14 . 1 1 14 14 ARG CB C 14 30.014 30.014 29.304 0.710 19542
3427 1 14 . 1 1 14 14 ARG H H 14 8.689 8.689 7.882 0.807 19542
3428 1 14 . 1 1 15 15 ASP N N 15 121.233 121.233 118.193 3.040 19542
3429 1 14 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.627 -0.124 19542
3430 1 14 . 1 1 15 15 ASP CA C 15 54.306 54.306 55.579 -1.273 19542
3431 1 14 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.579 -2.472 19542
3432 1 14 . 1 1 15 15 ASP H H 15 8.907 8.907 7.824 1.083 19542
3433 1 14 . 1 1 16 16 MET N N 16 119.073 119.073 119.181 -0.108 19542
3434 1 14 . 1 1 16 16 MET HA H 16 4.415 4.415 4.639 -0.224 19542
3435 1 14 . 1 1 16 16 MET CA C 16 55.995 55.995 54.685 1.310 19542
3436 1 14 . 1 1 16 16 MET CB C 16 32.662 32.662 31.446 1.216 19542
3437 1 14 . 1 1 16 16 MET H H 16 7.811 7.811 7.718 0.093 19542
3438 1 14 . 1 1 17 17 LYS N N 17 120.187 120.187 124.090 -3.903 19542
3439 1 14 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.142 0.125 19542
3440 1 14 . 1 1 17 17 LYS CA C 17 55.889 55.889 56.875 -0.986 19542
3441 1 14 . 1 1 17 17 LYS CB C 17 34.106 34.106 33.718 0.388 19542
3442 1 14 . 1 1 17 17 LYS H H 17 7.763 7.763 8.114 -0.351 19542
3443 1 14 . 1 1 18 18 PHE N N 18 115.631 115.631 116.759 -1.128 19542
3444 1 14 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.116 -0.003 19542
3445 1 14 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.302 0.669 19542
3446 1 14 . 1 1 18 18 PHE CB C 18 43.018 43.018 42.554 0.464 19542
3447 1 14 . 1 1 18 18 PHE H H 18 8.252 8.252 8.127 0.125 19542
3448 1 14 . 1 1 19 19 CYS N N 19 115.508 115.508 119.823 -4.315 19542
3449 1 14 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.274 0.728 19542
3450 1 14 . 1 1 19 19 CYS CA C 19 52.258 52.258 57.825 -5.567 19542
3451 1 14 . 1 1 19 19 CYS CB C 19 38.627 38.627 28.557 10.070 19542
3452 1 14 . 1 1 19 19 CYS H H 19 9.343 9.343 9.497 -0.154 19542
3453 1 14 . 1 1 20 20 TYR N N 20 128.934 128.934 117.409 11.525 19542
3454 1 14 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.931 0.276 19542
3455 1 14 . 1 1 20 20 TYR CA C 20 55.701 55.701 54.986 0.715 19542
3456 1 14 . 1 1 20 20 TYR CB C 20 43.184 43.184 41.406 1.778 19542
3457 1 14 . 1 1 20 20 TYR H H 20 8.871 8.871 9.228 -0.357 19542
3458 1 14 . 1 1 21 21 HIS N N 21 122.079 122.079 122.638 -0.559 19542
3459 1 14 . 1 1 21 21 HIS HA H 21 5.283 5.283 4.917 0.366 19542
3460 1 14 . 1 1 21 21 HIS CA C 21 54.713 54.713 54.206 0.507 19542
3461 1 14 . 1 1 21 21 HIS CB C 21 31.719 31.719 31.964 -0.245 19542
3462 1 14 . 1 1 21 21 HIS H H 21 8.797 8.797 9.184 -0.387 19542
3463 1 14 . 1 1 22 22 ASN N N 22 128.444 128.444 128.013 0.431 19542
3464 1 14 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.444 0.402 19542
3465 1 14 . 1 1 22 22 ASN CA C 22 52.512 52.512 51.010 1.502 19542
3466 1 14 . 1 1 22 22 ASN CB C 22 40.821 40.821 40.624 0.197 19542
3467 1 14 . 1 1 22 22 ASN H H 22 9.823 9.823 8.945 0.878 19542
3468 1 14 . 1 1 23 23 THR N N 23 116.691 116.691 118.172 -1.481 19542
3469 1 14 . 1 1 23 23 THR HA H 23 4.604 4.604 4.168 0.436 19542
3470 1 14 . 1 1 23 23 THR CA C 23 57.003 57.003 63.747 -6.744 19542
3471 1 14 . 1 1 23 23 THR CB C 23 69.344 69.344 69.200 0.144 19542
3472 1 14 . 1 1 23 23 THR H H 23 8.561 8.561 8.115 0.446 19542
3473 1 14 . 1 1 24 24 GLY N N 24 110.763 110.763 109.590 1.173 19542
3474 1 14 . 1 1 24 24 GLY CA C 24 44.993 44.993 44.670 0.323 19542
3475 1 14 . 1 1 24 24 GLY H H 24 8.608 8.608 8.160 0.448 19542
3476 1 14 . 1 1 25 25 MET N N 25 120.520 120.520 121.060 -0.540 19542
3477 1 14 . 1 1 25 25 MET HA H 25 4.818 4.818 4.694 0.124 19542
3478 1 14 . 1 1 25 25 MET CA C 25 53.892 53.892 51.689 2.203 19542
3479 1 14 . 1 1 25 25 MET CB C 25 32.399 32.399 32.219 0.180 19542
3480 1 14 . 1 1 25 25 MET H H 25 8.418 8.418 8.314 0.104 19542
3481 1 14 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.320 0.057 19542
3482 1 14 . 1 1 26 26 PRO CA C 26 63.841 63.841 63.047 0.794 19542
3483 1 14 . 1 1 26 26 PRO CB C 26 31.750 31.750 31.433 0.317 19542
3484 1 14 . 1 1 27 27 PHE N N 27 118.056 118.056 124.259 -6.203 19542
3485 1 14 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.775 -0.150 19542
3486 1 14 . 1 1 27 27 PHE CA C 27 57.332 57.332 56.263 1.069 19542
3487 1 14 . 1 1 27 27 PHE CB C 27 39.701 39.701 42.720 -3.019 19542
3488 1 14 . 1 1 27 27 PHE H H 27 7.988 7.988 8.023 -0.035 19542
3489 1 14 . 1 1 28 28 ARG N N 28 121.294 121.294 124.092 -2.798 19542
3490 1 14 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.287 -0.228 19542
3491 1 14 . 1 1 28 28 ARG CA C 28 57.142 57.142 57.767 -0.625 19542
3492 1 14 . 1 1 28 28 ARG CB C 28 29.711 29.711 30.141 -0.430 19542
3493 1 14 . 1 1 28 28 ARG H H 28 8.333 8.333 8.947 -0.615 19542
3494 1 14 . 1 1 29 29 ASN N N 29 116.243 116.243 115.723 0.520 19542
3495 1 14 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.401 0.195 19542
3496 1 14 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.617 -0.822 19542
3497 1 14 . 1 1 29 29 ASN CB C 29 38.239 38.239 37.793 0.446 19542
3498 1 14 . 1 1 29 29 ASN H H 29 8.356 8.356 8.953 -0.597 19542
3499 1 14 . 1 1 30 30 LEU N N 30 121.660 121.660 121.682 -0.022 19542
3500 1 14 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.604 -0.159 19542
3501 1 14 . 1 1 30 30 LEU CA C 30 55.203 55.203 54.315 0.888 19542
3502 1 14 . 1 1 30 30 LEU CB C 30 42.982 42.982 42.484 0.498 19542
3503 1 14 . 1 1 30 30 LEU H H 30 8.028 8.028 7.407 0.621 19542
3504 1 14 . 1 1 31 31 LYS N N 31 120.928 120.928 126.261 -5.333 19542
3505 1 14 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.449 -0.071 19542
3506 1 14 . 1 1 31 31 LYS CA C 31 56.271 56.271 55.221 1.050 19542
3507 1 14 . 1 1 31 31 LYS CB C 31 32.230 32.230 32.960 -0.730 19542
3508 1 14 . 1 1 31 31 LYS H H 31 8.306 8.306 8.399 -0.093 19542
3509 1 14 . 1 1 32 32 LEU N N 32 122.843 122.843 127.208 -4.365 19542
3510 1 14 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.387 0.059 19542
3511 1 14 . 1 1 32 32 LEU CA C 32 54.484 54.484 54.674 -0.190 19542
3512 1 14 . 1 1 32 32 LEU CB C 32 43.404 43.404 42.566 0.838 19542
3513 1 14 . 1 1 32 32 LEU H H 32 8.027 8.027 8.688 -0.661 19542
3514 1 14 . 1 1 33 33 ILE N N 33 123.311 123.311 128.383 -5.072 19542
3515 1 14 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.283 0.100 19542
3516 1 14 . 1 1 33 33 ILE CA C 33 60.595 60.595 60.228 0.367 19542
3517 1 14 . 1 1 33 33 ILE CB C 33 38.303 38.303 36.306 1.997 19542
3518 1 14 . 1 1 33 33 ILE H H 33 8.327 8.327 8.255 0.072 19542
3519 1 14 . 1 1 34 34 LEU N N 34 128.669 128.669 129.834 -1.165 19542
3520 1 14 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.801 -0.007 19542
3521 1 14 . 1 1 34 34 LEU CB C 34 42.873 42.873 41.264 1.609 19542
3522 1 14 . 1 1 34 34 LEU H H 34 8.880 8.880 8.276 0.604 19542
3523 1 14 . 1 1 35 35 GLN N N 35 121.600 121.600 120.979 0.621 19542
3524 1 14 . 1 1 35 35 GLN HA H 35 4.588 4.588 5.130 -0.542 19542
3525 1 14 . 1 1 35 35 GLN CA C 35 61.390 61.390 55.086 6.304 19542
3526 1 14 . 1 1 35 35 GLN CB C 35 33.866 33.866 30.526 3.340 19542
3527 1 14 . 1 1 35 35 GLN H H 35 8.210 8.210 7.866 0.344 19542
3528 1 14 . 1 1 36 36 GLY N N 36 106.726 106.726 109.725 -2.999 19542
3529 1 14 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.899 1.979 19542
3530 1 14 . 1 1 36 36 GLY H H 36 6.121 6.121 7.246 -1.125 19542
3531 1 14 . 1 1 37 37 CYS N N 37 124.584 124.584 118.209 6.375 19542
3532 1 14 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.240 0.634 19542
3533 1 14 . 1 1 37 37 CYS CA C 37 55.955 55.955 58.181 -2.226 19542
3534 1 14 . 1 1 37 37 CYS CB C 37 48.202 48.202 30.469 17.733 19542
3535 1 14 . 1 1 37 37 CYS H H 37 8.505 8.505 8.299 0.206 19542
3536 1 14 . 1 1 38 38 SER N N 38 115.036 115.036 118.008 -2.972 19542
3537 1 14 . 1 1 38 38 SER HA H 38 4.980 4.980 5.117 -0.137 19542
3538 1 14 . 1 1 38 38 SER CA C 38 58.792 58.792 56.467 2.325 19542
3539 1 14 . 1 1 38 38 SER CB C 38 65.971 65.971 65.710 0.261 19542
3540 1 14 . 1 1 38 38 SER H H 38 9.749 9.749 9.326 0.423 19542
3541 1 14 . 1 1 39 39 SER N N 39 117.276 117.276 120.885 -3.609 19542
3542 1 14 . 1 1 39 39 SER HA H 39 4.827 4.827 4.746 0.081 19542
3543 1 14 . 1 1 39 39 SER CA C 39 60.040 60.040 60.939 -0.899 19542
3544 1 14 . 1 1 39 39 SER CB C 39 63.784 63.784 63.731 0.053 19542
3545 1 14 . 1 1 39 39 SER H H 39 9.161 9.161 8.967 0.194 19542
3546 1 14 . 1 1 40 40 SER N N 40 115.041 115.041 115.033 0.008 19542
3547 1 14 . 1 1 40 40 SER HA H 40 4.660 4.660 4.822 -0.162 19542
3548 1 14 . 1 1 40 40 SER CA C 40 55.868 55.868 56.553 -0.685 19542
3549 1 14 . 1 1 40 40 SER CB C 40 64.868 64.868 65.323 -0.455 19542
3550 1 14 . 1 1 40 40 SER H H 40 7.911 7.911 7.667 0.244 19542
3551 1 14 . 1 1 41 41 CYS N N 41 124.146 124.146 120.311 3.835 19542
3552 1 14 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.538 -0.229 19542
3553 1 14 . 1 1 41 41 CYS CA C 41 57.567 57.567 57.740 -0.173 19542
3554 1 14 . 1 1 41 41 CYS CB C 41 40.000 40.000 28.902 11.098 19542
3555 1 14 . 1 1 41 41 CYS H H 41 8.067 8.067 8.380 -0.313 19542
3556 1 14 . 1 1 42 42 SER N N 42 118.590 118.590 122.302 -3.712 19542
3557 1 14 . 1 1 42 42 SER HA H 42 4.611 4.611 4.582 0.029 19542
3558 1 14 . 1 1 42 42 SER CA C 42 59.020 59.020 57.493 1.527 19542
3559 1 14 . 1 1 42 42 SER CB C 42 64.112 64.112 63.115 0.997 19542
3560 1 14 . 1 1 42 42 SER H H 42 8.491 8.491 8.634 -0.143 19542
3561 1 14 . 1 1 43 43 GLU N N 43 118.830 118.830 126.393 -7.563 19542
3562 1 14 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.174 0.475 19542
3563 1 14 . 1 1 43 43 GLU CA C 43 56.856 56.856 57.258 -0.402 19542
3564 1 14 . 1 1 43 43 GLU CB C 43 29.206 29.206 30.193 -0.987 19542
3565 1 14 . 1 1 43 43 GLU H H 43 8.861 8.861 8.553 0.308 19542
3566 1 14 . 1 1 44 44 THR N N 44 117.954 117.954 119.294 -1.340 19542
3567 1 14 . 1 1 44 44 THR HA H 44 4.619 4.619 4.412 0.207 19542
3568 1 14 . 1 1 44 44 THR CB C 44 72.341 72.341 70.009 2.332 19542
3569 1 14 . 1 1 44 44 THR H H 44 9.030 9.030 8.149 0.881 19542
3570 1 14 . 1 1 45 45 GLU N N 45 127.100 127.100 120.770 6.330 19542
3571 1 14 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.229 -0.135 19542
3572 1 14 . 1 1 45 45 GLU CA C 45 58.934 58.934 58.317 0.617 19542
3573 1 14 . 1 1 45 45 GLU CB C 45 27.009 27.009 29.998 -2.990 19542
3574 1 14 . 1 1 45 45 GLU H H 45 8.837 8.837 8.724 0.113 19542
3575 1 14 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.471 0.431 19542
3576 1 14 . 1 1 46 46 ASN CA C 46 53.244 53.244 55.596 -2.352 19542
3577 1 14 . 1 1 46 46 ASN CB C 46 40.053 40.053 39.205 0.848 19542
3578 1 14 . 1 1 46 46 ASN H H 46 8.018 8.018 7.795 0.223 19542
3579 1 14 . 1 1 47 47 ASN N N 47 120.765 120.765 118.226 2.539 19542
3580 1 14 . 1 1 47 47 ASN HA H 47 5.362 5.362 4.965 0.397 19542
3581 1 14 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.749 1.230 19542
3582 1 14 . 1 1 47 47 ASN CB C 47 41.749 41.749 38.724 3.026 19542
3583 1 14 . 1 1 47 47 ASN H H 47 7.835 7.835 7.826 0.009 19542
3584 1 14 . 1 1 48 48 LYS N N 48 123.576 123.576 126.867 -3.291 19542
3585 1 14 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.637 0.205 19542
3586 1 14 . 1 1 48 48 LYS CB C 48 34.398 34.398 33.526 0.872 19542
3587 1 14 . 1 1 48 48 LYS H H 48 8.548 8.548 8.643 -0.095 19542
3588 1 14 . 1 1 49 49 CYS N N 49 116.141 116.141 123.387 -7.246 19542
3589 1 14 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.752 -0.199 19542
3590 1 14 . 1 1 49 49 CYS CA C 49 53.386 53.386 57.836 -4.450 19542
3591 1 14 . 1 1 49 49 CYS CB C 49 44.935 44.935 27.479 17.456 19542
3592 1 14 . 1 1 49 49 CYS H H 49 8.873 8.873 8.759 0.114 19542
3593 1 14 . 1 1 50 50 CYS N N 50 118.484 118.484 122.625 -4.141 19542
3594 1 14 . 1 1 50 50 CYS HA H 50 5.265 5.265 4.988 0.277 19542
3595 1 14 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.111 -1.128 19542
3596 1 14 . 1 1 50 50 CYS CB C 50 46.111 46.111 30.970 15.141 19542
3597 1 14 . 1 1 50 50 CYS H H 50 9.389 9.389 9.576 -0.187 19542
3598 1 14 . 1 1 51 51 SER N N 51 115.213 115.213 115.439 -0.226 19542
3599 1 14 . 1 1 51 51 SER HA H 51 5.016 5.016 4.778 0.238 19542
3600 1 14 . 1 1 51 51 SER CA C 51 58.118 58.118 57.605 0.513 19542
3601 1 14 . 1 1 51 51 SER CB C 51 64.457 64.457 63.268 1.189 19542
3602 1 14 . 1 1 51 51 SER H H 51 9.290 9.290 8.541 0.749 19542
3603 1 14 . 1 1 52 52 THR N N 52 112.156 112.156 118.219 -6.063 19542
3604 1 14 . 1 1 52 52 THR HA H 52 4.692 4.692 4.513 0.179 19542
3605 1 14 . 1 1 52 52 THR CA C 52 59.835 59.835 60.748 -0.913 19542
3606 1 14 . 1 1 52 52 THR CB C 52 71.872 71.872 71.591 0.281 19542
3607 1 14 . 1 1 52 52 THR H H 52 7.624 7.624 7.497 0.127 19542
3608 1 14 . 1 1 53 53 ASP N N 53 119.869 119.869 122.984 -3.115 19542
3609 1 14 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.347 0.623 19542
3610 1 14 . 1 1 53 53 ASP CA C 53 55.485 55.485 56.352 -0.867 19542
3611 1 14 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.716 0.006 19542
3612 1 14 . 1 1 53 53 ASP H H 53 8.410 8.410 8.516 -0.106 19542
3613 1 14 . 1 1 54 54 ARG N N 54 111.677 111.677 117.730 -6.053 19542
3614 1 14 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.670 -0.485 19542
3615 1 14 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.593 0.369 19542
3616 1 14 . 1 1 54 54 ARG CB C 54 28.429 28.429 27.158 1.271 19542
3617 1 14 . 1 1 54 54 ARG H H 54 9.306 9.306 8.892 0.414 19542
3618 1 14 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.494 0.067 19542
3619 1 14 . 1 1 55 55 CYS CA C 55 57.814 57.814 59.591 -1.777 19542
3620 1 14 . 1 1 55 55 CYS CB C 55 46.236 46.236 26.808 19.427 19542
3621 1 14 . 1 1 55 55 CYS H H 55 7.995 7.995 7.986 0.009 19542
3622 1 14 . 1 1 56 56 ASN N N 56 121.881 121.881 117.940 3.941 19542
3623 1 14 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.707 0.103 19542
3624 1 14 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.992 -0.626 19542
3625 1 14 . 1 1 56 56 ASN CB C 56 37.837 37.837 36.925 0.912 19542
3626 1 14 . 1 1 56 56 ASN H H 56 8.755 8.755 8.697 0.058 19542
3627 1 15 . 1 1 2 2 LYS N N 2 126.352 126.352 120.654 5.698 19542
3628 1 15 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.303 0.087 19542
3629 1 15 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.802 -0.400 19542
3630 1 15 . 1 1 2 2 LYS CB C 2 29.734 29.734 32.528 -2.794 19542
3631 1 15 . 1 1 2 2 LYS H H 2 8.381 8.381 8.232 0.149 19542
3632 1 15 . 1 1 3 3 CYS N N 3 117.974 117.974 121.040 -3.066 19542
3633 1 15 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.694 0.265 19542
3634 1 15 . 1 1 3 3 CYS CA C 3 51.272 51.272 58.246 -6.974 19542
3635 1 15 . 1 1 3 3 CYS CB C 3 42.039 42.039 32.383 9.656 19542
3636 1 15 . 1 1 3 3 CYS H H 3 8.394 8.394 8.823 -0.429 19542
3637 1 15 . 1 1 4 4 PHE N N 4 120.016 120.016 121.073 -1.057 19542
3638 1 15 . 1 1 4 4 PHE HA H 4 4.606 4.606 4.884 -0.278 19542
3639 1 15 . 1 1 4 4 PHE CB C 4 39.719 39.719 36.818 2.901 19542
3640 1 15 . 1 1 4 4 PHE H H 4 9.550 9.550 9.377 0.173 19542
3641 1 15 . 1 1 5 5 GLN N N 5 120.517 120.517 122.005 -1.488 19542
3642 1 15 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.173 0.249 19542
3643 1 15 . 1 1 5 5 GLN CA C 5 56.003 56.003 57.355 -1.352 19542
3644 1 15 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.412 3.183 19542
3645 1 15 . 1 1 5 5 GLN H H 5 9.406 9.406 8.049 1.357 19542
3646 1 15 . 1 1 6 6 HIS N N 6 118.478 118.478 117.315 1.163 19542
3647 1 15 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.690 -0.212 19542
3648 1 15 . 1 1 6 6 HIS CA C 6 56.627 56.627 55.645 0.982 19542
3649 1 15 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.543 -2.567 19542
3650 1 15 . 1 1 6 6 HIS H H 6 8.827 8.827 7.400 1.427 19542
3651 1 15 . 1 1 7 7 GLY N N 7 103.072 103.072 108.174 -5.102 19542
3652 1 15 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.498 0.426 19542
3653 1 15 . 1 1 7 7 GLY H H 7 8.440 8.440 8.549 -0.109 19542
3654 1 15 . 1 1 8 8 LYS N N 8 119.909 119.909 120.302 -0.393 19542
3655 1 15 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.906 -0.078 19542
3656 1 15 . 1 1 8 8 LYS CB C 8 35.493 35.493 35.075 0.418 19542
3657 1 15 . 1 1 8 8 LYS H H 8 7.703 7.703 7.973 -0.270 19542
3658 1 15 . 1 1 9 9 VAL N N 9 122.232 122.232 123.080 -0.848 19542
3659 1 15 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.452 0.360 19542
3660 1 15 . 1 1 9 9 VAL CA C 9 63.286 63.286 63.155 0.131 19542
3661 1 15 . 1 1 9 9 VAL CB C 9 26.812 26.812 29.848 -3.036 19542
3662 1 15 . 1 1 9 9 VAL H H 9 8.552 8.552 8.243 0.309 19542
3663 1 15 . 1 1 10 10 VAL N N 10 123.963 123.963 125.096 -1.133 19542
3664 1 15 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.636 -0.030 19542
3665 1 15 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.298 1.094 19542
3666 1 15 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.632 -0.850 19542
3667 1 15 . 1 1 10 10 VAL H H 10 8.920 8.920 8.557 0.363 19542
3668 1 15 . 1 1 11 11 THR N N 11 118.572 118.572 120.056 -1.484 19542
3669 1 15 . 1 1 11 11 THR HA H 11 4.443 4.443 4.601 -0.158 19542
3670 1 15 . 1 1 11 11 THR CA C 11 62.719 62.719 63.000 -0.281 19542
3671 1 15 . 1 1 11 11 THR CB C 11 68.689 68.689 68.194 0.495 19542
3672 1 15 . 1 1 11 11 THR H H 11 8.517 8.517 8.168 0.349 19542
3673 1 15 . 1 1 12 12 CYS N N 12 126.835 126.835 126.048 0.787 19542
3674 1 15 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.461 0.210 19542
3675 1 15 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.785 -5.749 19542
3676 1 15 . 1 1 12 12 CYS CB C 12 38.892 38.892 28.195 10.697 19542
3677 1 15 . 1 1 12 12 CYS H H 12 8.970 8.970 8.645 0.325 19542
3678 1 15 . 1 1 13 13 HIS N N 13 121.091 121.091 121.441 -0.350 19542
3679 1 15 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.413 0.236 19542
3680 1 15 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.213 -1.715 19542
3681 1 15 . 1 1 13 13 HIS H H 13 9.015 9.015 8.479 0.536 19542
3682 1 15 . 1 1 14 14 ARG N N 14 120.872 120.872 121.216 -0.344 19542
3683 1 15 . 1 1 14 14 ARG HA H 14 4.043 4.043 4.029 0.014 19542
3684 1 15 . 1 1 14 14 ARG CA C 14 58.962 58.962 58.369 0.593 19542
3685 1 15 . 1 1 14 14 ARG CB C 14 30.014 30.014 30.124 -0.110 19542
3686 1 15 . 1 1 14 14 ARG H H 14 8.689 8.689 8.188 0.501 19542
3687 1 15 . 1 1 15 15 ASP N N 15 121.233 121.233 118.083 3.150 19542
3688 1 15 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.623 -0.120 19542
3689 1 15 . 1 1 15 15 ASP CA C 15 54.306 54.306 55.915 -1.609 19542
3690 1 15 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.254 -2.147 19542
3691 1 15 . 1 1 15 15 ASP H H 15 8.907 8.907 7.771 1.136 19542
3692 1 15 . 1 1 16 16 MET N N 16 119.073 119.073 118.571 0.502 19542
3693 1 15 . 1 1 16 16 MET HA H 16 4.415 4.415 4.558 -0.143 19542
3694 1 15 . 1 1 16 16 MET CA C 16 55.995 55.995 54.472 1.523 19542
3695 1 15 . 1 1 16 16 MET CB C 16 32.662 32.662 31.600 1.062 19542
3696 1 15 . 1 1 16 16 MET H H 16 7.811 7.811 7.582 0.229 19542
3697 1 15 . 1 1 17 17 LYS N N 17 120.187 120.187 123.886 -3.699 19542
3698 1 15 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.121 0.146 19542
3699 1 15 . 1 1 17 17 LYS CA C 17 55.889 55.889 57.148 -1.259 19542
3700 1 15 . 1 1 17 17 LYS CB C 17 34.106 34.106 33.429 0.677 19542
3701 1 15 . 1 1 17 17 LYS H H 17 7.763 7.763 8.051 -0.288 19542
3702 1 15 . 1 1 18 18 PHE N N 18 115.631 115.631 116.872 -1.241 19542
3703 1 15 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.201 -0.088 19542
3704 1 15 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.090 0.881 19542
3705 1 15 . 1 1 18 18 PHE CB C 18 43.018 43.018 42.923 0.095 19542
3706 1 15 . 1 1 18 18 PHE H H 18 8.252 8.252 7.999 0.253 19542
3707 1 15 . 1 1 19 19 CYS N N 19 115.508 115.508 120.288 -4.780 19542
3708 1 15 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.398 0.604 19542
3709 1 15 . 1 1 19 19 CYS CA C 19 52.258 52.258 57.753 -5.495 19542
3710 1 15 . 1 1 19 19 CYS CB C 19 38.627 38.627 28.039 10.588 19542
3711 1 15 . 1 1 19 19 CYS H H 19 9.343 9.343 9.446 -0.103 19542
3712 1 15 . 1 1 20 20 TYR N N 20 128.934 128.934 119.572 9.362 19542
3713 1 15 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.693 0.514 19542
3714 1 15 . 1 1 20 20 TYR CA C 20 55.701 55.701 54.732 0.969 19542
3715 1 15 . 1 1 20 20 TYR CB C 20 43.184 43.184 41.373 1.811 19542
3716 1 15 . 1 1 20 20 TYR H H 20 8.871 8.871 9.270 -0.399 19542
3717 1 15 . 1 1 21 21 HIS N N 21 122.079 122.079 122.710 -0.631 19542
3718 1 15 . 1 1 21 21 HIS HA H 21 5.283 5.283 5.268 0.015 19542
3719 1 15 . 1 1 21 21 HIS CA C 21 54.713 54.713 54.169 0.544 19542
3720 1 15 . 1 1 21 21 HIS CB C 21 31.719 31.719 31.818 -0.099 19542
3721 1 15 . 1 1 21 21 HIS H H 21 8.797 8.797 9.315 -0.518 19542
3722 1 15 . 1 1 22 22 ASN N N 22 128.444 128.444 128.295 0.149 19542
3723 1 15 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.251 0.595 19542
3724 1 15 . 1 1 22 22 ASN CA C 22 52.512 52.512 52.336 0.176 19542
3725 1 15 . 1 1 22 22 ASN CB C 22 40.821 40.821 40.635 0.186 19542
3726 1 15 . 1 1 22 22 ASN H H 22 9.823 9.823 9.113 0.710 19542
3727 1 15 . 1 1 23 23 THR N N 23 116.691 116.691 119.428 -2.737 19542
3728 1 15 . 1 1 23 23 THR HA H 23 4.604 4.604 4.439 0.165 19542
3729 1 15 . 1 1 23 23 THR CA C 23 57.003 57.003 61.293 -4.290 19542
3730 1 15 . 1 1 23 23 THR CB C 23 69.344 69.344 69.677 -0.333 19542
3731 1 15 . 1 1 23 23 THR H H 23 8.561 8.561 8.611 -0.050 19542
3732 1 15 . 1 1 24 24 GLY N N 24 110.763 110.763 113.005 -2.242 19542
3733 1 15 . 1 1 24 24 GLY CA C 24 44.993 44.993 43.968 1.025 19542
3734 1 15 . 1 1 24 24 GLY H H 24 8.608 8.608 8.224 0.384 19542
3735 1 15 . 1 1 25 25 MET N N 25 120.520 120.520 120.272 0.248 19542
3736 1 15 . 1 1 25 25 MET HA H 25 4.818 4.818 4.626 0.192 19542
3737 1 15 . 1 1 25 25 MET CA C 25 53.892 53.892 53.794 0.098 19542
3738 1 15 . 1 1 25 25 MET CB C 25 32.399 32.399 32.808 -0.409 19542
3739 1 15 . 1 1 25 25 MET H H 25 8.418 8.418 8.372 0.046 19542
3740 1 15 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.471 -0.094 19542
3741 1 15 . 1 1 26 26 PRO CA C 26 63.841 63.841 63.185 0.656 19542
3742 1 15 . 1 1 26 26 PRO CB C 26 31.750 31.750 31.155 0.595 19542
3743 1 15 . 1 1 27 27 PHE N N 27 118.056 118.056 124.168 -6.112 19542
3744 1 15 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.700 -0.075 19542
3745 1 15 . 1 1 27 27 PHE CA C 27 57.332 57.332 56.797 0.535 19542
3746 1 15 . 1 1 27 27 PHE CB C 27 39.701 39.701 41.828 -2.127 19542
3747 1 15 . 1 1 27 27 PHE H H 27 7.988 7.988 8.155 -0.167 19542
3748 1 15 . 1 1 28 28 ARG N N 28 121.294 121.294 121.047 0.247 19542
3749 1 15 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.505 -0.446 19542
3750 1 15 . 1 1 28 28 ARG CA C 28 57.142 57.142 56.058 1.084 19542
3751 1 15 . 1 1 28 28 ARG CB C 28 29.711 29.711 30.902 -1.191 19542
3752 1 15 . 1 1 28 28 ARG H H 28 8.333 8.333 8.823 -0.490 19542
3753 1 15 . 1 1 29 29 ASN N N 29 116.243 116.243 115.099 1.144 19542
3754 1 15 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.396 0.200 19542
3755 1 15 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.554 -0.759 19542
3756 1 15 . 1 1 29 29 ASN CB C 29 38.239 38.239 38.069 0.170 19542
3757 1 15 . 1 1 29 29 ASN H H 29 8.356 8.356 8.905 -0.549 19542
3758 1 15 . 1 1 30 30 LEU N N 30 121.660 121.660 119.498 2.162 19542
3759 1 15 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.547 -0.102 19542
3760 1 15 . 1 1 30 30 LEU CA C 30 55.203 55.203 54.999 0.204 19542
3761 1 15 . 1 1 30 30 LEU CB C 30 42.982 42.982 43.367 -0.385 19542
3762 1 15 . 1 1 30 30 LEU H H 30 8.028 8.028 7.599 0.429 19542
3763 1 15 . 1 1 31 31 LYS N N 31 120.928 120.928 125.237 -4.309 19542
3764 1 15 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.398 -0.020 19542
3765 1 15 . 1 1 31 31 LYS CA C 31 56.271 56.271 55.154 1.117 19542
3766 1 15 . 1 1 31 31 LYS CB C 31 32.230 32.230 31.127 1.103 19542
3767 1 15 . 1 1 31 31 LYS H H 31 8.306 8.306 8.155 0.151 19542
3768 1 15 . 1 1 32 32 LEU N N 32 122.843 122.843 122.609 0.234 19542
3769 1 15 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.427 0.019 19542
3770 1 15 . 1 1 32 32 LEU CA C 32 54.484 54.484 54.701 -0.217 19542
3771 1 15 . 1 1 32 32 LEU CB C 32 43.404 43.404 41.299 2.105 19542
3772 1 15 . 1 1 32 32 LEU H H 32 8.027 8.027 7.893 0.134 19542
3773 1 15 . 1 1 33 33 ILE N N 33 123.311 123.311 125.092 -1.781 19542
3774 1 15 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.397 -0.014 19542
3775 1 15 . 1 1 33 33 ILE CA C 33 60.595 60.595 60.367 0.228 19542
3776 1 15 . 1 1 33 33 ILE CB C 33 38.303 38.303 39.705 -1.402 19542
3777 1 15 . 1 1 33 33 ILE H H 33 8.327 8.327 8.064 0.263 19542
3778 1 15 . 1 1 34 34 LEU N N 34 128.669 128.669 131.176 -2.507 19542
3779 1 15 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.706 0.088 19542
3780 1 15 . 1 1 34 34 LEU CB C 34 42.873 42.873 41.093 1.780 19542
3781 1 15 . 1 1 34 34 LEU H H 34 8.880 8.880 9.012 -0.132 19542
3782 1 15 . 1 1 35 35 GLN N N 35 121.600 121.600 121.943 -0.343 19542
3783 1 15 . 1 1 35 35 GLN HA H 35 4.588 4.588 5.091 -0.503 19542
3784 1 15 . 1 1 35 35 GLN CA C 35 61.390 61.390 54.449 6.941 19542
3785 1 15 . 1 1 35 35 GLN CB C 35 33.866 33.866 32.463 1.403 19542
3786 1 15 . 1 1 35 35 GLN H H 35 8.210 8.210 8.410 -0.200 19542
3787 1 15 . 1 1 36 36 GLY N N 36 106.726 106.726 109.265 -2.539 19542
3788 1 15 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.464 2.414 19542
3789 1 15 . 1 1 36 36 GLY H H 36 6.121 6.121 6.875 -0.754 19542
3790 1 15 . 1 1 37 37 CYS N N 37 124.584 124.584 118.678 5.906 19542
3791 1 15 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.410 0.464 19542
3792 1 15 . 1 1 37 37 CYS CA C 37 55.955 55.955 58.104 -2.149 19542
3793 1 15 . 1 1 37 37 CYS CB C 37 48.202 48.202 29.263 18.939 19542
3794 1 15 . 1 1 37 37 CYS H H 37 8.505 8.505 8.457 0.048 19542
3795 1 15 . 1 1 38 38 SER N N 38 115.036 115.036 118.302 -3.266 19542
3796 1 15 . 1 1 38 38 SER HA H 38 4.980 4.980 4.980 -0.000 19542
3797 1 15 . 1 1 38 38 SER CA C 38 58.792 58.792 57.015 1.777 19542
3798 1 15 . 1 1 38 38 SER CB C 38 65.971 65.971 66.527 -0.556 19542
3799 1 15 . 1 1 38 38 SER H H 38 9.749 9.749 9.164 0.585 19542
3800 1 15 . 1 1 39 39 SER N N 39 117.276 117.276 118.744 -1.468 19542
3801 1 15 . 1 1 39 39 SER HA H 39 4.827 4.827 4.975 -0.148 19542
3802 1 15 . 1 1 39 39 SER CA C 39 60.040 60.040 59.706 0.334 19542
3803 1 15 . 1 1 39 39 SER CB C 39 63.784 63.784 63.756 0.028 19542
3804 1 15 . 1 1 39 39 SER H H 39 9.161 9.161 8.862 0.299 19542
3805 1 15 . 1 1 40 40 SER N N 40 115.041 115.041 115.597 -0.556 19542
3806 1 15 . 1 1 40 40 SER HA H 40 4.660 4.660 4.737 -0.077 19542
3807 1 15 . 1 1 40 40 SER CA C 40 55.868 55.868 58.435 -2.567 19542
3808 1 15 . 1 1 40 40 SER CB C 40 64.868 64.868 65.817 -0.949 19542
3809 1 15 . 1 1 40 40 SER H H 40 7.911 7.911 7.978 -0.067 19542
3810 1 15 . 1 1 41 41 CYS N N 41 124.146 124.146 120.089 4.057 19542
3811 1 15 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.539 -0.230 19542
3812 1 15 . 1 1 41 41 CYS CA C 41 57.567 57.567 58.706 -1.139 19542
3813 1 15 . 1 1 41 41 CYS CB C 41 40.000 40.000 29.588 10.412 19542
3814 1 15 . 1 1 41 41 CYS H H 41 8.067 8.067 8.616 -0.549 19542
3815 1 15 . 1 1 42 42 SER N N 42 118.590 118.590 120.502 -1.912 19542
3816 1 15 . 1 1 42 42 SER HA H 42 4.611 4.611 4.605 0.006 19542
3817 1 15 . 1 1 42 42 SER CA C 42 59.020 59.020 57.104 1.916 19542
3818 1 15 . 1 1 42 42 SER CB C 42 64.112 64.112 63.804 0.308 19542
3819 1 15 . 1 1 42 42 SER H H 42 8.491 8.491 8.600 -0.109 19542
3820 1 15 . 1 1 43 43 GLU N N 43 118.830 118.830 127.917 -9.087 19542
3821 1 15 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.606 0.043 19542
3822 1 15 . 1 1 43 43 GLU CA C 43 56.856 56.856 57.575 -0.719 19542
3823 1 15 . 1 1 43 43 GLU CB C 43 29.206 29.206 28.945 0.261 19542
3824 1 15 . 1 1 43 43 GLU H H 43 8.861 8.861 8.657 0.204 19542
3825 1 15 . 1 1 44 44 THR N N 44 117.954 117.954 118.223 -0.269 19542
3826 1 15 . 1 1 44 44 THR HA H 44 4.619 4.619 4.627 -0.008 19542
3827 1 15 . 1 1 44 44 THR CB C 44 72.341 72.341 70.930 1.411 19542
3828 1 15 . 1 1 44 44 THR H H 44 9.030 9.030 8.542 0.488 19542
3829 1 15 . 1 1 45 45 GLU N N 45 127.100 127.100 119.241 7.859 19542
3830 1 15 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.164 -0.070 19542
3831 1 15 . 1 1 45 45 GLU CA C 45 58.934 58.934 58.590 0.344 19542
3832 1 15 . 1 1 45 45 GLU CB C 45 27.009 27.009 30.025 -3.016 19542
3833 1 15 . 1 1 45 45 GLU H H 45 8.837 8.837 8.678 0.159 19542
3834 1 15 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.473 0.429 19542
3835 1 15 . 1 1 46 46 ASN CA C 46 53.244 53.244 55.641 -2.397 19542
3836 1 15 . 1 1 46 46 ASN CB C 46 40.053 40.053 38.829 1.224 19542
3837 1 15 . 1 1 46 46 ASN H H 46 8.018 8.018 8.125 -0.107 19542
3838 1 15 . 1 1 47 47 ASN N N 47 120.765 120.765 118.735 2.030 19542
3839 1 15 . 1 1 47 47 ASN HA H 47 5.362 5.362 5.119 0.243 19542
3840 1 15 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.420 1.559 19542
3841 1 15 . 1 1 47 47 ASN CB C 47 41.749 41.749 40.157 1.592 19542
3842 1 15 . 1 1 47 47 ASN H H 47 7.835 7.835 8.263 -0.428 19542
3843 1 15 . 1 1 48 48 LYS N N 48 123.576 123.576 127.575 -3.999 19542
3844 1 15 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.869 -0.027 19542
3845 1 15 . 1 1 48 48 LYS CB C 48 34.398 34.398 34.404 -0.006 19542
3846 1 15 . 1 1 48 48 LYS H H 48 8.548 8.548 8.711 -0.163 19542
3847 1 15 . 1 1 49 49 CYS N N 49 116.141 116.141 122.503 -6.362 19542
3848 1 15 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.671 -0.118 19542
3849 1 15 . 1 1 49 49 CYS CA C 49 53.386 53.386 58.011 -4.625 19542
3850 1 15 . 1 1 49 49 CYS CB C 49 44.935 44.935 29.180 15.755 19542
3851 1 15 . 1 1 49 49 CYS H H 49 8.873 8.873 8.730 0.143 19542
3852 1 15 . 1 1 50 50 CYS N N 50 118.484 118.484 120.780 -2.296 19542
3853 1 15 . 1 1 50 50 CYS HA H 50 5.265 5.265 4.970 0.295 19542
3854 1 15 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.315 -1.332 19542
3855 1 15 . 1 1 50 50 CYS CB C 50 46.111 46.111 30.827 15.284 19542
3856 1 15 . 1 1 50 50 CYS H H 50 9.389 9.389 9.582 -0.193 19542
3857 1 15 . 1 1 51 51 SER N N 51 115.213 115.213 119.325 -4.112 19542
3858 1 15 . 1 1 51 51 SER HA H 51 5.016 5.016 4.770 0.246 19542
3859 1 15 . 1 1 51 51 SER CA C 51 58.118 58.118 58.412 -0.294 19542
3860 1 15 . 1 1 51 51 SER CB C 51 64.457 64.457 62.144 2.313 19542
3861 1 15 . 1 1 51 51 SER H H 51 9.290 9.290 8.806 0.484 19542
3862 1 15 . 1 1 52 52 THR N N 52 112.156 112.156 117.853 -5.697 19542
3863 1 15 . 1 1 52 52 THR HA H 52 4.692 4.692 4.518 0.174 19542
3864 1 15 . 1 1 52 52 THR CA C 52 59.835 59.835 60.856 -1.021 19542
3865 1 15 . 1 1 52 52 THR CB C 52 71.872 71.872 71.781 0.091 19542
3866 1 15 . 1 1 52 52 THR H H 52 7.624 7.624 7.682 -0.058 19542
3867 1 15 . 1 1 53 53 ASP N N 53 119.869 119.869 123.469 -3.600 19542
3868 1 15 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.533 0.437 19542
3869 1 15 . 1 1 53 53 ASP CA C 53 55.485 55.485 55.953 -0.468 19542
3870 1 15 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.671 0.051 19542
3871 1 15 . 1 1 53 53 ASP H H 53 8.410 8.410 8.682 -0.272 19542
3872 1 15 . 1 1 54 54 ARG N N 54 111.677 111.677 119.268 -7.591 19542
3873 1 15 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.898 -0.713 19542
3874 1 15 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.559 0.403 19542
3875 1 15 . 1 1 54 54 ARG CB C 54 28.429 28.429 27.339 1.090 19542
3876 1 15 . 1 1 54 54 ARG H H 54 9.306 9.306 8.890 0.416 19542
3877 1 15 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.439 0.122 19542
3878 1 15 . 1 1 55 55 CYS CA C 55 57.814 57.814 59.161 -1.347 19542
3879 1 15 . 1 1 55 55 CYS CB C 55 46.236 46.236 27.858 18.378 19542
3880 1 15 . 1 1 55 55 CYS H H 55 7.995 7.995 7.873 0.122 19542
3881 1 15 . 1 1 56 56 ASN N N 56 121.881 121.881 120.510 1.371 19542
3882 1 15 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.637 0.173 19542
3883 1 15 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.535 -0.169 19542
3884 1 15 . 1 1 56 56 ASN CB C 56 37.837 37.837 36.430 1.407 19542
3885 1 15 . 1 1 56 56 ASN H H 56 8.755 8.755 8.622 0.133 19542
3886 1 16 . 1 1 2 2 LYS N N 2 126.352 126.352 121.087 5.265 19542
3887 1 16 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.319 0.071 19542
3888 1 16 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.489 -0.087 19542
3889 1 16 . 1 1 2 2 LYS CB C 2 29.734 29.734 33.122 -3.388 19542
3890 1 16 . 1 1 2 2 LYS H H 2 8.381 8.381 9.422 -1.041 19542
3891 1 16 . 1 1 3 3 CYS N N 3 117.974 117.974 120.771 -2.797 19542
3892 1 16 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.581 0.378 19542
3893 1 16 . 1 1 3 3 CYS CA C 3 51.272 51.272 57.590 -6.317 19542
3894 1 16 . 1 1 3 3 CYS CB C 3 42.039 42.039 31.335 10.704 19542
3895 1 16 . 1 1 3 3 CYS H H 3 8.394 8.394 8.531 -0.137 19542
3896 1 16 . 1 1 4 4 PHE N N 4 120.016 120.016 120.700 -0.684 19542
3897 1 16 . 1 1 4 4 PHE HA H 4 4.606 4.606 4.817 -0.211 19542
3898 1 16 . 1 1 4 4 PHE CB C 4 39.719 39.719 37.431 2.288 19542
3899 1 16 . 1 1 4 4 PHE H H 4 9.550 9.550 9.159 0.391 19542
3900 1 16 . 1 1 5 5 GLN N N 5 120.517 120.517 123.742 -3.225 19542
3901 1 16 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.241 0.181 19542
3902 1 16 . 1 1 5 5 GLN CA C 5 56.003 56.003 57.626 -1.623 19542
3903 1 16 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.805 2.789 19542
3904 1 16 . 1 1 5 5 GLN H H 5 9.406 9.406 7.894 1.512 19542
3905 1 16 . 1 1 6 6 HIS N N 6 118.478 118.478 116.473 2.005 19542
3906 1 16 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.785 -0.307 19542
3907 1 16 . 1 1 6 6 HIS CA C 6 56.627 56.627 56.086 0.541 19542
3908 1 16 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.713 -2.737 19542
3909 1 16 . 1 1 6 6 HIS H H 6 8.827 8.827 7.319 1.508 19542
3910 1 16 . 1 1 7 7 GLY N N 7 103.072 103.072 107.529 -4.457 19542
3911 1 16 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.333 0.591 19542
3912 1 16 . 1 1 7 7 GLY H H 7 8.440 8.440 8.493 -0.053 19542
3913 1 16 . 1 1 8 8 LYS N N 8 119.909 119.909 120.109 -0.200 19542
3914 1 16 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.855 -0.027 19542
3915 1 16 . 1 1 8 8 LYS CB C 8 35.493 35.493 34.915 0.578 19542
3916 1 16 . 1 1 8 8 LYS H H 8 7.703 7.703 7.962 -0.259 19542
3917 1 16 . 1 1 9 9 VAL N N 9 122.232 122.232 123.454 -1.222 19542
3918 1 16 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.787 0.025 19542
3919 1 16 . 1 1 9 9 VAL CA C 9 63.286 63.286 62.839 0.447 19542
3920 1 16 . 1 1 9 9 VAL CB C 9 26.812 26.812 31.436 -4.624 19542
3921 1 16 . 1 1 9 9 VAL H H 9 8.552 8.552 8.540 0.012 19542
3922 1 16 . 1 1 10 10 VAL N N 10 123.963 123.963 123.915 0.048 19542
3923 1 16 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.687 -0.081 19542
3924 1 16 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.375 1.017 19542
3925 1 16 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.673 -0.891 19542
3926 1 16 . 1 1 10 10 VAL H H 10 8.920 8.920 8.603 0.317 19542
3927 1 16 . 1 1 11 11 THR N N 11 118.572 118.572 120.036 -1.464 19542
3928 1 16 . 1 1 11 11 THR HA H 11 4.443 4.443 4.521 -0.078 19542
3929 1 16 . 1 1 11 11 THR CA C 11 62.719 62.719 62.936 -0.217 19542
3930 1 16 . 1 1 11 11 THR CB C 11 68.689 68.689 68.578 0.111 19542
3931 1 16 . 1 1 11 11 THR H H 11 8.517 8.517 8.166 0.351 19542
3932 1 16 . 1 1 12 12 CYS N N 12 126.835 126.835 126.334 0.501 19542
3933 1 16 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.418 0.253 19542
3934 1 16 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.290 -5.254 19542
3935 1 16 . 1 1 12 12 CYS CB C 12 38.892 38.892 27.768 11.124 19542
3936 1 16 . 1 1 12 12 CYS H H 12 8.970 8.970 8.681 0.289 19542
3937 1 16 . 1 1 13 13 HIS N N 13 121.091 121.091 120.618 0.473 19542
3938 1 16 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.446 0.203 19542
3939 1 16 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.544 -2.046 19542
3940 1 16 . 1 1 13 13 HIS H H 13 9.015 9.015 8.552 0.463 19542
3941 1 16 . 1 1 14 14 ARG N N 14 120.872 120.872 120.161 0.711 19542
3942 1 16 . 1 1 14 14 ARG HA H 14 4.043 4.043 4.015 0.028 19542
3943 1 16 . 1 1 14 14 ARG CA C 14 58.962 58.962 57.968 0.995 19542
3944 1 16 . 1 1 14 14 ARG CB C 14 30.014 30.014 29.686 0.328 19542
3945 1 16 . 1 1 14 14 ARG H H 14 8.689 8.689 8.125 0.564 19542
3946 1 16 . 1 1 15 15 ASP N N 15 121.233 121.233 116.623 4.610 19542
3947 1 16 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.683 -0.180 19542
3948 1 16 . 1 1 15 15 ASP CA C 15 54.306 54.306 54.758 -0.452 19542
3949 1 16 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.506 -2.399 19542
3950 1 16 . 1 1 15 15 ASP H H 15 8.907 8.907 7.794 1.113 19542
3951 1 16 . 1 1 16 16 MET N N 16 119.073 119.073 119.896 -0.823 19542
3952 1 16 . 1 1 16 16 MET HA H 16 4.415 4.415 4.530 -0.115 19542
3953 1 16 . 1 1 16 16 MET CA C 16 55.995 55.995 54.959 1.036 19542
3954 1 16 . 1 1 16 16 MET CB C 16 32.662 32.662 31.372 1.290 19542
3955 1 16 . 1 1 16 16 MET H H 16 7.811 7.811 7.594 0.217 19542
3956 1 16 . 1 1 17 17 LYS N N 17 120.187 120.187 121.868 -1.681 19542
3957 1 16 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.135 0.132 19542
3958 1 16 . 1 1 17 17 LYS CA C 17 55.889 55.889 57.584 -1.696 19542
3959 1 16 . 1 1 17 17 LYS CB C 17 34.106 34.106 33.312 0.794 19542
3960 1 16 . 1 1 17 17 LYS H H 17 7.763 7.763 8.213 -0.450 19542
3961 1 16 . 1 1 18 18 PHE N N 18 115.631 115.631 116.936 -1.305 19542
3962 1 16 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.092 0.021 19542
3963 1 16 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.422 0.549 19542
3964 1 16 . 1 1 18 18 PHE CB C 18 43.018 43.018 43.265 -0.247 19542
3965 1 16 . 1 1 18 18 PHE H H 18 8.252 8.252 8.382 -0.130 19542
3966 1 16 . 1 1 19 19 CYS N N 19 115.508 115.508 120.307 -4.799 19542
3967 1 16 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.146 0.856 19542
3968 1 16 . 1 1 19 19 CYS CA C 19 52.258 52.258 58.198 -5.940 19542
3969 1 16 . 1 1 19 19 CYS CB C 19 38.627 38.627 26.930 11.697 19542
3970 1 16 . 1 1 19 19 CYS H H 19 9.343 9.343 9.342 0.001 19542
3971 1 16 . 1 1 20 20 TYR N N 20 128.934 128.934 120.143 8.791 19542
3972 1 16 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.679 0.528 19542
3973 1 16 . 1 1 20 20 TYR CA C 20 55.701 55.701 54.872 0.829 19542
3974 1 16 . 1 1 20 20 TYR CB C 20 43.184 43.184 40.879 2.305 19542
3975 1 16 . 1 1 20 20 TYR H H 20 8.871 8.871 9.106 -0.235 19542
3976 1 16 . 1 1 21 21 HIS N N 21 122.079 122.079 124.069 -1.990 19542
3977 1 16 . 1 1 21 21 HIS HA H 21 5.283 5.283 4.867 0.416 19542
3978 1 16 . 1 1 21 21 HIS CA C 21 54.713 54.713 54.307 0.406 19542
3979 1 16 . 1 1 21 21 HIS CB C 21 31.719 31.719 31.905 -0.187 19542
3980 1 16 . 1 1 21 21 HIS H H 21 8.797 8.797 9.262 -0.465 19542
3981 1 16 . 1 1 22 22 ASN N N 22 128.444 128.444 128.784 -0.340 19542
3982 1 16 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.382 0.464 19542
3983 1 16 . 1 1 22 22 ASN CA C 22 52.512 52.512 52.070 0.442 19542
3984 1 16 . 1 1 22 22 ASN CB C 22 40.821 40.821 40.281 0.540 19542
3985 1 16 . 1 1 22 22 ASN H H 22 9.823 9.823 9.194 0.629 19542
3986 1 16 . 1 1 23 23 THR N N 23 116.691 116.691 117.053 -0.362 19542
3987 1 16 . 1 1 23 23 THR HA H 23 4.604 4.604 4.398 0.206 19542
3988 1 16 . 1 1 23 23 THR CA C 23 57.003 57.003 61.541 -4.538 19542
3989 1 16 . 1 1 23 23 THR CB C 23 69.344 69.344 69.910 -0.566 19542
3990 1 16 . 1 1 23 23 THR H H 23 8.561 8.561 8.607 -0.046 19542
3991 1 16 . 1 1 24 24 GLY N N 24 110.763 110.763 107.621 3.142 19542
3992 1 16 . 1 1 24 24 GLY CA C 24 44.993 44.993 44.422 0.571 19542
3993 1 16 . 1 1 24 24 GLY H H 24 8.608 8.608 8.240 0.368 19542
3994 1 16 . 1 1 25 25 MET N N 25 120.520 120.520 119.267 1.253 19542
3995 1 16 . 1 1 25 25 MET HA H 25 4.818 4.818 4.513 0.305 19542
3996 1 16 . 1 1 25 25 MET CA C 25 53.892 53.892 52.630 1.262 19542
3997 1 16 . 1 1 25 25 MET CB C 25 32.399 32.399 32.742 -0.344 19542
3998 1 16 . 1 1 25 25 MET H H 25 8.418 8.418 8.175 0.243 19542
3999 1 16 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.248 0.129 19542
4000 1 16 . 1 1 26 26 PRO CA C 26 63.841 63.841 62.636 1.205 19542
4001 1 16 . 1 1 26 26 PRO CB C 26 31.750 31.750 31.349 0.401 19542
4002 1 16 . 1 1 27 27 PHE N N 27 118.056 118.056 124.103 -6.047 19542
4003 1 16 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.783 -0.158 19542
4004 1 16 . 1 1 27 27 PHE CA C 27 57.332 57.332 55.765 1.567 19542
4005 1 16 . 1 1 27 27 PHE CB C 27 39.701 39.701 41.775 -2.074 19542
4006 1 16 . 1 1 27 27 PHE H H 27 7.988 7.988 8.643 -0.655 19542
4007 1 16 . 1 1 28 28 ARG N N 28 121.294 121.294 124.841 -3.547 19542
4008 1 16 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.050 0.009 19542
4009 1 16 . 1 1 28 28 ARG CA C 28 57.142 57.142 58.149 -1.007 19542
4010 1 16 . 1 1 28 28 ARG CB C 28 29.711 29.711 29.631 0.080 19542
4011 1 16 . 1 1 28 28 ARG H H 28 8.333 8.333 9.053 -0.720 19542
4012 1 16 . 1 1 29 29 ASN N N 29 116.243 116.243 115.775 0.468 19542
4013 1 16 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.396 0.200 19542
4014 1 16 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.222 -0.427 19542
4015 1 16 . 1 1 29 29 ASN CB C 29 38.239 38.239 37.804 0.435 19542
4016 1 16 . 1 1 29 29 ASN H H 29 8.356 8.356 8.864 -0.508 19542
4017 1 16 . 1 1 30 30 LEU N N 30 121.660 121.660 120.327 1.333 19542
4018 1 16 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.668 -0.223 19542
4019 1 16 . 1 1 30 30 LEU CA C 30 55.203 55.203 55.049 0.154 19542
4020 1 16 . 1 1 30 30 LEU CB C 30 42.982 42.982 43.560 -0.578 19542
4021 1 16 . 1 1 30 30 LEU H H 30 8.028 8.028 8.167 -0.139 19542
4022 1 16 . 1 1 31 31 LYS N N 31 120.928 120.928 126.982 -6.054 19542
4023 1 16 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.465 -0.087 19542
4024 1 16 . 1 1 31 31 LYS CA C 31 56.271 56.271 54.462 1.808 19542
4025 1 16 . 1 1 31 31 LYS CB C 31 32.230 32.230 32.486 -0.256 19542
4026 1 16 . 1 1 31 31 LYS H H 31 8.306 8.306 8.330 -0.024 19542
4027 1 16 . 1 1 32 32 LEU N N 32 122.843 122.843 127.870 -5.027 19542
4028 1 16 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.455 -0.009 19542
4029 1 16 . 1 1 32 32 LEU CA C 32 54.484 54.484 55.003 -0.519 19542
4030 1 16 . 1 1 32 32 LEU CB C 32 43.404 43.404 42.581 0.823 19542
4031 1 16 . 1 1 32 32 LEU H H 32 8.027 8.027 8.624 -0.597 19542
4032 1 16 . 1 1 33 33 ILE N N 33 123.311 123.311 128.236 -4.925 19542
4033 1 16 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.395 -0.012 19542
4034 1 16 . 1 1 33 33 ILE CA C 33 60.595 60.595 59.853 0.742 19542
4035 1 16 . 1 1 33 33 ILE CB C 33 38.303 38.303 37.430 0.873 19542
4036 1 16 . 1 1 33 33 ILE H H 33 8.327 8.327 7.989 0.338 19542
4037 1 16 . 1 1 34 34 LEU N N 34 128.669 128.669 128.795 -0.126 19542
4038 1 16 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.728 0.066 19542
4039 1 16 . 1 1 34 34 LEU CB C 34 42.873 42.873 41.907 0.966 19542
4040 1 16 . 1 1 34 34 LEU H H 34 8.880 8.880 8.354 0.526 19542
4041 1 16 . 1 1 35 35 GLN N N 35 121.600 121.600 120.615 0.985 19542
4042 1 16 . 1 1 35 35 GLN HA H 35 4.588 4.588 4.973 -0.385 19542
4043 1 16 . 1 1 35 35 GLN CA C 35 61.390 61.390 54.698 6.692 19542
4044 1 16 . 1 1 35 35 GLN CB C 35 33.866 33.866 30.406 3.460 19542
4045 1 16 . 1 1 35 35 GLN H H 35 8.210 8.210 8.493 -0.283 19542
4046 1 16 . 1 1 36 36 GLY N N 36 106.726 106.726 109.913 -3.187 19542
4047 1 16 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.181 2.697 19542
4048 1 16 . 1 1 36 36 GLY H H 36 6.121 6.121 7.640 -1.519 19542
4049 1 16 . 1 1 37 37 CYS N N 37 124.584 124.584 118.600 5.984 19542
4050 1 16 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.294 0.580 19542
4051 1 16 . 1 1 37 37 CYS CA C 37 55.955 55.955 57.900 -1.945 19542
4052 1 16 . 1 1 37 37 CYS CB C 37 48.202 48.202 29.487 18.715 19542
4053 1 16 . 1 1 37 37 CYS H H 37 8.505 8.505 8.593 -0.088 19542
4054 1 16 . 1 1 38 38 SER N N 38 115.036 115.036 118.165 -3.129 19542
4055 1 16 . 1 1 38 38 SER HA H 38 4.980 4.980 4.972 0.008 19542
4056 1 16 . 1 1 38 38 SER CA C 38 58.792 58.792 57.204 1.588 19542
4057 1 16 . 1 1 38 38 SER CB C 38 65.971 65.971 66.753 -0.782 19542
4058 1 16 . 1 1 38 38 SER H H 38 9.749 9.749 9.238 0.511 19542
4059 1 16 . 1 1 39 39 SER N N 39 117.276 117.276 120.404 -3.128 19542
4060 1 16 . 1 1 39 39 SER HA H 39 4.827 4.827 4.893 -0.066 19542
4061 1 16 . 1 1 39 39 SER CA C 39 60.040 60.040 59.335 0.705 19542
4062 1 16 . 1 1 39 39 SER CB C 39 63.784 63.784 63.701 0.083 19542
4063 1 16 . 1 1 39 39 SER H H 39 9.161 9.161 8.856 0.305 19542
4064 1 16 . 1 1 40 40 SER N N 40 115.041 115.041 115.111 -0.070 19542
4065 1 16 . 1 1 40 40 SER HA H 40 4.660 4.660 4.827 -0.167 19542
4066 1 16 . 1 1 40 40 SER CA C 40 55.868 55.868 56.837 -0.969 19542
4067 1 16 . 1 1 40 40 SER CB C 40 64.868 64.868 66.030 -1.162 19542
4068 1 16 . 1 1 40 40 SER H H 40 7.911 7.911 7.780 0.131 19542
4069 1 16 . 1 1 41 41 CYS N N 41 124.146 124.146 121.685 2.461 19542
4070 1 16 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.560 -0.251 19542
4071 1 16 . 1 1 41 41 CYS CA C 41 57.567 57.567 58.767 -1.200 19542
4072 1 16 . 1 1 41 41 CYS CB C 41 40.000 40.000 29.085 10.915 19542
4073 1 16 . 1 1 41 41 CYS H H 41 8.067 8.067 8.473 -0.406 19542
4074 1 16 . 1 1 42 42 SER N N 42 118.590 118.590 122.407 -3.817 19542
4075 1 16 . 1 1 42 42 SER HA H 42 4.611 4.611 4.457 0.154 19542
4076 1 16 . 1 1 42 42 SER CA C 42 59.020 59.020 57.182 1.838 19542
4077 1 16 . 1 1 42 42 SER CB C 42 64.112 64.112 63.404 0.708 19542
4078 1 16 . 1 1 42 42 SER H H 42 8.491 8.491 8.540 -0.049 19542
4079 1 16 . 1 1 43 43 GLU N N 43 118.830 118.830 127.678 -8.848 19542
4080 1 16 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.168 0.481 19542
4081 1 16 . 1 1 43 43 GLU CA C 43 56.856 56.856 57.072 -0.216 19542
4082 1 16 . 1 1 43 43 GLU CB C 43 29.206 29.206 29.184 0.022 19542
4083 1 16 . 1 1 43 43 GLU H H 43 8.861 8.861 8.669 0.192 19542
4084 1 16 . 1 1 44 44 THR N N 44 117.954 117.954 118.033 -0.079 19542
4085 1 16 . 1 1 44 44 THR HA H 44 4.619 4.619 4.628 -0.009 19542
4086 1 16 . 1 1 44 44 THR CB C 44 72.341 72.341 70.775 1.566 19542
4087 1 16 . 1 1 44 44 THR H H 44 9.030 9.030 7.859 1.171 19542
4088 1 16 . 1 1 45 45 GLU N N 45 127.100 127.100 118.041 9.059 19542
4089 1 16 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.210 -0.116 19542
4090 1 16 . 1 1 45 45 GLU CA C 45 58.934 58.934 57.495 1.439 19542
4091 1 16 . 1 1 45 45 GLU CB C 45 27.009 27.009 29.721 -2.712 19542
4092 1 16 . 1 1 45 45 GLU H H 45 8.837 8.837 8.610 0.227 19542
4093 1 16 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.523 0.379 19542
4094 1 16 . 1 1 46 46 ASN CA C 46 53.244 53.244 54.600 -1.356 19542
4095 1 16 . 1 1 46 46 ASN CB C 46 40.053 40.053 39.250 0.803 19542
4096 1 16 . 1 1 46 46 ASN H H 46 8.018 8.018 7.992 0.026 19542
4097 1 16 . 1 1 47 47 ASN N N 47 120.765 120.765 119.679 1.086 19542
4098 1 16 . 1 1 47 47 ASN HA H 47 5.362 5.362 5.429 -0.067 19542
4099 1 16 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.322 1.657 19542
4100 1 16 . 1 1 47 47 ASN CB C 47 41.749 41.749 40.329 1.420 19542
4101 1 16 . 1 1 47 47 ASN H H 47 7.835 7.835 7.945 -0.110 19542
4102 1 16 . 1 1 48 48 LYS N N 48 123.576 123.576 125.939 -2.363 19542
4103 1 16 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.667 0.175 19542
4104 1 16 . 1 1 48 48 LYS CB C 48 34.398 34.398 35.009 -0.611 19542
4105 1 16 . 1 1 48 48 LYS H H 48 8.548 8.548 8.802 -0.254 19542
4106 1 16 . 1 1 49 49 CYS N N 49 116.141 116.141 116.383 -0.242 19542
4107 1 16 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.975 -0.422 19542
4108 1 16 . 1 1 49 49 CYS CA C 49 53.386 53.386 56.127 -2.741 19542
4109 1 16 . 1 1 49 49 CYS CB C 49 44.935 44.935 28.512 16.423 19542
4110 1 16 . 1 1 49 49 CYS H H 49 8.873 8.873 8.406 0.467 19542
4111 1 16 . 1 1 50 50 CYS N N 50 118.484 118.484 121.567 -3.083 19542
4112 1 16 . 1 1 50 50 CYS HA H 50 5.265 5.265 4.951 0.314 19542
4113 1 16 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.319 -1.336 19542
4114 1 16 . 1 1 50 50 CYS CB C 50 46.111 46.111 31.031 15.080 19542
4115 1 16 . 1 1 50 50 CYS H H 50 9.389 9.389 9.159 0.230 19542
4116 1 16 . 1 1 51 51 SER N N 51 115.213 115.213 117.162 -1.949 19542
4117 1 16 . 1 1 51 51 SER HA H 51 5.016 5.016 4.774 0.242 19542
4118 1 16 . 1 1 51 51 SER CA C 51 58.118 58.118 58.768 -0.650 19542
4119 1 16 . 1 1 51 51 SER CB C 51 64.457 64.457 63.078 1.379 19542
4120 1 16 . 1 1 51 51 SER H H 51 9.290 9.290 8.740 0.550 19542
4121 1 16 . 1 1 52 52 THR N N 52 112.156 112.156 117.771 -5.615 19542
4122 1 16 . 1 1 52 52 THR HA H 52 4.692 4.692 4.438 0.254 19542
4123 1 16 . 1 1 52 52 THR CA C 52 59.835 59.835 61.409 -1.574 19542
4124 1 16 . 1 1 52 52 THR CB C 52 71.872 71.872 70.815 1.057 19542
4125 1 16 . 1 1 52 52 THR H H 52 7.624 7.624 7.443 0.181 19542
4126 1 16 . 1 1 53 53 ASP N N 53 119.869 119.869 124.283 -4.414 19542
4127 1 16 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.466 0.504 19542
4128 1 16 . 1 1 53 53 ASP CA C 53 55.485 55.485 56.079 -0.594 19542
4129 1 16 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.788 -0.066 19542
4130 1 16 . 1 1 53 53 ASP H H 53 8.410 8.410 8.637 -0.227 19542
4131 1 16 . 1 1 54 54 ARG N N 54 111.677 111.677 117.105 -5.428 19542
4132 1 16 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.504 -0.319 19542
4133 1 16 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.270 0.692 19542
4134 1 16 . 1 1 54 54 ARG CB C 54 28.429 28.429 26.866 1.563 19542
4135 1 16 . 1 1 54 54 ARG H H 54 9.306 9.306 8.551 0.755 19542
4136 1 16 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.656 -0.095 19542
4137 1 16 . 1 1 55 55 CYS CA C 55 57.814 57.814 58.893 -1.079 19542
4138 1 16 . 1 1 55 55 CYS CB C 55 46.236 46.236 26.811 19.425 19542
4139 1 16 . 1 1 55 55 CYS H H 55 7.995 7.995 7.997 -0.002 19542
4140 1 16 . 1 1 56 56 ASN N N 56 121.881 121.881 119.962 1.919 19542
4141 1 16 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.694 0.116 19542
4142 1 16 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.632 -0.266 19542
4143 1 16 . 1 1 56 56 ASN CB C 56 37.837 37.837 36.501 1.336 19542
4144 1 16 . 1 1 56 56 ASN H H 56 8.755 8.755 8.797 -0.042 19542
4145 1 17 . 1 1 2 2 LYS N N 2 126.352 126.352 123.092 3.260 19542
4146 1 17 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.049 0.341 19542
4147 1 17 . 1 1 2 2 LYS CA C 2 54.402 54.402 55.406 -1.004 19542
4148 1 17 . 1 1 2 2 LYS CB C 2 29.734 29.734 32.528 -2.794 19542
4149 1 17 . 1 1 2 2 LYS H H 2 8.381 8.381 8.434 -0.053 19542
4150 1 17 . 1 1 3 3 CYS N N 3 117.974 117.974 120.489 -2.515 19542
4151 1 17 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.554 0.405 19542
4152 1 17 . 1 1 3 3 CYS CA C 3 51.272 51.272 58.111 -6.839 19542
4153 1 17 . 1 1 3 3 CYS CB C 3 42.039 42.039 32.134 9.905 19542
4154 1 17 . 1 1 3 3 CYS H H 3 8.394 8.394 9.037 -0.643 19542
4155 1 17 . 1 1 4 4 PHE N N 4 120.016 120.016 121.030 -1.014 19542
4156 1 17 . 1 1 4 4 PHE HA H 4 4.606 4.606 4.952 -0.346 19542
4157 1 17 . 1 1 4 4 PHE CB C 4 39.719 39.719 37.064 2.655 19542
4158 1 17 . 1 1 4 4 PHE H H 4 9.550 9.550 9.161 0.389 19542
4159 1 17 . 1 1 5 5 GLN N N 5 120.517 120.517 122.665 -2.148 19542
4160 1 17 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.329 0.093 19542
4161 1 17 . 1 1 5 5 GLN CA C 5 56.003 56.003 57.630 -1.627 19542
4162 1 17 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.878 2.716 19542
4163 1 17 . 1 1 5 5 GLN H H 5 9.406 9.406 7.817 1.589 19542
4164 1 17 . 1 1 6 6 HIS N N 6 118.478 118.478 116.007 2.471 19542
4165 1 17 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.742 -0.264 19542
4166 1 17 . 1 1 6 6 HIS CA C 6 56.627 56.627 56.015 0.612 19542
4167 1 17 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.185 -2.209 19542
4168 1 17 . 1 1 6 6 HIS H H 6 8.827 8.827 7.726 1.101 19542
4169 1 17 . 1 1 7 7 GLY N N 7 103.072 103.072 106.119 -3.047 19542
4170 1 17 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.403 0.521 19542
4171 1 17 . 1 1 7 7 GLY H H 7 8.440 8.440 8.575 -0.135 19542
4172 1 17 . 1 1 8 8 LYS N N 8 119.909 119.909 121.285 -1.376 19542
4173 1 17 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.800 0.028 19542
4174 1 17 . 1 1 8 8 LYS CB C 8 35.493 35.493 34.650 0.843 19542
4175 1 17 . 1 1 8 8 LYS H H 8 7.703 7.703 7.930 -0.227 19542
4176 1 17 . 1 1 9 9 VAL N N 9 122.232 122.232 122.586 -0.354 19542
4177 1 17 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.690 0.122 19542
4178 1 17 . 1 1 9 9 VAL CA C 9 63.286 63.286 62.979 0.307 19542
4179 1 17 . 1 1 9 9 VAL CB C 9 26.812 26.812 30.803 -3.991 19542
4180 1 17 . 1 1 9 9 VAL H H 9 8.552 8.552 8.511 0.041 19542
4181 1 17 . 1 1 10 10 VAL N N 10 123.963 123.963 123.814 0.149 19542
4182 1 17 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.756 -0.150 19542
4183 1 17 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.372 1.020 19542
4184 1 17 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.410 -0.628 19542
4185 1 17 . 1 1 10 10 VAL H H 10 8.920 8.920 8.715 0.205 19542
4186 1 17 . 1 1 11 11 THR N N 11 118.572 118.572 119.654 -1.082 19542
4187 1 17 . 1 1 11 11 THR HA H 11 4.443 4.443 4.809 -0.366 19542
4188 1 17 . 1 1 11 11 THR CA C 11 62.719 62.719 63.184 -0.466 19542
4189 1 17 . 1 1 11 11 THR CB C 11 68.689 68.689 68.964 -0.275 19542
4190 1 17 . 1 1 11 11 THR H H 11 8.517 8.517 8.217 0.300 19542
4191 1 17 . 1 1 12 12 CYS N N 12 126.835 126.835 126.300 0.535 19542
4192 1 17 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.525 0.146 19542
4193 1 17 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.968 -5.932 19542
4194 1 17 . 1 1 12 12 CYS CB C 12 38.892 38.892 27.582 11.310 19542
4195 1 17 . 1 1 12 12 CYS H H 12 8.970 8.970 8.737 0.233 19542
4196 1 17 . 1 1 13 13 HIS N N 13 121.091 121.091 122.700 -1.609 19542
4197 1 17 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.458 0.191 19542
4198 1 17 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.061 -1.563 19542
4199 1 17 . 1 1 13 13 HIS H H 13 9.015 9.015 8.553 0.462 19542
4200 1 17 . 1 1 14 14 ARG N N 14 120.872 120.872 121.799 -0.927 19542
4201 1 17 . 1 1 14 14 ARG HA H 14 4.043 4.043 3.951 0.092 19542
4202 1 17 . 1 1 14 14 ARG CA C 14 58.962 58.962 58.336 0.626 19542
4203 1 17 . 1 1 14 14 ARG CB C 14 30.014 30.014 29.831 0.183 19542
4204 1 17 . 1 1 14 14 ARG H H 14 8.689 8.689 8.006 0.683 19542
4205 1 17 . 1 1 15 15 ASP N N 15 121.233 121.233 119.278 1.955 19542
4206 1 17 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.625 -0.122 19542
4207 1 17 . 1 1 15 15 ASP CA C 15 54.306 54.306 56.497 -2.191 19542
4208 1 17 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.289 -2.182 19542
4209 1 17 . 1 1 15 15 ASP H H 15 8.907 8.907 7.924 0.983 19542
4210 1 17 . 1 1 16 16 MET N N 16 119.073 119.073 118.074 0.999 19542
4211 1 17 . 1 1 16 16 MET HA H 16 4.415 4.415 4.785 -0.370 19542
4212 1 17 . 1 1 16 16 MET CA C 16 55.995 55.995 54.356 1.639 19542
4213 1 17 . 1 1 16 16 MET CB C 16 32.662 32.662 31.942 0.720 19542
4214 1 17 . 1 1 16 16 MET H H 16 7.811 7.811 7.760 0.051 19542
4215 1 17 . 1 1 17 17 LYS N N 17 120.187 120.187 122.845 -2.658 19542
4216 1 17 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.146 0.121 19542
4217 1 17 . 1 1 17 17 LYS CA C 17 55.889 55.889 56.525 -0.636 19542
4218 1 17 . 1 1 17 17 LYS CB C 17 34.106 34.106 32.863 1.243 19542
4219 1 17 . 1 1 17 17 LYS H H 17 7.763 7.763 8.357 -0.594 19542
4220 1 17 . 1 1 18 18 PHE N N 18 115.631 115.631 117.455 -1.824 19542
4221 1 17 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.251 -0.138 19542
4222 1 17 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.325 0.646 19542
4223 1 17 . 1 1 18 18 PHE CB C 18 43.018 43.018 41.937 1.081 19542
4224 1 17 . 1 1 18 18 PHE H H 18 8.252 8.252 8.019 0.233 19542
4225 1 17 . 1 1 19 19 CYS N N 19 115.508 115.508 121.675 -6.167 19542
4226 1 17 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.182 0.820 19542
4227 1 17 . 1 1 19 19 CYS CA C 19 52.258 52.258 58.033 -5.775 19542
4228 1 17 . 1 1 19 19 CYS CB C 19 38.627 38.627 27.715 10.912 19542
4229 1 17 . 1 1 19 19 CYS H H 19 9.343 9.343 9.353 -0.010 19542
4230 1 17 . 1 1 20 20 TYR N N 20 128.934 128.934 117.204 11.730 19542
4231 1 17 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.989 0.218 19542
4232 1 17 . 1 1 20 20 TYR CA C 20 55.701 55.701 54.745 0.956 19542
4233 1 17 . 1 1 20 20 TYR CB C 20 43.184 43.184 41.554 1.630 19542
4234 1 17 . 1 1 20 20 TYR H H 20 8.871 8.871 9.076 -0.205 19542
4235 1 17 . 1 1 21 21 HIS N N 21 122.079 122.079 122.977 -0.898 19542
4236 1 17 . 1 1 21 21 HIS HA H 21 5.283 5.283 5.122 0.161 19542
4237 1 17 . 1 1 21 21 HIS CA C 21 54.713 54.713 54.312 0.401 19542
4238 1 17 . 1 1 21 21 HIS CB C 21 31.719 31.719 32.547 -0.828 19542
4239 1 17 . 1 1 21 21 HIS H H 21 8.797 8.797 8.827 -0.030 19542
4240 1 17 . 1 1 22 22 ASN N N 22 128.444 128.444 128.538 -0.094 19542
4241 1 17 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.169 0.677 19542
4242 1 17 . 1 1 22 22 ASN CA C 22 52.512 52.512 53.849 -1.337 19542
4243 1 17 . 1 1 22 22 ASN CB C 22 40.821 40.821 39.230 1.591 19542
4244 1 17 . 1 1 22 22 ASN H H 22 9.823 9.823 8.985 0.838 19542
4245 1 17 . 1 1 23 23 THR N N 23 116.691 116.691 120.358 -3.667 19542
4246 1 17 . 1 1 23 23 THR HA H 23 4.604 4.604 4.640 -0.036 19542
4247 1 17 . 1 1 23 23 THR CA C 23 57.003 57.003 60.306 -3.303 19542
4248 1 17 . 1 1 23 23 THR CB C 23 69.344 69.344 70.767 -1.423 19542
4249 1 17 . 1 1 23 23 THR H H 23 8.561 8.561 8.847 -0.286 19542
4250 1 17 . 1 1 24 24 GLY N N 24 110.763 110.763 108.982 1.781 19542
4251 1 17 . 1 1 24 24 GLY CA C 24 44.993 44.993 45.662 -0.669 19542
4252 1 17 . 1 1 24 24 GLY H H 24 8.608 8.608 8.449 0.159 19542
4253 1 17 . 1 1 25 25 MET N N 25 120.520 120.520 121.808 -1.288 19542
4254 1 17 . 1 1 25 25 MET HA H 25 4.818 4.818 4.837 -0.019 19542
4255 1 17 . 1 1 25 25 MET CA C 25 53.892 53.892 53.039 0.853 19542
4256 1 17 . 1 1 25 25 MET CB C 25 32.399 32.399 33.170 -0.771 19542
4257 1 17 . 1 1 25 25 MET H H 25 8.418 8.418 8.287 0.131 19542
4258 1 17 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.542 -0.165 19542
4259 1 17 . 1 1 26 26 PRO CA C 26 63.841 63.841 63.214 0.627 19542
4260 1 17 . 1 1 26 26 PRO CB C 26 31.750 31.750 31.898 -0.147 19542
4261 1 17 . 1 1 27 27 PHE N N 27 118.056 118.056 122.855 -4.799 19542
4262 1 17 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.511 0.114 19542
4263 1 17 . 1 1 27 27 PHE CA C 27 57.332 57.332 58.095 -0.763 19542
4264 1 17 . 1 1 27 27 PHE CB C 27 39.701 39.701 39.534 0.167 19542
4265 1 17 . 1 1 27 27 PHE H H 27 7.988 7.988 8.634 -0.646 19542
4266 1 17 . 1 1 28 28 ARG N N 28 121.294 121.294 123.388 -2.094 19542
4267 1 17 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.468 -0.409 19542
4268 1 17 . 1 1 28 28 ARG CA C 28 57.142 57.142 55.590 1.552 19542
4269 1 17 . 1 1 28 28 ARG CB C 28 29.711 29.711 31.366 -1.655 19542
4270 1 17 . 1 1 28 28 ARG H H 28 8.333 8.333 8.691 -0.358 19542
4271 1 17 . 1 1 29 29 ASN N N 29 116.243 116.243 118.102 -1.859 19542
4272 1 17 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.377 0.219 19542
4273 1 17 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.144 -0.349 19542
4274 1 17 . 1 1 29 29 ASN CB C 29 38.239 38.239 38.310 -0.071 19542
4275 1 17 . 1 1 29 29 ASN H H 29 8.356 8.356 8.979 -0.623 19542
4276 1 17 . 1 1 30 30 LEU N N 30 121.660 121.660 119.446 2.214 19542
4277 1 17 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.579 -0.134 19542
4278 1 17 . 1 1 30 30 LEU CA C 30 55.203 55.203 54.763 0.440 19542
4279 1 17 . 1 1 30 30 LEU CB C 30 42.982 42.982 42.824 0.158 19542
4280 1 17 . 1 1 30 30 LEU H H 30 8.028 8.028 7.608 0.420 19542
4281 1 17 . 1 1 31 31 LYS N N 31 120.928 120.928 126.466 -5.538 19542
4282 1 17 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.480 -0.102 19542
4283 1 17 . 1 1 31 31 LYS CA C 31 56.271 56.271 55.423 0.848 19542
4284 1 17 . 1 1 31 31 LYS CB C 31 32.230 32.230 30.785 1.446 19542
4285 1 17 . 1 1 31 31 LYS H H 31 8.306 8.306 8.495 -0.189 19542
4286 1 17 . 1 1 32 32 LEU N N 32 122.843 122.843 123.339 -0.496 19542
4287 1 17 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.571 -0.125 19542
4288 1 17 . 1 1 32 32 LEU CA C 32 54.484 54.484 53.552 0.932 19542
4289 1 17 . 1 1 32 32 LEU CB C 32 43.404 43.404 43.835 -0.431 19542
4290 1 17 . 1 1 32 32 LEU H H 32 8.027 8.027 8.004 0.023 19542
4291 1 17 . 1 1 33 33 ILE N N 33 123.311 123.311 125.880 -2.569 19542
4292 1 17 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.191 0.192 19542
4293 1 17 . 1 1 33 33 ILE CA C 33 60.595 60.595 59.944 0.651 19542
4294 1 17 . 1 1 33 33 ILE CB C 33 38.303 38.303 39.186 -0.883 19542
4295 1 17 . 1 1 33 33 ILE H H 33 8.327 8.327 8.490 -0.163 19542
4296 1 17 . 1 1 34 34 LEU N N 34 128.669 128.669 131.223 -2.554 19542
4297 1 17 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.577 0.217 19542
4298 1 17 . 1 1 34 34 LEU CB C 34 42.873 42.873 41.267 1.606 19542
4299 1 17 . 1 1 34 34 LEU H H 34 8.880 8.880 8.907 -0.027 19542
4300 1 17 . 1 1 35 35 GLN N N 35 121.600 121.600 122.846 -1.246 19542
4301 1 17 . 1 1 35 35 GLN HA H 35 4.588 4.588 5.303 -0.715 19542
4302 1 17 . 1 1 35 35 GLN CA C 35 61.390 61.390 54.631 6.759 19542
4303 1 17 . 1 1 35 35 GLN CB C 35 33.866 33.866 31.482 2.384 19542
4304 1 17 . 1 1 35 35 GLN H H 35 8.210 8.210 8.057 0.153 19542
4305 1 17 . 1 1 36 36 GLY N N 36 106.726 106.726 109.872 -3.146 19542
4306 1 17 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.509 2.369 19542
4307 1 17 . 1 1 36 36 GLY H H 36 6.121 6.121 7.670 -1.549 19542
4308 1 17 . 1 1 37 37 CYS N N 37 124.584 124.584 118.754 5.830 19542
4309 1 17 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.350 0.524 19542
4310 1 17 . 1 1 37 37 CYS CA C 37 55.955 55.955 57.959 -2.004 19542
4311 1 17 . 1 1 37 37 CYS CB C 37 48.202 48.202 30.642 17.559 19542
4312 1 17 . 1 1 37 37 CYS H H 37 8.505 8.505 8.534 -0.029 19542
4313 1 17 . 1 1 38 38 SER N N 38 115.036 115.036 118.421 -3.385 19542
4314 1 17 . 1 1 38 38 SER HA H 38 4.980 4.980 5.078 -0.098 19542
4315 1 17 . 1 1 38 38 SER CA C 38 58.792 58.792 56.273 2.519 19542
4316 1 17 . 1 1 38 38 SER CB C 38 65.971 65.971 65.680 0.291 19542
4317 1 17 . 1 1 38 38 SER H H 38 9.749 9.749 9.393 0.356 19542
4318 1 17 . 1 1 39 39 SER N N 39 117.276 117.276 119.760 -2.484 19542
4319 1 17 . 1 1 39 39 SER HA H 39 4.827 4.827 4.886 -0.059 19542
4320 1 17 . 1 1 39 39 SER CA C 39 60.040 60.040 60.885 -0.845 19542
4321 1 17 . 1 1 39 39 SER CB C 39 63.784 63.784 63.764 0.020 19542
4322 1 17 . 1 1 39 39 SER H H 39 9.161 9.161 8.828 0.333 19542
4323 1 17 . 1 1 40 40 SER N N 40 115.041 115.041 114.988 0.053 19542
4324 1 17 . 1 1 40 40 SER HA H 40 4.660 4.660 4.766 -0.106 19542
4325 1 17 . 1 1 40 40 SER CA C 40 55.868 55.868 57.619 -1.751 19542
4326 1 17 . 1 1 40 40 SER CB C 40 64.868 64.868 65.965 -1.097 19542
4327 1 17 . 1 1 40 40 SER H H 40 7.911 7.911 7.734 0.177 19542
4328 1 17 . 1 1 41 41 CYS N N 41 124.146 124.146 121.972 2.174 19542
4329 1 17 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.567 -0.258 19542
4330 1 17 . 1 1 41 41 CYS CA C 41 57.567 57.567 58.303 -0.736 19542
4331 1 17 . 1 1 41 41 CYS CB C 41 40.000 40.000 30.306 9.694 19542
4332 1 17 . 1 1 41 41 CYS H H 41 8.067 8.067 8.383 -0.316 19542
4333 1 17 . 1 1 42 42 SER N N 42 118.590 118.590 120.842 -2.252 19542
4334 1 17 . 1 1 42 42 SER HA H 42 4.611 4.611 4.479 0.132 19542
4335 1 17 . 1 1 42 42 SER CA C 42 59.020 59.020 57.329 1.691 19542
4336 1 17 . 1 1 42 42 SER CB C 42 64.112 64.112 63.385 0.727 19542
4337 1 17 . 1 1 42 42 SER H H 42 8.491 8.491 8.551 -0.060 19542
4338 1 17 . 1 1 43 43 GLU N N 43 118.830 118.830 128.052 -9.222 19542
4339 1 17 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.007 0.642 19542
4340 1 17 . 1 1 43 43 GLU CA C 43 56.856 56.856 57.664 -0.808 19542
4341 1 17 . 1 1 43 43 GLU CB C 43 29.206 29.206 29.247 -0.042 19542
4342 1 17 . 1 1 43 43 GLU H H 43 8.861 8.861 8.716 0.145 19542
4343 1 17 . 1 1 44 44 THR N N 44 117.954 117.954 117.964 -0.010 19542
4344 1 17 . 1 1 44 44 THR HA H 44 4.619 4.619 4.650 -0.031 19542
4345 1 17 . 1 1 44 44 THR CB C 44 72.341 72.341 70.757 1.584 19542
4346 1 17 . 1 1 44 44 THR H H 44 9.030 9.030 8.306 0.724 19542
4347 1 17 . 1 1 45 45 GLU N N 45 127.100 127.100 119.250 7.850 19542
4348 1 17 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.156 -0.062 19542
4349 1 17 . 1 1 45 45 GLU CA C 45 58.934 58.934 58.429 0.505 19542
4350 1 17 . 1 1 45 45 GLU CB C 45 27.009 27.009 29.646 -2.637 19542
4351 1 17 . 1 1 45 45 GLU H H 45 8.837 8.837 8.777 0.060 19542
4352 1 17 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.785 0.117 19542
4353 1 17 . 1 1 46 46 ASN CA C 46 53.244 53.244 54.933 -1.689 19542
4354 1 17 . 1 1 46 46 ASN CB C 46 40.053 40.053 39.192 0.861 19542
4355 1 17 . 1 1 46 46 ASN H H 46 8.018 8.018 8.117 -0.099 19542
4356 1 17 . 1 1 47 47 ASN N N 47 120.765 120.765 118.620 2.145 19542
4357 1 17 . 1 1 47 47 ASN HA H 47 5.362 5.362 5.124 0.238 19542
4358 1 17 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.333 1.646 19542
4359 1 17 . 1 1 47 47 ASN CB C 47 41.749 41.749 40.080 1.669 19542
4360 1 17 . 1 1 47 47 ASN H H 47 7.835 7.835 8.114 -0.279 19542
4361 1 17 . 1 1 48 48 LYS N N 48 123.576 123.576 128.674 -5.098 19542
4362 1 17 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.894 -0.052 19542
4363 1 17 . 1 1 48 48 LYS CB C 48 34.398 34.398 33.048 1.350 19542
4364 1 17 . 1 1 48 48 LYS H H 48 8.548 8.548 8.540 0.008 19542
4365 1 17 . 1 1 49 49 CYS N N 49 116.141 116.141 124.311 -8.170 19542
4366 1 17 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.705 -0.152 19542
4367 1 17 . 1 1 49 49 CYS CA C 49 53.386 53.386 57.847 -4.461 19542
4368 1 17 . 1 1 49 49 CYS CB C 49 44.935 44.935 26.681 18.254 19542
4369 1 17 . 1 1 49 49 CYS H H 49 8.873 8.873 8.541 0.332 19542
4370 1 17 . 1 1 50 50 CYS N N 50 118.484 118.484 122.711 -4.227 19542
4371 1 17 . 1 1 50 50 CYS HA H 50 5.265 5.265 4.985 0.280 19542
4372 1 17 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.430 -1.447 19542
4373 1 17 . 1 1 50 50 CYS CB C 50 46.111 46.111 30.802 15.309 19542
4374 1 17 . 1 1 50 50 CYS H H 50 9.389 9.389 9.445 -0.056 19542
4375 1 17 . 1 1 51 51 SER N N 51 115.213 115.213 117.078 -1.865 19542
4376 1 17 . 1 1 51 51 SER HA H 51 5.016 5.016 4.939 0.077 19542
4377 1 17 . 1 1 51 51 SER CA C 51 58.118 58.118 57.855 0.263 19542
4378 1 17 . 1 1 51 51 SER CB C 51 64.457 64.457 62.760 1.697 19542
4379 1 17 . 1 1 51 51 SER H H 51 9.290 9.290 8.549 0.741 19542
4380 1 17 . 1 1 52 52 THR N N 52 112.156 112.156 117.645 -5.489 19542
4381 1 17 . 1 1 52 52 THR HA H 52 4.692 4.692 4.473 0.219 19542
4382 1 17 . 1 1 52 52 THR CA C 52 59.835 59.835 61.398 -1.563 19542
4383 1 17 . 1 1 52 52 THR CB C 52 71.872 71.872 72.030 -0.158 19542
4384 1 17 . 1 1 52 52 THR H H 52 7.624 7.624 7.308 0.316 19542
4385 1 17 . 1 1 53 53 ASP N N 53 119.869 119.869 121.790 -1.921 19542
4386 1 17 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.327 0.643 19542
4387 1 17 . 1 1 53 53 ASP CA C 53 55.485 55.485 55.643 -0.158 19542
4388 1 17 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.786 -0.064 19542
4389 1 17 . 1 1 53 53 ASP H H 53 8.410 8.410 8.725 -0.315 19542
4390 1 17 . 1 1 54 54 ARG N N 54 111.677 111.677 120.301 -8.624 19542
4391 1 17 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.510 -0.325 19542
4392 1 17 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.456 0.506 19542
4393 1 17 . 1 1 54 54 ARG CB C 54 28.429 28.429 27.039 1.390 19542
4394 1 17 . 1 1 54 54 ARG H H 54 9.306 9.306 8.846 0.460 19542
4395 1 17 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.471 0.090 19542
4396 1 17 . 1 1 55 55 CYS CA C 55 57.814 57.814 59.275 -1.461 19542
4397 1 17 . 1 1 55 55 CYS CB C 55 46.236 46.236 27.002 19.234 19542
4398 1 17 . 1 1 55 55 CYS H H 55 7.995 7.995 7.915 0.080 19542
4399 1 17 . 1 1 56 56 ASN N N 56 121.881 121.881 120.283 1.598 19542
4400 1 17 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.702 0.108 19542
4401 1 17 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.553 -0.187 19542
4402 1 17 . 1 1 56 56 ASN CB C 56 37.837 37.837 36.520 1.317 19542
4403 1 17 . 1 1 56 56 ASN H H 56 8.755 8.755 8.633 0.122 19542
4404 1 18 . 1 1 2 2 LYS N N 2 126.352 126.352 120.701 5.651 19542
4405 1 18 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.293 0.097 19542
4406 1 18 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.803 -0.401 19542
4407 1 18 . 1 1 2 2 LYS CB C 2 29.734 29.734 32.879 -3.145 19542
4408 1 18 . 1 1 2 2 LYS H H 2 8.381 8.381 8.198 0.183 19542
4409 1 18 . 1 1 3 3 CYS N N 3 117.974 117.974 120.931 -2.957 19542
4410 1 18 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.550 0.409 19542
4411 1 18 . 1 1 3 3 CYS CA C 3 51.272 51.272 58.290 -7.018 19542
4412 1 18 . 1 1 3 3 CYS CB C 3 42.039 42.039 32.375 9.664 19542
4413 1 18 . 1 1 3 3 CYS H H 3 8.394 8.394 8.797 -0.403 19542
4414 1 18 . 1 1 4 4 PHE N N 4 120.016 120.016 121.287 -1.271 19542
4415 1 18 . 1 1 4 4 PHE HA H 4 4.606 4.606 4.922 -0.316 19542
4416 1 18 . 1 1 4 4 PHE CB C 4 39.719 39.719 37.276 2.443 19542
4417 1 18 . 1 1 4 4 PHE H H 4 9.550 9.550 9.236 0.314 19542
4418 1 18 . 1 1 5 5 GLN N N 5 120.517 120.517 123.486 -2.969 19542
4419 1 18 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.209 0.213 19542
4420 1 18 . 1 1 5 5 GLN CA C 5 56.003 56.003 57.631 -1.628 19542
4421 1 18 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.860 2.734 19542
4422 1 18 . 1 1 5 5 GLN H H 5 9.406 9.406 7.955 1.451 19542
4423 1 18 . 1 1 6 6 HIS N N 6 118.478 118.478 115.063 3.415 19542
4424 1 18 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.705 -0.227 19542
4425 1 18 . 1 1 6 6 HIS CA C 6 56.627 56.627 56.581 0.046 19542
4426 1 18 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.833 -2.857 19542
4427 1 18 . 1 1 6 6 HIS H H 6 8.827 8.827 7.779 1.048 19542
4428 1 18 . 1 1 7 7 GLY N N 7 103.072 103.072 106.166 -3.094 19542
4429 1 18 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.095 0.829 19542
4430 1 18 . 1 1 7 7 GLY H H 7 8.440 8.440 8.556 -0.116 19542
4431 1 18 . 1 1 8 8 LYS N N 8 119.909 119.909 121.061 -1.152 19542
4432 1 18 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.813 0.015 19542
4433 1 18 . 1 1 8 8 LYS CB C 8 35.493 35.493 34.554 0.939 19542
4434 1 18 . 1 1 8 8 LYS H H 8 7.703 7.703 8.009 -0.306 19542
4435 1 18 . 1 1 9 9 VAL N N 9 122.232 122.232 122.232 0.000 19542
4436 1 18 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.621 0.191 19542
4437 1 18 . 1 1 9 9 VAL CA C 9 63.286 63.286 62.778 0.508 19542
4438 1 18 . 1 1 9 9 VAL CB C 9 26.812 26.812 31.388 -4.576 19542
4439 1 18 . 1 1 9 9 VAL H H 9 8.552 8.552 8.403 0.149 19542
4440 1 18 . 1 1 10 10 VAL N N 10 123.963 123.963 123.681 0.282 19542
4441 1 18 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.680 -0.074 19542
4442 1 18 . 1 1 10 10 VAL CA C 10 60.392 60.392 58.959 1.433 19542
4443 1 18 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.611 -0.829 19542
4444 1 18 . 1 1 10 10 VAL H H 10 8.920 8.920 8.656 0.264 19542
4445 1 18 . 1 1 11 11 THR N N 11 118.572 118.572 119.706 -1.134 19542
4446 1 18 . 1 1 11 11 THR HA H 11 4.443 4.443 4.439 0.004 19542
4447 1 18 . 1 1 11 11 THR CA C 11 62.719 62.719 63.685 -0.966 19542
4448 1 18 . 1 1 11 11 THR CB C 11 68.689 68.689 68.284 0.405 19542
4449 1 18 . 1 1 11 11 THR H H 11 8.517 8.517 8.304 0.213 19542
4450 1 18 . 1 1 12 12 CYS N N 12 126.835 126.835 126.868 -0.033 19542
4451 1 18 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.504 0.167 19542
4452 1 18 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.367 -5.331 19542
4453 1 18 . 1 1 12 12 CYS CB C 12 38.892 38.892 28.221 10.671 19542
4454 1 18 . 1 1 12 12 CYS H H 12 8.970 8.970 8.794 0.176 19542
4455 1 18 . 1 1 13 13 HIS N N 13 121.091 121.091 121.418 -0.327 19542
4456 1 18 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.463 0.186 19542
4457 1 18 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.244 -1.746 19542
4458 1 18 . 1 1 13 13 HIS H H 13 9.015 9.015 8.510 0.505 19542
4459 1 18 . 1 1 14 14 ARG N N 14 120.872 120.872 123.084 -2.212 19542
4460 1 18 . 1 1 14 14 ARG HA H 14 4.043 4.043 3.930 0.113 19542
4461 1 18 . 1 1 14 14 ARG CA C 14 58.962 58.962 58.365 0.597 19542
4462 1 18 . 1 1 14 14 ARG CB C 14 30.014 30.014 29.635 0.379 19542
4463 1 18 . 1 1 14 14 ARG H H 14 8.689 8.689 8.298 0.391 19542
4464 1 18 . 1 1 15 15 ASP N N 15 121.233 121.233 117.968 3.265 19542
4465 1 18 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.667 -0.164 19542
4466 1 18 . 1 1 15 15 ASP CA C 15 54.306 54.306 54.929 -0.623 19542
4467 1 18 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.755 -2.648 19542
4468 1 18 . 1 1 15 15 ASP H H 15 8.907 8.907 7.441 1.466 19542
4469 1 18 . 1 1 16 16 MET N N 16 119.073 119.073 119.018 0.055 19542
4470 1 18 . 1 1 16 16 MET HA H 16 4.415 4.415 4.645 -0.230 19542
4471 1 18 . 1 1 16 16 MET CA C 16 55.995 55.995 54.801 1.194 19542
4472 1 18 . 1 1 16 16 MET CB C 16 32.662 32.662 31.295 1.367 19542
4473 1 18 . 1 1 16 16 MET H H 16 7.811 7.811 7.690 0.121 19542
4474 1 18 . 1 1 17 17 LYS N N 17 120.187 120.187 122.263 -2.076 19542
4475 1 18 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.225 0.042 19542
4476 1 18 . 1 1 17 17 LYS CA C 17 55.889 55.889 56.691 -0.802 19542
4477 1 18 . 1 1 17 17 LYS CB C 17 34.106 34.106 33.386 0.719 19542
4478 1 18 . 1 1 17 17 LYS H H 17 7.763 7.763 8.229 -0.466 19542
4479 1 18 . 1 1 18 18 PHE N N 18 115.631 115.631 116.792 -1.161 19542
4480 1 18 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.037 0.076 19542
4481 1 18 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.338 0.633 19542
4482 1 18 . 1 1 18 18 PHE CB C 18 43.018 43.018 42.962 0.056 19542
4483 1 18 . 1 1 18 18 PHE H H 18 8.252 8.252 7.905 0.347 19542
4484 1 18 . 1 1 19 19 CYS N N 19 115.508 115.508 119.885 -4.377 19542
4485 1 18 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.123 0.879 19542
4486 1 18 . 1 1 19 19 CYS CA C 19 52.258 52.258 57.962 -5.704 19542
4487 1 18 . 1 1 19 19 CYS CB C 19 38.627 38.627 28.565 10.062 19542
4488 1 18 . 1 1 19 19 CYS H H 19 9.343 9.343 9.510 -0.167 19542
4489 1 18 . 1 1 20 20 TYR N N 20 128.934 128.934 117.447 11.487 19542
4490 1 18 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.881 0.326 19542
4491 1 18 . 1 1 20 20 TYR CA C 20 55.701 55.701 55.072 0.629 19542
4492 1 18 . 1 1 20 20 TYR CB C 20 43.184 43.184 41.227 1.957 19542
4493 1 18 . 1 1 20 20 TYR H H 20 8.871 8.871 9.213 -0.342 19542
4494 1 18 . 1 1 21 21 HIS N N 21 122.079 122.079 123.483 -1.404 19542
4495 1 18 . 1 1 21 21 HIS HA H 21 5.283 5.283 4.869 0.414 19542
4496 1 18 . 1 1 21 21 HIS CA C 21 54.713 54.713 53.906 0.807 19542
4497 1 18 . 1 1 21 21 HIS CB C 21 31.719 31.719 31.277 0.442 19542
4498 1 18 . 1 1 21 21 HIS H H 21 8.797 8.797 9.178 -0.381 19542
4499 1 18 . 1 1 22 22 ASN N N 22 128.444 128.444 127.333 1.111 19542
4500 1 18 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.398 0.448 19542
4501 1 18 . 1 1 22 22 ASN CA C 22 52.512 52.512 52.483 0.029 19542
4502 1 18 . 1 1 22 22 ASN CB C 22 40.821 40.821 41.900 -1.079 19542
4503 1 18 . 1 1 22 22 ASN H H 22 9.823 9.823 8.925 0.898 19542
4504 1 18 . 1 1 23 23 THR N N 23 116.691 116.691 118.299 -1.608 19542
4505 1 18 . 1 1 23 23 THR HA H 23 4.604 4.604 5.203 -0.599 19542
4506 1 18 . 1 1 23 23 THR CA C 23 57.003 57.003 59.312 -2.309 19542
4507 1 18 . 1 1 23 23 THR CB C 23 69.344 69.344 71.214 -1.870 19542
4508 1 18 . 1 1 23 23 THR H H 23 8.561 8.561 7.701 0.860 19542
4509 1 18 . 1 1 24 24 GLY N N 24 110.763 110.763 108.722 2.041 19542
4510 1 18 . 1 1 24 24 GLY CA C 24 44.993 44.993 44.269 0.724 19542
4511 1 18 . 1 1 24 24 GLY H H 24 8.608 8.608 8.261 0.347 19542
4512 1 18 . 1 1 25 25 MET N N 25 120.520 120.520 121.034 -0.514 19542
4513 1 18 . 1 1 25 25 MET HA H 25 4.818 4.818 4.703 0.115 19542
4514 1 18 . 1 1 25 25 MET CA C 25 53.892 53.892 53.658 0.234 19542
4515 1 18 . 1 1 25 25 MET CB C 25 32.399 32.399 33.025 -0.626 19542
4516 1 18 . 1 1 25 25 MET H H 25 8.418 8.418 8.335 0.083 19542
4517 1 18 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.446 -0.069 19542
4518 1 18 . 1 1 26 26 PRO CA C 26 63.841 63.841 63.116 0.725 19542
4519 1 18 . 1 1 26 26 PRO CB C 26 31.750 31.750 31.223 0.527 19542
4520 1 18 . 1 1 27 27 PHE N N 27 118.056 118.056 123.618 -5.562 19542
4521 1 18 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.738 -0.113 19542
4522 1 18 . 1 1 27 27 PHE CA C 27 57.332 57.332 56.066 1.266 19542
4523 1 18 . 1 1 27 27 PHE CB C 27 39.701 39.701 43.203 -3.502 19542
4524 1 18 . 1 1 27 27 PHE H H 27 7.988 7.988 7.859 0.129 19542
4525 1 18 . 1 1 28 28 ARG N N 28 121.294 121.294 123.879 -2.585 19542
4526 1 18 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.124 -0.065 19542
4527 1 18 . 1 1 28 28 ARG CA C 28 57.142 57.142 58.279 -1.137 19542
4528 1 18 . 1 1 28 28 ARG CB C 28 29.711 29.711 29.736 -0.025 19542
4529 1 18 . 1 1 28 28 ARG H H 28 8.333 8.333 8.980 -0.647 19542
4530 1 18 . 1 1 29 29 ASN N N 29 116.243 116.243 116.204 0.039 19542
4531 1 18 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.409 0.187 19542
4532 1 18 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.555 -0.760 19542
4533 1 18 . 1 1 29 29 ASN CB C 29 38.239 38.239 37.700 0.539 19542
4534 1 18 . 1 1 29 29 ASN H H 29 8.356 8.356 8.834 -0.478 19542
4535 1 18 . 1 1 30 30 LEU N N 30 121.660 121.660 122.619 -0.959 19542
4536 1 18 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.476 -0.031 19542
4537 1 18 . 1 1 30 30 LEU CA C 30 55.203 55.203 54.630 0.572 19542
4538 1 18 . 1 1 30 30 LEU CB C 30 42.982 42.982 41.798 1.184 19542
4539 1 18 . 1 1 30 30 LEU H H 30 8.028 8.028 7.920 0.108 19542
4540 1 18 . 1 1 31 31 LYS N N 31 120.928 120.928 125.643 -4.715 19542
4541 1 18 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.542 -0.164 19542
4542 1 18 . 1 1 31 31 LYS CA C 31 56.271 56.271 54.492 1.779 19542
4543 1 18 . 1 1 31 31 LYS CB C 31 32.230 32.230 32.046 0.184 19542
4544 1 18 . 1 1 31 31 LYS H H 31 8.306 8.306 7.952 0.354 19542
4545 1 18 . 1 1 32 32 LEU N N 32 122.843 122.843 126.538 -3.695 19542
4546 1 18 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.450 -0.004 19542
4547 1 18 . 1 1 32 32 LEU CA C 32 54.484 54.484 54.505 -0.021 19542
4548 1 18 . 1 1 32 32 LEU CB C 32 43.404 43.404 42.597 0.807 19542
4549 1 18 . 1 1 32 32 LEU H H 32 8.027 8.027 8.378 -0.351 19542
4550 1 18 . 1 1 33 33 ILE N N 33 123.311 123.311 127.603 -4.292 19542
4551 1 18 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.401 -0.018 19542
4552 1 18 . 1 1 33 33 ILE CA C 33 60.595 60.595 59.869 0.726 19542
4553 1 18 . 1 1 33 33 ILE CB C 33 38.303 38.303 36.970 1.333 19542
4554 1 18 . 1 1 33 33 ILE H H 33 8.327 8.327 7.995 0.332 19542
4555 1 18 . 1 1 34 34 LEU N N 34 128.669 128.669 127.848 0.821 19542
4556 1 18 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.720 0.074 19542
4557 1 18 . 1 1 34 34 LEU CB C 34 42.873 42.873 42.125 0.748 19542
4558 1 18 . 1 1 34 34 LEU H H 34 8.880 8.880 8.803 0.077 19542
4559 1 18 . 1 1 35 35 GLN N N 35 121.600 121.600 120.802 0.798 19542
4560 1 18 . 1 1 35 35 GLN HA H 35 4.588 4.588 4.972 -0.384 19542
4561 1 18 . 1 1 35 35 GLN CA C 35 61.390 61.390 55.222 6.168 19542
4562 1 18 . 1 1 35 35 GLN CB C 35 33.866 33.866 29.769 4.097 19542
4563 1 18 . 1 1 35 35 GLN H H 35 8.210 8.210 8.248 -0.038 19542
4564 1 18 . 1 1 36 36 GLY N N 36 106.726 106.726 110.281 -3.555 19542
4565 1 18 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.330 2.548 19542
4566 1 18 . 1 1 36 36 GLY H H 36 6.121 6.121 7.867 -1.746 19542
4567 1 18 . 1 1 37 37 CYS N N 37 124.584 124.584 117.768 6.816 19542
4568 1 18 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.225 0.649 19542
4569 1 18 . 1 1 37 37 CYS CA C 37 55.955 55.955 57.888 -1.933 19542
4570 1 18 . 1 1 37 37 CYS CB C 37 48.202 48.202 30.346 17.856 19542
4571 1 18 . 1 1 37 37 CYS H H 37 8.505 8.505 8.453 0.052 19542
4572 1 18 . 1 1 38 38 SER N N 38 115.036 115.036 116.673 -1.637 19542
4573 1 18 . 1 1 38 38 SER HA H 38 4.980 4.980 5.100 -0.120 19542
4574 1 18 . 1 1 38 38 SER CA C 38 58.792 58.792 56.565 2.227 19542
4575 1 18 . 1 1 38 38 SER CB C 38 65.971 65.971 64.877 1.094 19542
4576 1 18 . 1 1 38 38 SER H H 38 9.749 9.749 9.251 0.498 19542
4577 1 18 . 1 1 39 39 SER N N 39 117.276 117.276 117.795 -0.519 19542
4578 1 18 . 1 1 39 39 SER HA H 39 4.827 4.827 5.001 -0.174 19542
4579 1 18 . 1 1 39 39 SER CA C 39 60.040 60.040 59.027 1.013 19542
4580 1 18 . 1 1 39 39 SER CB C 39 63.784 63.784 63.879 -0.095 19542
4581 1 18 . 1 1 39 39 SER H H 39 9.161 9.161 8.741 0.420 19542
4582 1 18 . 1 1 40 40 SER N N 40 115.041 115.041 113.361 1.680 19542
4583 1 18 . 1 1 40 40 SER HA H 40 4.660 4.660 4.703 -0.043 19542
4584 1 18 . 1 1 40 40 SER CA C 40 55.868 55.868 56.475 -0.607 19542
4585 1 18 . 1 1 40 40 SER CB C 40 64.868 64.868 65.850 -0.982 19542
4586 1 18 . 1 1 40 40 SER H H 40 7.911 7.911 7.701 0.210 19542
4587 1 18 . 1 1 41 41 CYS N N 41 124.146 124.146 119.912 4.234 19542
4588 1 18 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.369 -0.060 19542
4589 1 18 . 1 1 41 41 CYS CA C 41 57.567 57.567 57.242 0.325 19542
4590 1 18 . 1 1 41 41 CYS CB C 41 40.000 40.000 27.184 12.816 19542
4591 1 18 . 1 1 41 41 CYS H H 41 8.067 8.067 8.066 0.001 19542
4592 1 18 . 1 1 42 42 SER N N 42 118.590 118.590 123.791 -5.201 19542
4593 1 18 . 1 1 42 42 SER HA H 42 4.611 4.611 4.335 0.276 19542
4594 1 18 . 1 1 42 42 SER CA C 42 59.020 59.020 58.201 0.819 19542
4595 1 18 . 1 1 42 42 SER CB C 42 64.112 64.112 63.051 1.061 19542
4596 1 18 . 1 1 42 42 SER H H 42 8.491 8.491 8.732 -0.241 19542
4597 1 18 . 1 1 43 43 GLU N N 43 118.830 118.830 127.279 -8.449 19542
4598 1 18 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.126 0.523 19542
4599 1 18 . 1 1 43 43 GLU CA C 43 56.856 56.856 57.183 -0.327 19542
4600 1 18 . 1 1 43 43 GLU CB C 43 29.206 29.206 28.347 0.859 19542
4601 1 18 . 1 1 43 43 GLU H H 43 8.861 8.861 8.426 0.435 19542
4602 1 18 . 1 1 44 44 THR N N 44 117.954 117.954 114.579 3.375 19542
4603 1 18 . 1 1 44 44 THR HA H 44 4.619 4.619 4.639 -0.020 19542
4604 1 18 . 1 1 44 44 THR CB C 44 72.341 72.341 71.155 1.186 19542
4605 1 18 . 1 1 44 44 THR H H 44 9.030 9.030 7.740 1.290 19542
4606 1 18 . 1 1 45 45 GLU N N 45 127.100 127.100 119.062 8.038 19542
4607 1 18 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.176 -0.082 19542
4608 1 18 . 1 1 45 45 GLU CA C 45 58.934 58.934 57.877 1.057 19542
4609 1 18 . 1 1 45 45 GLU CB C 45 27.009 27.009 29.893 -2.885 19542
4610 1 18 . 1 1 45 45 GLU H H 45 8.837 8.837 8.733 0.104 19542
4611 1 18 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.488 0.414 19542
4612 1 18 . 1 1 46 46 ASN CA C 46 53.244 53.244 55.393 -2.149 19542
4613 1 18 . 1 1 46 46 ASN CB C 46 40.053 40.053 38.744 1.309 19542
4614 1 18 . 1 1 46 46 ASN H H 46 8.018 8.018 8.474 -0.456 19542
4615 1 18 . 1 1 47 47 ASN N N 47 120.765 120.765 119.327 1.438 19542
4616 1 18 . 1 1 47 47 ASN HA H 47 5.362 5.362 4.977 0.385 19542
4617 1 18 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.709 1.270 19542
4618 1 18 . 1 1 47 47 ASN CB C 47 41.749 41.749 39.026 2.723 19542
4619 1 18 . 1 1 47 47 ASN H H 47 7.835 7.835 7.831 0.004 19542
4620 1 18 . 1 1 48 48 LYS N N 48 123.576 123.576 127.144 -3.568 19542
4621 1 18 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.510 0.332 19542
4622 1 18 . 1 1 48 48 LYS CB C 48 34.398 34.398 32.461 1.937 19542
4623 1 18 . 1 1 48 48 LYS H H 48 8.548 8.548 8.687 -0.139 19542
4624 1 18 . 1 1 49 49 CYS N N 49 116.141 116.141 120.777 -4.636 19542
4625 1 18 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.837 -0.284 19542
4626 1 18 . 1 1 49 49 CYS CA C 49 53.386 53.386 55.970 -2.584 19542
4627 1 18 . 1 1 49 49 CYS CB C 49 44.935 44.935 27.416 17.519 19542
4628 1 18 . 1 1 49 49 CYS H H 49 8.873 8.873 8.638 0.235 19542
4629 1 18 . 1 1 50 50 CYS N N 50 118.484 118.484 122.094 -3.610 19542
4630 1 18 . 1 1 50 50 CYS HA H 50 5.265 5.265 4.941 0.324 19542
4631 1 18 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.045 -1.062 19542
4632 1 18 . 1 1 50 50 CYS CB C 50 46.111 46.111 30.891 15.220 19542
4633 1 18 . 1 1 50 50 CYS H H 50 9.389 9.389 9.541 -0.152 19542
4634 1 18 . 1 1 51 51 SER N N 51 115.213 115.213 116.879 -1.666 19542
4635 1 18 . 1 1 51 51 SER HA H 51 5.016 5.016 4.745 0.271 19542
4636 1 18 . 1 1 51 51 SER CA C 51 58.118 58.118 57.754 0.364 19542
4637 1 18 . 1 1 51 51 SER CB C 51 64.457 64.457 62.367 2.090 19542
4638 1 18 . 1 1 51 51 SER H H 51 9.290 9.290 8.705 0.585 19542
4639 1 18 . 1 1 52 52 THR N N 52 112.156 112.156 117.495 -5.339 19542
4640 1 18 . 1 1 52 52 THR HA H 52 4.692 4.692 4.444 0.248 19542
4641 1 18 . 1 1 52 52 THR CA C 52 59.835 59.835 60.864 -1.029 19542
4642 1 18 . 1 1 52 52 THR CB C 52 71.872 71.872 71.818 0.054 19542
4643 1 18 . 1 1 52 52 THR H H 52 7.624 7.624 7.690 -0.066 19542
4644 1 18 . 1 1 53 53 ASP N N 53 119.869 119.869 122.997 -3.128 19542
4645 1 18 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.438 0.532 19542
4646 1 18 . 1 1 53 53 ASP CA C 53 55.485 55.485 56.353 -0.868 19542
4647 1 18 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.773 -0.051 19542
4648 1 18 . 1 1 53 53 ASP H H 53 8.410 8.410 8.565 -0.155 19542
4649 1 18 . 1 1 54 54 ARG N N 54 111.677 111.677 117.824 -6.147 19542
4650 1 18 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.610 -0.425 19542
4651 1 18 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.569 0.394 19542
4652 1 18 . 1 1 54 54 ARG CB C 54 28.429 28.429 27.232 1.198 19542
4653 1 18 . 1 1 54 54 ARG H H 54 9.306 9.306 8.882 0.424 19542
4654 1 18 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.432 0.129 19542
4655 1 18 . 1 1 55 55 CYS CA C 55 57.814 57.814 59.797 -1.983 19542
4656 1 18 . 1 1 55 55 CYS CB C 55 46.236 46.236 27.065 19.171 19542
4657 1 18 . 1 1 55 55 CYS H H 55 7.995 7.995 7.947 0.048 19542
4658 1 18 . 1 1 56 56 ASN N N 56 121.881 121.881 120.299 1.582 19542
4659 1 18 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.709 0.101 19542
4660 1 18 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.651 -0.285 19542
4661 1 18 . 1 1 56 56 ASN CB C 56 37.837 37.837 36.546 1.291 19542
4662 1 18 . 1 1 56 56 ASN H H 56 8.755 8.755 8.684 0.071 19542
4663 1 19 . 1 1 2 2 LYS N N 2 126.352 126.352 123.173 3.179 19542
4664 1 19 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.440 -0.050 19542
4665 1 19 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.417 -0.015 19542
4666 1 19 . 1 1 2 2 LYS CB C 2 29.734 29.734 33.380 -3.646 19542
4667 1 19 . 1 1 2 2 LYS H H 2 8.381 8.381 8.262 0.119 19542
4668 1 19 . 1 1 3 3 CYS N N 3 117.974 117.974 120.619 -2.645 19542
4669 1 19 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.586 0.373 19542
4670 1 19 . 1 1 3 3 CYS CA C 3 51.272 51.272 58.407 -7.135 19542
4671 1 19 . 1 1 3 3 CYS CB C 3 42.039 42.039 32.313 9.726 19542
4672 1 19 . 1 1 3 3 CYS H H 3 8.394 8.394 8.576 -0.182 19542
4673 1 19 . 1 1 4 4 PHE N N 4 120.016 120.016 121.313 -1.297 19542
4674 1 19 . 1 1 4 4 PHE HA H 4 4.606 4.606 5.051 -0.445 19542
4675 1 19 . 1 1 4 4 PHE CB C 4 39.719 39.719 37.415 2.304 19542
4676 1 19 . 1 1 4 4 PHE H H 4 9.550 9.550 9.277 0.273 19542
4677 1 19 . 1 1 5 5 GLN N N 5 120.517 120.517 121.269 -0.752 19542
4678 1 19 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.400 0.022 19542
4679 1 19 . 1 1 5 5 GLN CA C 5 56.003 56.003 58.092 -2.089 19542
4680 1 19 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.530 3.064 19542
4681 1 19 . 1 1 5 5 GLN H H 5 9.406 9.406 7.789 1.617 19542
4682 1 19 . 1 1 6 6 HIS N N 6 118.478 118.478 115.165 3.313 19542
4683 1 19 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.737 -0.259 19542
4684 1 19 . 1 1 6 6 HIS CA C 6 56.627 56.627 56.170 0.457 19542
4685 1 19 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.433 -2.457 19542
4686 1 19 . 1 1 6 6 HIS H H 6 8.827 8.827 7.693 1.134 19542
4687 1 19 . 1 1 7 7 GLY N N 7 103.072 103.072 104.626 -1.554 19542
4688 1 19 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.444 0.480 19542
4689 1 19 . 1 1 7 7 GLY H H 7 8.440 8.440 8.470 -0.030 19542
4690 1 19 . 1 1 8 8 LYS N N 8 119.909 119.909 120.559 -0.650 19542
4691 1 19 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.798 0.030 19542
4692 1 19 . 1 1 8 8 LYS CB C 8 35.493 35.493 35.318 0.175 19542
4693 1 19 . 1 1 8 8 LYS H H 8 7.703 7.703 7.936 -0.233 19542
4694 1 19 . 1 1 9 9 VAL N N 9 122.232 122.232 122.718 -0.486 19542
4695 1 19 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.637 0.175 19542
4696 1 19 . 1 1 9 9 VAL CA C 9 63.286 63.286 62.619 0.667 19542
4697 1 19 . 1 1 9 9 VAL CB C 9 26.812 26.812 30.656 -3.844 19542
4698 1 19 . 1 1 9 9 VAL H H 9 8.552 8.552 8.354 0.198 19542
4699 1 19 . 1 1 10 10 VAL N N 10 123.963 123.963 124.427 -0.464 19542
4700 1 19 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.606 0.000 19542
4701 1 19 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.193 1.199 19542
4702 1 19 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.116 -0.334 19542
4703 1 19 . 1 1 10 10 VAL H H 10 8.920 8.920 8.470 0.450 19542
4704 1 19 . 1 1 11 11 THR N N 11 118.572 118.572 119.795 -1.223 19542
4705 1 19 . 1 1 11 11 THR HA H 11 4.443 4.443 4.456 -0.013 19542
4706 1 19 . 1 1 11 11 THR CA C 11 62.719 62.719 63.684 -0.965 19542
4707 1 19 . 1 1 11 11 THR CB C 11 68.689 68.689 68.074 0.615 19542
4708 1 19 . 1 1 11 11 THR H H 11 8.517 8.517 8.221 0.296 19542
4709 1 19 . 1 1 12 12 CYS N N 12 126.835 126.835 126.530 0.305 19542
4710 1 19 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.448 0.223 19542
4711 1 19 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.677 -5.641 19542
4712 1 19 . 1 1 12 12 CYS CB C 12 38.892 38.892 27.094 11.798 19542
4713 1 19 . 1 1 12 12 CYS H H 12 8.970 8.970 8.696 0.274 19542
4714 1 19 . 1 1 13 13 HIS N N 13 121.091 121.091 123.563 -2.472 19542
4715 1 19 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.501 0.148 19542
4716 1 19 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.315 -1.817 19542
4717 1 19 . 1 1 13 13 HIS H H 13 9.015 9.015 8.653 0.362 19542
4718 1 19 . 1 1 14 14 ARG N N 14 120.872 120.872 120.223 0.649 19542
4719 1 19 . 1 1 14 14 ARG HA H 14 4.043 4.043 4.015 0.028 19542
4720 1 19 . 1 1 14 14 ARG CA C 14 58.962 58.962 57.919 1.043 19542
4721 1 19 . 1 1 14 14 ARG CB C 14 30.014 30.014 29.832 0.182 19542
4722 1 19 . 1 1 14 14 ARG H H 14 8.689 8.689 7.857 0.832 19542
4723 1 19 . 1 1 15 15 ASP N N 15 121.233 121.233 119.272 1.961 19542
4724 1 19 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.576 -0.073 19542
4725 1 19 . 1 1 15 15 ASP CA C 15 54.306 54.306 56.683 -2.377 19542
4726 1 19 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.240 -2.133 19542
4727 1 19 . 1 1 15 15 ASP H H 15 8.907 8.907 8.077 0.830 19542
4728 1 19 . 1 1 16 16 MET N N 16 119.073 119.073 118.382 0.691 19542
4729 1 19 . 1 1 16 16 MET HA H 16 4.415 4.415 4.617 -0.202 19542
4730 1 19 . 1 1 16 16 MET CA C 16 55.995 55.995 54.482 1.513 19542
4731 1 19 . 1 1 16 16 MET CB C 16 32.662 32.662 31.537 1.125 19542
4732 1 19 . 1 1 16 16 MET H H 16 7.811 7.811 7.610 0.201 19542
4733 1 19 . 1 1 17 17 LYS N N 17 120.187 120.187 122.601 -2.414 19542
4734 1 19 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.025 0.242 19542
4735 1 19 . 1 1 17 17 LYS CA C 17 55.889 55.889 57.210 -1.321 19542
4736 1 19 . 1 1 17 17 LYS CB C 17 34.106 34.106 32.904 1.202 19542
4737 1 19 . 1 1 17 17 LYS H H 17 7.763 7.763 8.193 -0.430 19542
4738 1 19 . 1 1 18 18 PHE N N 18 115.631 115.631 117.609 -1.978 19542
4739 1 19 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.200 -0.087 19542
4740 1 19 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.306 0.665 19542
4741 1 19 . 1 1 18 18 PHE CB C 18 43.018 43.018 41.933 1.085 19542
4742 1 19 . 1 1 18 18 PHE H H 18 8.252 8.252 8.073 0.179 19542
4743 1 19 . 1 1 19 19 CYS N N 19 115.508 115.508 121.612 -6.104 19542
4744 1 19 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.342 0.660 19542
4745 1 19 . 1 1 19 19 CYS CA C 19 52.258 52.258 58.092 -5.834 19542
4746 1 19 . 1 1 19 19 CYS CB C 19 38.627 38.627 27.860 10.767 19542
4747 1 19 . 1 1 19 19 CYS H H 19 9.343 9.343 9.441 -0.098 19542
4748 1 19 . 1 1 20 20 TYR N N 20 128.934 128.934 117.924 11.010 19542
4749 1 19 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.713 0.494 19542
4750 1 19 . 1 1 20 20 TYR CA C 20 55.701 55.701 54.997 0.704 19542
4751 1 19 . 1 1 20 20 TYR CB C 20 43.184 43.184 41.459 1.725 19542
4752 1 19 . 1 1 20 20 TYR H H 20 8.871 8.871 9.097 -0.226 19542
4753 1 19 . 1 1 21 21 HIS N N 21 122.079 122.079 122.166 -0.087 19542
4754 1 19 . 1 1 21 21 HIS HA H 21 5.283 5.283 4.824 0.459 19542
4755 1 19 . 1 1 21 21 HIS CA C 21 54.713 54.713 55.127 -0.414 19542
4756 1 19 . 1 1 21 21 HIS CB C 21 31.719 31.719 31.926 -0.207 19542
4757 1 19 . 1 1 21 21 HIS H H 21 8.797 8.797 9.211 -0.414 19542
4758 1 19 . 1 1 22 22 ASN N N 22 128.444 128.444 128.233 0.211 19542
4759 1 19 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.185 0.661 19542
4760 1 19 . 1 1 22 22 ASN CA C 22 52.512 52.512 51.898 0.614 19542
4761 1 19 . 1 1 22 22 ASN CB C 22 40.821 40.821 40.190 0.631 19542
4762 1 19 . 1 1 22 22 ASN H H 22 9.823 9.823 8.956 0.867 19542
4763 1 19 . 1 1 23 23 THR N N 23 116.691 116.691 119.552 -2.861 19542
4764 1 19 . 1 1 23 23 THR HA H 23 4.604 4.604 4.272 0.332 19542
4765 1 19 . 1 1 23 23 THR CA C 23 57.003 57.003 61.561 -4.558 19542
4766 1 19 . 1 1 23 23 THR CB C 23 69.344 69.344 69.933 -0.589 19542
4767 1 19 . 1 1 23 23 THR H H 23 8.561 8.561 7.677 0.884 19542
4768 1 19 . 1 1 24 24 GLY N N 24 110.763 110.763 114.777 -4.014 19542
4769 1 19 . 1 1 24 24 GLY CA C 24 44.993 44.993 44.735 0.258 19542
4770 1 19 . 1 1 24 24 GLY H H 24 8.608 8.608 8.257 0.351 19542
4771 1 19 . 1 1 25 25 MET N N 25 120.520 120.520 121.920 -1.400 19542
4772 1 19 . 1 1 25 25 MET HA H 25 4.818 4.818 4.395 0.423 19542
4773 1 19 . 1 1 25 25 MET CA C 25 53.892 53.892 52.772 1.120 19542
4774 1 19 . 1 1 25 25 MET CB C 25 32.399 32.399 31.646 0.753 19542
4775 1 19 . 1 1 25 25 MET H H 25 8.418 8.418 8.329 0.089 19542
4776 1 19 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.269 0.108 19542
4777 1 19 . 1 1 26 26 PRO CA C 26 63.841 63.841 63.656 0.185 19542
4778 1 19 . 1 1 26 26 PRO CB C 26 31.750 31.750 30.736 1.014 19542
4779 1 19 . 1 1 27 27 PHE N N 27 118.056 118.056 123.256 -5.200 19542
4780 1 19 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.714 -0.089 19542
4781 1 19 . 1 1 27 27 PHE CA C 27 57.332 57.332 56.155 1.177 19542
4782 1 19 . 1 1 27 27 PHE CB C 27 39.701 39.701 42.821 -3.120 19542
4783 1 19 . 1 1 27 27 PHE H H 27 7.988 7.988 7.872 0.116 19542
4784 1 19 . 1 1 28 28 ARG N N 28 121.294 121.294 124.004 -2.710 19542
4785 1 19 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.248 -0.189 19542
4786 1 19 . 1 1 28 28 ARG CA C 28 57.142 57.142 57.699 -0.557 19542
4787 1 19 . 1 1 28 28 ARG CB C 28 29.711 29.711 29.912 -0.201 19542
4788 1 19 . 1 1 28 28 ARG H H 28 8.333 8.333 8.988 -0.655 19542
4789 1 19 . 1 1 29 29 ASN N N 29 116.243 116.243 116.275 -0.032 19542
4790 1 19 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.371 0.225 19542
4791 1 19 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.744 -0.949 19542
4792 1 19 . 1 1 29 29 ASN CB C 29 38.239 38.239 37.854 0.385 19542
4793 1 19 . 1 1 29 29 ASN H H 29 8.356 8.356 8.956 -0.600 19542
4794 1 19 . 1 1 30 30 LEU N N 30 121.660 121.660 122.547 -0.887 19542
4795 1 19 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.568 -0.123 19542
4796 1 19 . 1 1 30 30 LEU CA C 30 55.203 55.203 54.477 0.726 19542
4797 1 19 . 1 1 30 30 LEU CB C 30 42.982 42.982 43.508 -0.526 19542
4798 1 19 . 1 1 30 30 LEU H H 30 8.028 8.028 7.418 0.610 19542
4799 1 19 . 1 1 31 31 LYS N N 31 120.928 120.928 126.042 -5.114 19542
4800 1 19 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.646 -0.268 19542
4801 1 19 . 1 1 31 31 LYS CA C 31 56.271 56.271 54.190 2.081 19542
4802 1 19 . 1 1 31 31 LYS CB C 31 32.230 32.230 31.877 0.353 19542
4803 1 19 . 1 1 31 31 LYS H H 31 8.306 8.306 8.469 -0.163 19542
4804 1 19 . 1 1 32 32 LEU N N 32 122.843 122.843 121.234 1.609 19542
4805 1 19 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.566 -0.120 19542
4806 1 19 . 1 1 32 32 LEU CA C 32 54.484 54.484 54.762 -0.278 19542
4807 1 19 . 1 1 32 32 LEU CB C 32 43.404 43.404 41.822 1.582 19542
4808 1 19 . 1 1 32 32 LEU H H 32 8.027 8.027 8.212 -0.185 19542
4809 1 19 . 1 1 33 33 ILE N N 33 123.311 123.311 126.322 -3.011 19542
4810 1 19 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.692 -0.309 19542
4811 1 19 . 1 1 33 33 ILE CA C 33 60.595 60.595 59.607 0.988 19542
4812 1 19 . 1 1 33 33 ILE CB C 33 38.303 38.303 40.493 -2.190 19542
4813 1 19 . 1 1 33 33 ILE H H 33 8.327 8.327 8.007 0.320 19542
4814 1 19 . 1 1 34 34 LEU N N 34 128.669 128.669 131.564 -2.895 19542
4815 1 19 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.801 -0.007 19542
4816 1 19 . 1 1 34 34 LEU CB C 34 42.873 42.873 42.105 0.768 19542
4817 1 19 . 1 1 34 34 LEU H H 34 8.880 8.880 9.161 -0.281 19542
4818 1 19 . 1 1 35 35 GLN N N 35 121.600 121.600 121.679 -0.079 19542
4819 1 19 . 1 1 35 35 GLN HA H 35 4.588 4.588 4.887 -0.299 19542
4820 1 19 . 1 1 35 35 GLN CA C 35 61.390 61.390 54.159 7.231 19542
4821 1 19 . 1 1 35 35 GLN CB C 35 33.866 33.866 30.928 2.938 19542
4822 1 19 . 1 1 35 35 GLN H H 35 8.210 8.210 8.467 -0.257 19542
4823 1 19 . 1 1 36 36 GLY N N 36 106.726 106.726 108.869 -2.143 19542
4824 1 19 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.775 2.103 19542
4825 1 19 . 1 1 36 36 GLY H H 36 6.121 6.121 6.975 -0.854 19542
4826 1 19 . 1 1 37 37 CYS N N 37 124.584 124.584 119.212 5.372 19542
4827 1 19 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.409 0.465 19542
4828 1 19 . 1 1 37 37 CYS CA C 37 55.955 55.955 58.120 -2.165 19542
4829 1 19 . 1 1 37 37 CYS CB C 37 48.202 48.202 29.823 18.379 19542
4830 1 19 . 1 1 37 37 CYS H H 37 8.505 8.505 8.161 0.344 19542
4831 1 19 . 1 1 38 38 SER N N 38 115.036 115.036 117.533 -2.497 19542
4832 1 19 . 1 1 38 38 SER HA H 38 4.980 4.980 5.016 -0.036 19542
4833 1 19 . 1 1 38 38 SER CA C 38 58.792 58.792 56.626 2.166 19542
4834 1 19 . 1 1 38 38 SER CB C 38 65.971 65.971 66.112 -0.141 19542
4835 1 19 . 1 1 38 38 SER H H 38 9.749 9.749 9.334 0.415 19542
4836 1 19 . 1 1 39 39 SER N N 39 117.276 117.276 116.853 0.423 19542
4837 1 19 . 1 1 39 39 SER HA H 39 4.827 4.827 4.928 -0.101 19542
4838 1 19 . 1 1 39 39 SER CA C 39 60.040 60.040 58.890 1.150 19542
4839 1 19 . 1 1 39 39 SER CB C 39 63.784 63.784 63.607 0.177 19542
4840 1 19 . 1 1 39 39 SER H H 39 9.161 9.161 8.797 0.364 19542
4841 1 19 . 1 1 40 40 SER N N 40 115.041 115.041 113.860 1.181 19542
4842 1 19 . 1 1 40 40 SER HA H 40 4.660 4.660 4.886 -0.226 19542
4843 1 19 . 1 1 40 40 SER CA C 40 55.868 55.868 57.037 -1.169 19542
4844 1 19 . 1 1 40 40 SER CB C 40 64.868 64.868 66.018 -1.150 19542
4845 1 19 . 1 1 40 40 SER H H 40 7.911 7.911 7.583 0.328 19542
4846 1 19 . 1 1 41 41 CYS N N 41 124.146 124.146 120.822 3.324 19542
4847 1 19 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.388 -0.079 19542
4848 1 19 . 1 1 41 41 CYS CA C 41 57.567 57.567 57.880 -0.313 19542
4849 1 19 . 1 1 41 41 CYS CB C 41 40.000 40.000 28.337 11.663 19542
4850 1 19 . 1 1 41 41 CYS H H 41 8.067 8.067 8.193 -0.126 19542
4851 1 19 . 1 1 42 42 SER N N 42 118.590 118.590 121.042 -2.452 19542
4852 1 19 . 1 1 42 42 SER HA H 42 4.611 4.611 4.386 0.225 19542
4853 1 19 . 1 1 42 42 SER CA C 42 59.020 59.020 58.126 0.894 19542
4854 1 19 . 1 1 42 42 SER CB C 42 64.112 64.112 63.195 0.917 19542
4855 1 19 . 1 1 42 42 SER H H 42 8.491 8.491 8.535 -0.044 19542
4856 1 19 . 1 1 43 43 GLU N N 43 118.830 118.830 125.978 -7.148 19542
4857 1 19 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.307 0.342 19542
4858 1 19 . 1 1 43 43 GLU CA C 43 56.856 56.856 56.323 0.533 19542
4859 1 19 . 1 1 43 43 GLU CB C 43 29.206 29.206 29.826 -0.620 19542
4860 1 19 . 1 1 43 43 GLU H H 43 8.861 8.861 8.429 0.432 19542
4861 1 19 . 1 1 44 44 THR N N 44 117.954 117.954 118.857 -0.903 19542
4862 1 19 . 1 1 44 44 THR HA H 44 4.619 4.619 4.327 0.292 19542
4863 1 19 . 1 1 44 44 THR CB C 44 72.341 72.341 69.199 3.142 19542
4864 1 19 . 1 1 44 44 THR H H 44 9.030 9.030 8.088 0.942 19542
4865 1 19 . 1 1 45 45 GLU N N 45 127.100 127.100 120.214 6.886 19542
4866 1 19 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.279 -0.185 19542
4867 1 19 . 1 1 45 45 GLU CA C 45 58.934 58.934 58.872 0.062 19542
4868 1 19 . 1 1 45 45 GLU CB C 45 27.009 27.009 29.496 -2.487 19542
4869 1 19 . 1 1 45 45 GLU H H 45 8.837 8.837 8.665 0.172 19542
4870 1 19 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.530 0.372 19542
4871 1 19 . 1 1 46 46 ASN CA C 46 53.244 53.244 54.235 -0.991 19542
4872 1 19 . 1 1 46 46 ASN CB C 46 40.053 40.053 39.052 1.001 19542
4873 1 19 . 1 1 46 46 ASN H H 46 8.018 8.018 8.295 -0.277 19542
4874 1 19 . 1 1 47 47 ASN N N 47 120.765 120.765 117.897 2.868 19542
4875 1 19 . 1 1 47 47 ASN HA H 47 5.362 5.362 4.879 0.483 19542
4876 1 19 . 1 1 47 47 ASN CA C 47 53.979 53.979 53.163 0.816 19542
4877 1 19 . 1 1 47 47 ASN CB C 47 41.749 41.749 38.703 3.046 19542
4878 1 19 . 1 1 47 47 ASN H H 47 7.835 7.835 8.127 -0.292 19542
4879 1 19 . 1 1 48 48 LYS N N 48 123.576 123.576 127.062 -3.486 19542
4880 1 19 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.663 0.179 19542
4881 1 19 . 1 1 48 48 LYS CB C 48 34.398 34.398 34.087 0.311 19542
4882 1 19 . 1 1 48 48 LYS H H 48 8.548 8.548 8.729 -0.181 19542
4883 1 19 . 1 1 49 49 CYS N N 49 116.141 116.141 116.510 -0.369 19542
4884 1 19 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.917 -0.364 19542
4885 1 19 . 1 1 49 49 CYS CA C 49 53.386 53.386 55.848 -2.462 19542
4886 1 19 . 1 1 49 49 CYS CB C 49 44.935 44.935 29.398 15.537 19542
4887 1 19 . 1 1 49 49 CYS H H 49 8.873 8.873 8.480 0.393 19542
4888 1 19 . 1 1 50 50 CYS N N 50 118.484 118.484 120.112 -1.628 19542
4889 1 19 . 1 1 50 50 CYS HA H 50 5.265 5.265 5.120 0.145 19542
4890 1 19 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.068 -1.085 19542
4891 1 19 . 1 1 50 50 CYS CB C 50 46.111 46.111 30.925 15.186 19542
4892 1 19 . 1 1 50 50 CYS H H 50 9.389 9.389 9.451 -0.062 19542
4893 1 19 . 1 1 51 51 SER N N 51 115.213 115.213 116.592 -1.379 19542
4894 1 19 . 1 1 51 51 SER HA H 51 5.016 5.016 4.769 0.247 19542
4895 1 19 . 1 1 51 51 SER CA C 51 58.118 58.118 58.306 -0.188 19542
4896 1 19 . 1 1 51 51 SER CB C 51 64.457 64.457 63.115 1.341 19542
4897 1 19 . 1 1 51 51 SER H H 51 9.290 9.290 8.657 0.633 19542
4898 1 19 . 1 1 52 52 THR N N 52 112.156 112.156 115.967 -3.811 19542
4899 1 19 . 1 1 52 52 THR HA H 52 4.692 4.692 4.473 0.219 19542
4900 1 19 . 1 1 52 52 THR CA C 52 59.835 59.835 61.221 -1.386 19542
4901 1 19 . 1 1 52 52 THR CB C 52 71.872 71.872 71.817 0.055 19542
4902 1 19 . 1 1 52 52 THR H H 52 7.624 7.624 7.468 0.156 19542
4903 1 19 . 1 1 53 53 ASP N N 53 119.869 119.869 122.939 -3.070 19542
4904 1 19 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.645 0.325 19542
4905 1 19 . 1 1 53 53 ASP CA C 53 55.485 55.485 55.479 0.006 19542
4906 1 19 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.679 0.043 19542
4907 1 19 . 1 1 53 53 ASP H H 53 8.410 8.410 8.720 -0.310 19542
4908 1 19 . 1 1 54 54 ARG N N 54 111.677 111.677 120.403 -8.726 19542
4909 1 19 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.673 -0.488 19542
4910 1 19 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.833 0.129 19542
4911 1 19 . 1 1 54 54 ARG CB C 54 28.429 28.429 27.208 1.221 19542
4912 1 19 . 1 1 54 54 ARG H H 54 9.306 9.306 8.877 0.429 19542
4913 1 19 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.378 0.183 19542
4914 1 19 . 1 1 55 55 CYS CA C 55 57.814 57.814 59.639 -1.825 19542
4915 1 19 . 1 1 55 55 CYS CB C 55 46.236 46.236 26.830 19.406 19542
4916 1 19 . 1 1 55 55 CYS H H 55 7.995 7.995 7.948 0.047 19542
4917 1 19 . 1 1 56 56 ASN N N 56 121.881 121.881 117.797 4.084 19542
4918 1 19 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.613 0.197 19542
4919 1 19 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.953 -0.587 19542
4920 1 19 . 1 1 56 56 ASN CB C 56 37.837 37.837 37.228 0.609 19542
4921 1 19 . 1 1 56 56 ASN H H 56 8.755 8.755 8.623 0.132 19542
4922 1 20 . 1 1 2 2 LYS N N 2 126.352 126.352 121.024 5.328 19542
4923 1 20 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.242 0.148 19542
4924 1 20 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.743 -0.341 19542
4925 1 20 . 1 1 2 2 LYS CB C 2 29.734 29.734 33.141 -3.407 19542
4926 1 20 . 1 1 2 2 LYS H H 2 8.381 8.381 8.294 0.087 19542
4927 1 20 . 1 1 3 3 CYS N N 3 117.974 117.974 120.622 -2.648 19542
4928 1 20 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.530 0.429 19542
4929 1 20 . 1 1 3 3 CYS CA C 3 51.272 51.272 58.325 -7.053 19542
4930 1 20 . 1 1 3 3 CYS CB C 3 42.039 42.039 32.236 9.803 19542
4931 1 20 . 1 1 3 3 CYS H H 3 8.394 8.394 8.735 -0.341 19542
4932 1 20 . 1 1 4 4 PHE N N 4 120.016 120.016 121.283 -1.267 19542
4933 1 20 . 1 1 4 4 PHE HA H 4 4.606 4.606 4.862 -0.257 19542
4934 1 20 . 1 1 4 4 PHE CB C 4 39.719 39.719 37.206 2.513 19542
4935 1 20 . 1 1 4 4 PHE H H 4 9.550 9.550 9.214 0.336 19542
4936 1 20 . 1 1 5 5 GLN N N 5 120.517 120.517 124.138 -3.621 19542
4937 1 20 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.393 0.029 19542
4938 1 20 . 1 1 5 5 GLN CA C 5 56.003 56.003 57.903 -1.900 19542
4939 1 20 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.777 2.817 19542
4940 1 20 . 1 1 5 5 GLN H H 5 9.406 9.406 8.059 1.347 19542
4941 1 20 . 1 1 6 6 HIS N N 6 118.478 118.478 116.098 2.380 19542
4942 1 20 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.594 -0.116 19542
4943 1 20 . 1 1 6 6 HIS CA C 6 56.627 56.627 56.395 0.232 19542
4944 1 20 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.623 -2.647 19542
4945 1 20 . 1 1 6 6 HIS H H 6 8.827 8.827 7.772 1.055 19542
4946 1 20 . 1 1 7 7 GLY N N 7 103.072 103.072 107.584 -4.512 19542
4947 1 20 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.040 0.884 19542
4948 1 20 . 1 1 7 7 GLY H H 7 8.440 8.440 8.505 -0.065 19542
4949 1 20 . 1 1 8 8 LYS N N 8 119.909 119.909 120.301 -0.392 19542
4950 1 20 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.886 -0.058 19542
4951 1 20 . 1 1 8 8 LYS CB C 8 35.493 35.493 34.907 0.586 19542
4952 1 20 . 1 1 8 8 LYS H H 8 7.703 7.703 7.976 -0.273 19542
4953 1 20 . 1 1 9 9 VAL N N 9 122.232 122.232 122.512 -0.280 19542
4954 1 20 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.665 0.147 19542
4955 1 20 . 1 1 9 9 VAL CA C 9 63.286 63.286 62.637 0.649 19542
4956 1 20 . 1 1 9 9 VAL CB C 9 26.812 26.812 31.174 -4.362 19542
4957 1 20 . 1 1 9 9 VAL H H 9 8.552 8.552 8.431 0.121 19542
4958 1 20 . 1 1 10 10 VAL N N 10 123.963 123.963 123.766 0.197 19542
4959 1 20 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.685 -0.079 19542
4960 1 20 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.154 1.238 19542
4961 1 20 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.422 -0.640 19542
4962 1 20 . 1 1 10 10 VAL H H 10 8.920 8.920 8.744 0.176 19542
4963 1 20 . 1 1 11 11 THR N N 11 118.572 118.572 119.576 -1.004 19542
4964 1 20 . 1 1 11 11 THR HA H 11 4.443 4.443 4.289 0.154 19542
4965 1 20 . 1 1 11 11 THR CA C 11 62.719 62.719 63.081 -0.361 19542
4966 1 20 . 1 1 11 11 THR CB C 11 68.689 68.689 68.273 0.416 19542
4967 1 20 . 1 1 11 11 THR H H 11 8.517 8.517 8.261 0.256 19542
4968 1 20 . 1 1 12 12 CYS N N 12 126.835 126.835 126.361 0.474 19542
4969 1 20 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.518 0.153 19542
4970 1 20 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.720 -5.684 19542
4971 1 20 . 1 1 12 12 CYS CB C 12 38.892 38.892 27.845 11.047 19542
4972 1 20 . 1 1 12 12 CYS H H 12 8.970 8.970 8.501 0.469 19542
4973 1 20 . 1 1 13 13 HIS N N 13 121.091 121.091 121.976 -0.885 19542
4974 1 20 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.583 0.066 19542
4975 1 20 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.692 -2.194 19542
4976 1 20 . 1 1 13 13 HIS H H 13 9.015 9.015 8.488 0.527 19542
4977 1 20 . 1 1 14 14 ARG N N 14 120.872 120.872 122.233 -1.361 19542
4978 1 20 . 1 1 14 14 ARG HA H 14 4.043 4.043 3.877 0.166 19542
4979 1 20 . 1 1 14 14 ARG CA C 14 58.962 58.962 58.989 -0.026 19542
4980 1 20 . 1 1 14 14 ARG CB C 14 30.014 30.014 29.785 0.230 19542
4981 1 20 . 1 1 14 14 ARG H H 14 8.689 8.689 8.193 0.496 19542
4982 1 20 . 1 1 15 15 ASP N N 15 121.233 121.233 120.125 1.108 19542
4983 1 20 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.564 -0.061 19542
4984 1 20 . 1 1 15 15 ASP CA C 15 54.306 54.306 56.904 -2.598 19542
4985 1 20 . 1 1 15 15 ASP CB C 15 39.107 39.107 40.891 -1.784 19542
4986 1 20 . 1 1 15 15 ASP H H 15 8.907 8.907 7.960 0.947 19542
4987 1 20 . 1 1 16 16 MET N N 16 119.073 119.073 118.153 0.920 19542
4988 1 20 . 1 1 16 16 MET HA H 16 4.415 4.415 4.698 -0.283 19542
4989 1 20 . 1 1 16 16 MET CA C 16 55.995 55.995 54.902 1.093 19542
4990 1 20 . 1 1 16 16 MET CB C 16 32.662 32.662 31.797 0.865 19542
4991 1 20 . 1 1 16 16 MET H H 16 7.811 7.811 7.743 0.068 19542
4992 1 20 . 1 1 17 17 LYS N N 17 120.187 120.187 121.521 -1.334 19542
4993 1 20 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.296 -0.029 19542
4994 1 20 . 1 1 17 17 LYS CA C 17 55.889 55.889 56.106 -0.217 19542
4995 1 20 . 1 1 17 17 LYS CB C 17 34.106 34.106 33.594 0.512 19542
4996 1 20 . 1 1 17 17 LYS H H 17 7.763 7.763 8.256 -0.493 19542
4997 1 20 . 1 1 18 18 PHE N N 18 115.631 115.631 118.569 -2.938 19542
4998 1 20 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.109 0.004 19542
4999 1 20 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.525 0.446 19542
5000 1 20 . 1 1 18 18 PHE CB C 18 43.018 43.018 41.908 1.110 19542
5001 1 20 . 1 1 18 18 PHE H H 18 8.252 8.252 8.013 0.239 19542
5002 1 20 . 1 1 19 19 CYS N N 19 115.508 115.508 122.540 -7.032 19542
5003 1 20 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.025 0.977 19542
5004 1 20 . 1 1 19 19 CYS CA C 19 52.258 52.258 58.299 -6.041 19542
5005 1 20 . 1 1 19 19 CYS CB C 19 38.627 38.627 27.630 10.997 19542
5006 1 20 . 1 1 19 19 CYS H H 19 9.343 9.343 9.441 -0.098 19542
5007 1 20 . 1 1 20 20 TYR N N 20 128.934 128.934 118.520 10.414 19542
5008 1 20 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.846 0.361 19542
5009 1 20 . 1 1 20 20 TYR CA C 20 55.701 55.701 54.936 0.765 19542
5010 1 20 . 1 1 20 20 TYR CB C 20 43.184 43.184 41.231 1.953 19542
5011 1 20 . 1 1 20 20 TYR H H 20 8.871 8.871 9.044 -0.173 19542
5012 1 20 . 1 1 21 21 HIS N N 21 122.079 122.079 124.054 -1.975 19542
5013 1 20 . 1 1 21 21 HIS HA H 21 5.283 5.283 5.053 0.230 19542
5014 1 20 . 1 1 21 21 HIS CA C 21 54.713 54.713 54.273 0.440 19542
5015 1 20 . 1 1 21 21 HIS CB C 21 31.719 31.719 31.859 -0.140 19542
5016 1 20 . 1 1 21 21 HIS H H 21 8.797 8.797 9.397 -0.600 19542
5017 1 20 . 1 1 22 22 ASN N N 22 128.444 128.444 128.004 0.440 19542
5018 1 20 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.013 0.833 19542
5019 1 20 . 1 1 22 22 ASN CA C 22 52.512 52.512 53.129 -0.617 19542
5020 1 20 . 1 1 22 22 ASN CB C 22 40.821 40.821 40.529 0.292 19542
5021 1 20 . 1 1 22 22 ASN H H 22 9.823 9.823 9.146 0.677 19542
5022 1 20 . 1 1 23 23 THR N N 23 116.691 116.691 118.844 -2.153 19542
5023 1 20 . 1 1 23 23 THR HA H 23 4.604 4.604 4.013 0.591 19542
5024 1 20 . 1 1 23 23 THR CA C 23 57.003 57.003 62.928 -5.925 19542
5025 1 20 . 1 1 23 23 THR CB C 23 69.344 69.344 68.994 0.350 19542
5026 1 20 . 1 1 23 23 THR H H 23 8.561 8.561 8.722 -0.161 19542
5027 1 20 . 1 1 24 24 GLY N N 24 110.763 110.763 110.481 0.282 19542
5028 1 20 . 1 1 24 24 GLY CA C 24 44.993 44.993 44.804 0.189 19542
5029 1 20 . 1 1 24 24 GLY H H 24 8.608 8.608 8.034 0.574 19542
5030 1 20 . 1 1 25 25 MET N N 25 120.520 120.520 119.728 0.792 19542
5031 1 20 . 1 1 25 25 MET HA H 25 4.818 4.818 4.631 0.187 19542
5032 1 20 . 1 1 25 25 MET CA C 25 53.892 53.892 52.401 1.491 19542
5033 1 20 . 1 1 25 25 MET CB C 25 32.399 32.399 35.138 -2.739 19542
5034 1 20 . 1 1 25 25 MET H H 25 8.418 8.418 8.343 0.075 19542
5035 1 20 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.435 -0.058 19542
5036 1 20 . 1 1 26 26 PRO CA C 26 63.841 63.841 62.765 1.076 19542
5037 1 20 . 1 1 26 26 PRO CB C 26 31.750 31.750 31.432 0.318 19542
5038 1 20 . 1 1 27 27 PHE N N 27 118.056 118.056 124.587 -6.531 19542
5039 1 20 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.838 -0.213 19542
5040 1 20 . 1 1 27 27 PHE CA C 27 57.332 57.332 56.034 1.298 19542
5041 1 20 . 1 1 27 27 PHE CB C 27 39.701 39.701 43.419 -3.718 19542
5042 1 20 . 1 1 27 27 PHE H H 27 7.988 7.988 7.888 0.100 19542
5043 1 20 . 1 1 28 28 ARG N N 28 121.294 121.294 122.631 -1.337 19542
5044 1 20 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.113 -0.054 19542
5045 1 20 . 1 1 28 28 ARG CA C 28 57.142 57.142 57.720 -0.578 19542
5046 1 20 . 1 1 28 28 ARG CB C 28 29.711 29.711 29.625 0.086 19542
5047 1 20 . 1 1 28 28 ARG H H 28 8.333 8.333 8.948 -0.615 19542
5048 1 20 . 1 1 29 29 ASN N N 29 116.243 116.243 115.360 0.883 19542
5049 1 20 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.390 0.206 19542
5050 1 20 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.282 -0.487 19542
5051 1 20 . 1 1 29 29 ASN CB C 29 38.239 38.239 37.880 0.359 19542
5052 1 20 . 1 1 29 29 ASN H H 29 8.356 8.356 8.874 -0.518 19542
5053 1 20 . 1 1 30 30 LEU N N 30 121.660 121.660 121.286 0.374 19542
5054 1 20 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.620 -0.175 19542
5055 1 20 . 1 1 30 30 LEU CA C 30 55.203 55.203 53.986 1.217 19542
5056 1 20 . 1 1 30 30 LEU CB C 30 42.982 42.982 42.397 0.585 19542
5057 1 20 . 1 1 30 30 LEU H H 30 8.028 8.028 7.915 0.113 19542
5058 1 20 . 1 1 31 31 LYS N N 31 120.928 120.928 127.302 -6.374 19542
5059 1 20 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.402 -0.024 19542
5060 1 20 . 1 1 31 31 LYS CA C 31 56.271 56.271 55.025 1.246 19542
5061 1 20 . 1 1 31 31 LYS CB C 31 32.230 32.230 31.284 0.946 19542
5062 1 20 . 1 1 31 31 LYS H H 31 8.306 8.306 8.526 -0.220 19542
5063 1 20 . 1 1 32 32 LEU N N 32 122.843 122.843 128.245 -5.402 19542
5064 1 20 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.550 -0.104 19542
5065 1 20 . 1 1 32 32 LEU CA C 32 54.484 54.484 54.865 -0.381 19542
5066 1 20 . 1 1 32 32 LEU CB C 32 43.404 43.404 42.727 0.677 19542
5067 1 20 . 1 1 32 32 LEU H H 32 8.027 8.027 7.982 0.045 19542
5068 1 20 . 1 1 33 33 ILE N N 33 123.311 123.311 127.132 -3.821 19542
5069 1 20 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.517 -0.134 19542
5070 1 20 . 1 1 33 33 ILE CA C 33 60.595 60.595 59.417 1.178 19542
5071 1 20 . 1 1 33 33 ILE CB C 33 38.303 38.303 39.517 -1.214 19542
5072 1 20 . 1 1 33 33 ILE H H 33 8.327 8.327 8.040 0.287 19542
5073 1 20 . 1 1 34 34 LEU N N 34 128.669 128.669 129.171 -0.502 19542
5074 1 20 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.863 -0.069 19542
5075 1 20 . 1 1 34 34 LEU CB C 34 42.873 42.873 42.079 0.794 19542
5076 1 20 . 1 1 34 34 LEU H H 34 8.880 8.880 8.582 0.298 19542
5077 1 20 . 1 1 35 35 GLN N N 35 121.600 121.600 122.474 -0.874 19542
5078 1 20 . 1 1 35 35 GLN HA H 35 4.588 4.588 5.127 -0.539 19542
5079 1 20 . 1 1 35 35 GLN CA C 35 61.390 61.390 55.134 6.256 19542
5080 1 20 . 1 1 35 35 GLN CB C 35 33.866 33.866 30.280 3.586 19542
5081 1 20 . 1 1 35 35 GLN H H 35 8.210 8.210 8.473 -0.263 19542
5082 1 20 . 1 1 36 36 GLY N N 36 106.726 106.726 110.183 -3.457 19542
5083 1 20 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.571 2.307 19542
5084 1 20 . 1 1 36 36 GLY H H 36 6.121 6.121 7.867 -1.746 19542
5085 1 20 . 1 1 37 37 CYS N N 37 124.584 124.584 118.851 5.733 19542
5086 1 20 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.209 0.665 19542
5087 1 20 . 1 1 37 37 CYS CA C 37 55.955 55.955 58.042 -2.087 19542
5088 1 20 . 1 1 37 37 CYS CB C 37 48.202 48.202 30.495 17.707 19542
5089 1 20 . 1 1 37 37 CYS H H 37 8.505 8.505 8.527 -0.022 19542
5090 1 20 . 1 1 38 38 SER N N 38 115.036 115.036 118.452 -3.416 19542
5091 1 20 . 1 1 38 38 SER HA H 38 4.980 4.980 5.103 -0.123 19542
5092 1 20 . 1 1 38 38 SER CA C 38 58.792 58.792 56.677 2.115 19542
5093 1 20 . 1 1 38 38 SER CB C 38 65.971 65.971 66.232 -0.261 19542
5094 1 20 . 1 1 38 38 SER H H 38 9.749 9.749 9.386 0.363 19542
5095 1 20 . 1 1 39 39 SER N N 39 117.276 117.276 118.933 -1.657 19542
5096 1 20 . 1 1 39 39 SER HA H 39 4.827 4.827 4.814 0.013 19542
5097 1 20 . 1 1 39 39 SER CA C 39 60.040 60.040 59.575 0.465 19542
5098 1 20 . 1 1 39 39 SER CB C 39 63.784 63.784 63.772 0.012 19542
5099 1 20 . 1 1 39 39 SER H H 39 9.161 9.161 8.847 0.314 19542
5100 1 20 . 1 1 40 40 SER N N 40 115.041 115.041 114.224 0.817 19542
5101 1 20 . 1 1 40 40 SER HA H 40 4.660 4.660 4.566 0.094 19542
5102 1 20 . 1 1 40 40 SER CA C 40 55.868 55.868 56.770 -0.902 19542
5103 1 20 . 1 1 40 40 SER CB C 40 64.868 64.868 65.111 -0.243 19542
5104 1 20 . 1 1 40 40 SER H H 40 7.911 7.911 7.597 0.314 19542
5105 1 20 . 1 1 41 41 CYS N N 41 124.146 124.146 122.806 1.340 19542
5106 1 20 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.533 -0.224 19542
5107 1 20 . 1 1 41 41 CYS CA C 41 57.567 57.567 58.232 -0.665 19542
5108 1 20 . 1 1 41 41 CYS CB C 41 40.000 40.000 26.776 13.224 19542
5109 1 20 . 1 1 41 41 CYS H H 41 8.067 8.067 8.036 0.031 19542
5110 1 20 . 1 1 42 42 SER N N 42 118.590 118.590 124.527 -5.937 19542
5111 1 20 . 1 1 42 42 SER HA H 42 4.611 4.611 4.379 0.232 19542
5112 1 20 . 1 1 42 42 SER CA C 42 59.020 59.020 57.421 1.599 19542
5113 1 20 . 1 1 42 42 SER CB C 42 64.112 64.112 62.444 1.668 19542
5114 1 20 . 1 1 42 42 SER H H 42 8.491 8.491 8.767 -0.276 19542
5115 1 20 . 1 1 43 43 GLU N N 43 118.830 118.830 126.872 -8.042 19542
5116 1 20 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.118 0.531 19542
5117 1 20 . 1 1 43 43 GLU CA C 43 56.856 56.856 57.571 -0.715 19542
5118 1 20 . 1 1 43 43 GLU CB C 43 29.206 29.206 28.944 0.262 19542
5119 1 20 . 1 1 43 43 GLU H H 43 8.861 8.861 8.124 0.737 19542
5120 1 20 . 1 1 44 44 THR N N 44 117.954 117.954 117.757 0.197 19542
5121 1 20 . 1 1 44 44 THR HA H 44 4.619 4.619 4.532 0.087 19542
5122 1 20 . 1 1 44 44 THR CB C 44 72.341 72.341 71.159 1.182 19542
5123 1 20 . 1 1 44 44 THR H H 44 9.030 9.030 7.864 1.166 19542
5124 1 20 . 1 1 45 45 GLU N N 45 127.100 127.100 120.731 6.369 19542
5125 1 20 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.277 -0.183 19542
5126 1 20 . 1 1 45 45 GLU CA C 45 58.934 58.934 58.187 0.747 19542
5127 1 20 . 1 1 45 45 GLU CB C 45 27.009 27.009 29.622 -2.613 19542
5128 1 20 . 1 1 45 45 GLU H H 45 8.837 8.837 8.672 0.165 19542
5129 1 20 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.643 0.259 19542
5130 1 20 . 1 1 46 46 ASN CA C 46 53.244 53.244 53.109 0.135 19542
5131 1 20 . 1 1 46 46 ASN CB C 46 40.053 40.053 39.010 1.043 19542
5132 1 20 . 1 1 46 46 ASN H H 46 8.018 8.018 8.317 -0.299 19542
5133 1 20 . 1 1 47 47 ASN N N 47 120.765 120.765 117.705 3.060 19542
5134 1 20 . 1 1 47 47 ASN HA H 47 5.362 5.362 5.165 0.197 19542
5135 1 20 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.460 1.519 19542
5136 1 20 . 1 1 47 47 ASN CB C 47 41.749 41.749 41.242 0.507 19542
5137 1 20 . 1 1 47 47 ASN H H 47 7.835 7.835 7.373 0.462 19542
5138 1 20 . 1 1 48 48 LYS N N 48 123.576 123.576 126.581 -3.005 19542
5139 1 20 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.667 0.175 19542
5140 1 20 . 1 1 48 48 LYS CB C 48 34.398 34.398 33.972 0.426 19542
5141 1 20 . 1 1 48 48 LYS H H 48 8.548 8.548 9.012 -0.464 19542
5142 1 20 . 1 1 49 49 CYS N N 49 116.141 116.141 119.722 -3.581 19542
5143 1 20 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.828 -0.275 19542
5144 1 20 . 1 1 49 49 CYS CA C 49 53.386 53.386 55.888 -2.502 19542
5145 1 20 . 1 1 49 49 CYS CB C 49 44.935 44.935 28.099 16.836 19542
5146 1 20 . 1 1 49 49 CYS H H 49 8.873 8.873 8.715 0.158 19542
5147 1 20 . 1 1 50 50 CYS N N 50 118.484 118.484 122.693 -4.209 19542
5148 1 20 . 1 1 50 50 CYS HA H 50 5.265 5.265 4.938 0.327 19542
5149 1 20 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.706 -1.724 19542
5150 1 20 . 1 1 50 50 CYS CB C 50 46.111 46.111 30.473 15.639 19542
5151 1 20 . 1 1 50 50 CYS H H 50 9.389 9.389 9.319 0.070 19542
5152 1 20 . 1 1 51 51 SER N N 51 115.213 115.213 116.357 -1.144 19542
5153 1 20 . 1 1 51 51 SER HA H 51 5.016 5.016 4.800 0.216 19542
5154 1 20 . 1 1 51 51 SER CA C 51 58.118 58.118 58.095 0.023 19542
5155 1 20 . 1 1 51 51 SER CB C 51 64.457 64.457 62.698 1.759 19542
5156 1 20 . 1 1 51 51 SER H H 51 9.290 9.290 8.569 0.721 19542
5157 1 20 . 1 1 52 52 THR N N 52 112.156 112.156 118.338 -6.182 19542
5158 1 20 . 1 1 52 52 THR HA H 52 4.692 4.692 4.481 0.211 19542
5159 1 20 . 1 1 52 52 THR CA C 52 59.835 59.835 61.120 -1.285 19542
5160 1 20 . 1 1 52 52 THR CB C 52 71.872 71.872 71.420 0.452 19542
5161 1 20 . 1 1 52 52 THR H H 52 7.624 7.624 7.313 0.311 19542
5162 1 20 . 1 1 53 53 ASP N N 53 119.869 119.869 121.317 -1.448 19542
5163 1 20 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.459 0.511 19542
5164 1 20 . 1 1 53 53 ASP CA C 53 55.485 55.485 54.990 0.495 19542
5165 1 20 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.957 -0.235 19542
5166 1 20 . 1 1 53 53 ASP H H 53 8.410 8.410 8.621 -0.211 19542
5167 1 20 . 1 1 54 54 ARG N N 54 111.677 111.677 116.173 -4.496 19542
5168 1 20 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.663 -0.478 19542
5169 1 20 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.765 0.197 19542
5170 1 20 . 1 1 54 54 ARG CB C 54 28.429 28.429 27.291 1.138 19542
5171 1 20 . 1 1 54 54 ARG H H 54 9.306 9.306 8.572 0.734 19542
5172 1 20 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.416 0.145 19542
5173 1 20 . 1 1 55 55 CYS CA C 55 57.814 57.814 59.268 -1.454 19542
5174 1 20 . 1 1 55 55 CYS CB C 55 46.236 46.236 26.629 19.607 19542
5175 1 20 . 1 1 55 55 CYS H H 55 7.995 7.995 7.821 0.174 19542
5176 1 20 . 1 1 56 56 ASN N N 56 121.881 121.881 116.729 5.152 19542
5177 1 20 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.662 0.148 19542
5178 1 20 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.310 0.056 19542
5179 1 20 . 1 1 56 56 ASN CB C 56 37.837 37.837 37.143 0.694 19542
5180 1 20 . 1 1 56 56 ASN H H 56 8.755 8.755 8.303 0.452 19542
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 52 3.594 0.959 3.497 19542
2 1 1 "Average Difference" HA 58 0.308 -0.084 0.299 19542
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19542
4 1 1 "Average Difference" CA 49 2.390 0.278 2.398 19542
5 1 1 "Average Difference" CB 52 5.827 -2.163 5.463 19542
6 1 1 "Average Difference" HN 54 0.462 -0.102 0.455 19542
7 1 2 "Average Difference" N 52 3.845 0.789 3.799 19542
8 1 2 "Average Difference" HA 58 0.281 -0.100 0.265 19542
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19542
10 1 2 "Average Difference" CA 49 2.024 0.132 2.040 19542
11 1 2 "Average Difference" CB 52 6.009 -2.366 5.578 19542
12 1 2 "Average Difference" HN 54 0.501 -0.123 0.490 19542
13 1 3 "Average Difference" N 52 3.832 0.920 3.757 19542
14 1 3 "Average Difference" HA 58 0.295 -0.100 0.280 19542
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19542
16 1 3 "Average Difference" CA 49 2.264 0.211 2.278 19542
17 1 3 "Average Difference" CB 52 5.952 -2.268 5.556 19542
18 1 3 "Average Difference" HN 54 0.564 -0.161 0.545 19542
19 1 4 "Average Difference" N 52 3.450 0.750 3.400 19542
20 1 4 "Average Difference" HA 58 0.297 -0.109 0.279 19542
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19542
22 1 4 "Average Difference" CA 49 2.179 0.288 2.183 19542
23 1 4 "Average Difference" CB 52 5.907 -2.204 5.534 19542
24 1 4 "Average Difference" HN 54 0.557 -0.159 0.539 19542
25 1 5 "Average Difference" N 52 3.317 0.697 3.275 19542
26 1 5 "Average Difference" HA 58 0.314 -0.068 0.309 19542
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19542
28 1 5 "Average Difference" CA 49 2.129 0.279 2.132 19542
29 1 5 "Average Difference" CB 52 5.830 -2.240 5.435 19542
30 1 5 "Average Difference" HN 54 0.543 -0.126 0.533 19542
31 1 6 "Average Difference" N 52 3.654 0.868 3.584 19542
32 1 6 "Average Difference" HA 58 0.289 -0.047 0.287 19542
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19542
34 1 6 "Average Difference" CA 49 2.237 0.164 2.254 19542
35 1 6 "Average Difference" CB 52 5.969 -2.185 5.609 19542
36 1 6 "Average Difference" HN 54 0.540 -0.118 0.532 19542
37 1 7 "Average Difference" N 52 3.833 1.292 3.644 19542
38 1 7 "Average Difference" HA 58 0.313 -0.111 0.295 19542
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19542
40 1 7 "Average Difference" CA 49 2.422 0.393 2.414 19542
41 1 7 "Average Difference" CB 52 5.912 -2.307 5.497 19542
42 1 7 "Average Difference" HN 54 0.465 -0.071 0.464 19542
43 1 8 "Average Difference" N 52 3.370 0.639 3.342 19542
44 1 8 "Average Difference" HA 58 0.311 -0.098 0.298 19542
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19542
46 1 8 "Average Difference" CA 49 2.356 0.347 2.354 19542
47 1 8 "Average Difference" CB 52 5.853 -2.124 5.507 19542
48 1 8 "Average Difference" HN 54 0.528 -0.118 0.519 19542
49 1 9 "Average Difference" N 52 3.621 1.034 3.504 19542
50 1 9 "Average Difference" HA 58 0.290 -0.049 0.288 19542
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19542
52 1 9 "Average Difference" CA 49 2.092 0.193 2.105 19542
53 1 9 "Average Difference" CB 52 5.895 -2.374 5.448 19542
54 1 9 "Average Difference" HN 54 0.610 -0.193 0.584 19542
55 1 10 "Average Difference" N 52 3.316 0.976 3.200 19542
56 1 10 "Average Difference" HA 58 0.244 -0.049 0.241 19542
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19542
58 1 10 "Average Difference" CA 49 2.108 0.227 2.117 19542
59 1 10 "Average Difference" CB 52 5.901 -2.187 5.534 19542
60 1 10 "Average Difference" HN 54 0.534 -0.120 0.525 19542
61 1 11 "Average Difference" N 52 3.619 0.828 3.558 19542
62 1 11 "Average Difference" HA 58 0.313 -0.086 0.304 19542
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19542
64 1 11 "Average Difference" CA 49 2.143 0.252 2.151 19542
65 1 11 "Average Difference" CB 52 5.949 -2.390 5.501 19542
66 1 11 "Average Difference" HN 54 0.559 -0.128 0.549 19542
67 1 12 "Average Difference" N 52 3.630 0.821 3.570 19542
68 1 12 "Average Difference" HA 58 0.280 -0.057 0.276 19542
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19542
70 1 12 "Average Difference" CA 49 2.184 0.204 2.197 19542
71 1 12 "Average Difference" CB 52 5.925 -2.294 5.516 19542
72 1 12 "Average Difference" HN 54 0.515 -0.135 0.502 19542
73 1 13 "Average Difference" N 52 3.569 1.272 3.367 19542
74 1 13 "Average Difference" HA 58 0.294 -0.097 0.280 19542
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19542
76 1 13 "Average Difference" CA 49 2.342 0.381 2.335 19542
77 1 13 "Average Difference" CB 52 5.873 -2.291 5.461 19542
78 1 13 "Average Difference" HN 54 0.546 -0.174 0.522 19542
79 1 14 "Average Difference" N 52 3.786 1.123 3.651 19542
80 1 14 "Average Difference" HA 58 0.293 -0.101 0.277 19542
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19542
82 1 14 "Average Difference" CA 49 2.381 0.334 2.382 19542
83 1 14 "Average Difference" CB 52 5.855 -2.341 5.419 19542
84 1 14 "Average Difference" HN 54 0.497 -0.165 0.473 19542
85 1 15 "Average Difference" N 52 3.682 1.006 3.576 19542
86 1 15 "Average Difference" HA 58 0.267 -0.051 0.265 19542
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19542
88 1 15 "Average Difference" CA 49 2.292 0.381 2.283 19542
89 1 15 "Average Difference" CB 52 5.729 -2.188 5.346 19542
90 1 15 "Average Difference" HN 54 0.454 -0.109 0.445 19542
91 1 16 "Average Difference" N 52 3.686 0.891 3.612 19542
92 1 16 "Average Difference" HA 58 0.277 -0.077 0.269 19542
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19542
94 1 16 "Average Difference" CA 49 2.172 0.215 2.184 19542
95 1 16 "Average Difference" CB 52 5.939 -2.239 5.554 19542
96 1 16 "Average Difference" HN 54 0.557 -0.095 0.554 19542
97 1 17 "Average Difference" N 52 3.882 1.211 3.724 19542
98 1 17 "Average Difference" HA 58 0.301 -0.057 0.298 19542
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19542
100 1 17 "Average Difference" CA 49 2.270 0.390 2.260 19542
101 1 17 "Average Difference" CB 52 5.860 -2.263 5.458 19542
102 1 17 "Average Difference" HN 54 0.494 -0.092 0.490 19542
103 1 18 "Average Difference" N 52 3.772 0.758 3.731 19542
104 1 18 "Average Difference" HA 58 0.300 -0.075 0.293 19542
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19542
106 1 18 "Average Difference" CA 49 2.080 0.217 2.090 19542
107 1 18 "Average Difference" CB 52 5.951 -2.341 5.525 19542
108 1 18 "Average Difference" HN 54 0.544 -0.140 0.531 19542
109 1 19 "Average Difference" N 52 3.457 0.786 3.399 19542
110 1 19 "Average Difference" HA 58 0.290 -0.082 0.281 19542
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19542
112 1 19 "Average Difference" CA 49 2.267 0.313 2.268 19542
113 1 19 "Average Difference" CB 52 5.880 -2.284 5.472 19542
114 1 19 "Average Difference" HN 54 0.492 -0.165 0.468 19542
115 1 20 "Average Difference" N 52 3.748 1.088 3.622 19542
116 1 20 "Average Difference" HA 58 0.307 -0.094 0.294 19542
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19542
118 1 20 "Average Difference" CA 49 2.276 0.290 2.281 19542
119 1 20 "Average Difference" CB 52 5.986 -2.246 5.603 19542
120 1 20 "Average Difference" HN 54 0.524 -0.141 0.510 19542
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 19542
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 LYS N N 2 126.352 126.352 121.498 4.854 19542
2 1 . 1 1 2 2 LYS HA H 2 5.390 5.390 5.294 0.096 19542
3 1 . 1 1 2 2 LYS CA C 2 54.402 54.402 54.654 -0.252 19542
4 1 . 1 1 2 2 LYS CB C 2 29.734 29.734 33.062 -3.328 19542
5 1 . 1 1 2 2 LYS H H 2 8.381 8.381 8.582 -0.201 19542
6 1 . 1 1 3 3 CYS N N 3 117.974 117.974 120.752 -2.778 19542
7 1 . 1 1 3 3 CYS HA H 3 4.959 4.959 4.568 0.391 19542
8 1 . 1 1 3 3 CYS CA C 3 51.272 51.272 58.083 -6.811 19542
9 1 . 1 1 3 3 CYS CB C 3 42.039 42.039 32.088 9.951 19542
10 1 . 1 1 3 3 CYS H H 3 8.394 8.394 8.758 -0.364 19542
11 1 . 1 1 4 4 PHE N N 4 120.016 120.016 121.045 -1.029 19542
12 1 . 1 1 4 4 PHE HA H 4 4.606 4.606 4.939 -0.333 19542
13 1 . 1 1 4 4 PHE CB C 4 39.719 39.719 37.091 2.628 19542
14 1 . 1 1 4 4 PHE H H 4 9.550 9.550 9.244 0.306 19542
15 1 . 1 1 5 5 GLN N N 5 120.517 120.517 122.891 -2.374 19542
16 1 . 1 1 5 5 GLN HA H 5 4.422 4.422 4.276 0.146 19542
17 1 . 1 1 5 5 GLN CA C 5 56.003 56.003 57.821 -1.818 19542
18 1 . 1 1 5 5 GLN CB C 5 32.594 32.594 29.651 2.943 19542
19 1 . 1 1 5 5 GLN H H 5 9.406 9.406 7.938 1.468 19542
20 1 . 1 1 6 6 HIS N N 6 118.478 118.478 116.362 2.116 19542
21 1 . 1 1 6 6 HIS HA H 6 4.478 4.478 4.679 -0.201 19542
22 1 . 1 1 6 6 HIS CA C 6 56.627 56.627 56.021 0.606 19542
23 1 . 1 1 6 6 HIS CB C 6 27.976 27.976 30.443 -2.467 19542
24 1 . 1 1 6 6 HIS H H 6 8.827 8.827 7.605 1.222 19542
25 1 . 1 1 7 7 GLY N N 7 103.072 103.072 106.785 -3.713 19542
26 1 . 1 1 7 7 GLY CA C 7 45.924 45.924 45.391 0.533 19542
27 1 . 1 1 7 7 GLY H H 7 8.440 8.440 8.546 -0.106 19542
28 1 . 1 1 8 8 LYS N N 8 119.909 119.909 120.764 -0.855 19542
29 1 . 1 1 8 8 LYS HA H 8 4.828 4.828 4.825 0.003 19542
30 1 . 1 1 8 8 LYS CB C 8 35.493 35.493 34.726 0.767 19542
31 1 . 1 1 8 8 LYS H H 8 7.703 7.703 7.897 -0.194 19542
32 1 . 1 1 9 9 VAL N N 9 122.232 122.232 122.863 -0.631 19542
33 1 . 1 1 9 9 VAL HA H 9 3.812 3.812 3.744 0.068 19542
34 1 . 1 1 9 9 VAL CA C 9 63.286 63.286 62.802 0.484 19542
35 1 . 1 1 9 9 VAL CB C 9 26.812 26.812 30.822 -4.010 19542
36 1 . 1 1 9 9 VAL H H 9 8.552 8.552 8.471 0.081 19542
37 1 . 1 1 10 10 VAL N N 10 123.963 123.963 124.576 -0.613 19542
38 1 . 1 1 10 10 VAL HA H 10 4.606 4.606 4.679 -0.073 19542
39 1 . 1 1 10 10 VAL CA C 10 60.392 60.392 59.325 1.067 19542
40 1 . 1 1 10 10 VAL CB C 10 34.782 34.782 35.321 -0.539 19542
41 1 . 1 1 10 10 VAL H H 10 8.920 8.920 8.662 0.258 19542
42 1 . 1 1 11 11 THR N N 11 118.572 118.572 119.658 -1.086 19542
43 1 . 1 1 11 11 THR HA H 11 4.443 4.443 4.507 -0.064 19542
44 1 . 1 1 11 11 THR CA C 11 62.719 62.719 62.984 -0.265 19542
45 1 . 1 1 11 11 THR CB C 11 68.689 68.689 68.519 0.170 19542
46 1 . 1 1 11 11 THR H H 11 8.517 8.517 8.208 0.309 19542
47 1 . 1 1 12 12 CYS N N 12 126.835 126.835 126.267 0.568 19542
48 1 . 1 1 12 12 CYS HA H 12 4.671 4.671 4.464 0.207 19542
49 1 . 1 1 12 12 CYS CA C 12 53.036 53.036 58.668 -5.632 19542
50 1 . 1 1 12 12 CYS CB C 12 38.892 38.892 27.663 11.229 19542
51 1 . 1 1 12 12 CYS H H 12 8.970 8.970 8.619 0.351 19542
52 1 . 1 1 13 13 HIS N N 13 121.091 121.091 122.230 -1.139 19542
53 1 . 1 1 13 13 HIS HA H 13 4.649 4.649 4.493 0.156 19542
54 1 . 1 1 13 13 HIS CB C 13 29.498 29.498 31.360 -1.862 19542
55 1 . 1 1 13 13 HIS H H 13 9.015 9.015 8.565 0.450 19542
56 1 . 1 1 14 14 ARG N N 14 120.872 120.872 121.189 -0.317 19542
57 1 . 1 1 14 14 ARG HA H 14 4.043 4.043 3.990 0.053 19542
58 1 . 1 1 14 14 ARG CA C 14 58.962 58.962 58.219 0.743 19542
59 1 . 1 1 14 14 ARG CB C 14 30.014 30.014 29.754 0.260 19542
60 1 . 1 1 14 14 ARG H H 14 8.689 8.689 8.069 0.620 19542
61 1 . 1 1 15 15 ASP N N 15 121.233 121.233 118.443 2.790 19542
62 1 . 1 1 15 15 ASP HA H 15 4.503 4.503 4.636 -0.133 19542
63 1 . 1 1 15 15 ASP CA C 15 54.306 54.306 55.836 -1.529 19542
64 1 . 1 1 15 15 ASP CB C 15 39.107 39.107 41.432 -2.325 19542
65 1 . 1 1 15 15 ASP H H 15 8.907 8.907 7.823 1.084 19542
66 1 . 1 1 16 16 MET N N 16 119.073 119.073 118.775 0.298 19542
67 1 . 1 1 16 16 MET HA H 16 4.415 4.415 4.620 -0.205 19542
68 1 . 1 1 16 16 MET CA C 16 55.995 55.995 54.872 1.123 19542
69 1 . 1 1 16 16 MET CB C 16 32.662 32.662 31.696 0.966 19542
70 1 . 1 1 16 16 MET H H 16 7.811 7.811 7.686 0.125 19542
71 1 . 1 1 17 17 LYS N N 17 120.187 120.187 122.411 -2.224 19542
72 1 . 1 1 17 17 LYS HA H 17 4.267 4.267 4.188 0.079 19542
73 1 . 1 1 17 17 LYS CA C 17 55.889 55.889 56.866 -0.977 19542
74 1 . 1 1 17 17 LYS CB C 17 34.106 34.106 33.535 0.571 19542
75 1 . 1 1 17 17 LYS H H 17 7.763 7.763 8.290 -0.527 19542
76 1 . 1 1 18 18 PHE N N 18 115.631 115.631 117.261 -1.630 19542
77 1 . 1 1 18 18 PHE HA H 18 5.113 5.113 5.130 -0.017 19542
78 1 . 1 1 18 18 PHE CA C 18 56.971 56.971 56.359 0.612 19542
79 1 . 1 1 18 18 PHE CB C 18 43.018 43.018 42.723 0.295 19542
80 1 . 1 1 18 18 PHE H H 18 8.252 8.252 8.139 0.113 19542
81 1 . 1 1 19 19 CYS N N 19 115.508 115.508 120.783 -5.275 19542
82 1 . 1 1 19 19 CYS HA H 19 6.002 6.002 5.248 0.754 19542
83 1 . 1 1 19 19 CYS CA C 19 52.258 52.258 58.000 -5.742 19542
84 1 . 1 1 19 19 CYS CB C 19 38.627 38.627 27.807 10.821 19542
85 1 . 1 1 19 19 CYS H H 19 9.343 9.343 9.407 -0.064 19542
86 1 . 1 1 20 20 TYR N N 20 128.934 128.934 118.883 10.051 19542
87 1 . 1 1 20 20 TYR HA H 20 6.207 6.207 5.767 0.440 19542
88 1 . 1 1 20 20 TYR CA C 20 55.701 55.701 54.920 0.781 19542
89 1 . 1 1 20 20 TYR CB C 20 43.184 43.184 41.202 1.982 19542
90 1 . 1 1 20 20 TYR H H 20 8.871 8.871 9.147 -0.276 19542
91 1 . 1 1 21 21 HIS N N 21 122.079 122.079 122.981 -0.902 19542
92 1 . 1 1 21 21 HIS HA H 21 5.283 5.283 4.949 0.334 19542
93 1 . 1 1 21 21 HIS CA C 21 54.713 54.713 54.384 0.329 19542
94 1 . 1 1 21 21 HIS CB C 21 31.719 31.719 31.829 -0.110 19542
95 1 . 1 1 21 21 HIS H H 21 8.797 8.797 9.255 -0.458 19542
96 1 . 1 1 22 22 ASN N N 22 128.444 128.444 127.994 0.450 19542
97 1 . 1 1 22 22 ASN HA H 22 5.846 5.846 5.271 0.575 19542
98 1 . 1 1 22 22 ASN CA C 22 52.512 52.512 52.313 0.199 19542
99 1 . 1 1 22 22 ASN CB C 22 40.821 40.821 40.532 0.289 19542
100 1 . 1 1 22 22 ASN H H 22 9.823 9.823 8.933 0.890 19542
101 1 . 1 1 23 23 THR N N 23 116.691 116.691 118.775 -2.084 19542
102 1 . 1 1 23 23 THR HA H 23 4.604 4.604 4.492 0.112 19542
103 1 . 1 1 23 23 THR CA C 23 57.003 57.003 61.608 -4.605 19542
104 1 . 1 1 23 23 THR CB C 23 69.344 69.344 69.791 -0.447 19542
105 1 . 1 1 23 23 THR H H 23 8.561 8.561 8.250 0.311 19542
106 1 . 1 1 24 24 GLY N N 24 110.763 110.763 110.535 0.228 19542
107 1 . 1 1 24 24 GLY CA C 24 44.993 44.993 44.889 0.104 19542
108 1 . 1 1 24 24 GLY H H 24 8.608 8.608 8.261 0.347 19542
109 1 . 1 1 25 25 MET N N 25 120.520 120.520 121.123 -0.602 19542
110 1 . 1 1 25 25 MET HA H 25 4.818 4.818 4.610 0.208 19542
111 1 . 1 1 25 25 MET CA C 25 53.892 53.892 52.817 1.075 19542
112 1 . 1 1 25 25 MET CB C 25 32.399 32.399 32.972 -0.573 19542
113 1 . 1 1 25 25 MET H H 25 8.418 8.418 8.164 0.254 19542
114 1 . 1 1 26 26 PRO HA H 26 4.377 4.377 4.385 -0.008 19542
115 1 . 1 1 26 26 PRO CA C 26 63.841 63.841 62.959 0.882 19542
116 1 . 1 1 26 26 PRO CB C 26 31.750 31.750 31.362 0.388 19542
117 1 . 1 1 27 27 PHE N N 27 118.056 118.056 123.441 -5.385 19542
118 1 . 1 1 27 27 PHE HA H 27 4.625 4.625 4.724 -0.099 19542
119 1 . 1 1 27 27 PHE CA C 27 57.332 57.332 56.445 0.887 19542
120 1 . 1 1 27 27 PHE CB C 27 39.701 39.701 41.952 -2.251 19542
121 1 . 1 1 27 27 PHE H H 27 7.988 7.988 8.052 -0.064 19542
122 1 . 1 1 28 28 ARG N N 28 121.294 121.294 123.682 -2.388 19542
123 1 . 1 1 28 28 ARG HA H 28 4.059 4.059 4.292 -0.233 19542
124 1 . 1 1 28 28 ARG CA C 28 57.142 57.142 57.073 0.069 19542
125 1 . 1 1 28 28 ARG CB C 28 29.711 29.711 30.124 -0.413 19542
126 1 . 1 1 28 28 ARG H H 28 8.333 8.333 8.923 -0.590 19542
127 1 . 1 1 29 29 ASN N N 29 116.243 116.243 116.587 -0.344 19542
128 1 . 1 1 29 29 ASN HA H 29 4.596 4.596 4.385 0.211 19542
129 1 . 1 1 29 29 ASN CA C 29 53.795 53.795 54.286 -0.491 19542
130 1 . 1 1 29 29 ASN CB C 29 38.239 38.239 37.937 0.302 19542
131 1 . 1 1 29 29 ASN H H 29 8.356 8.356 8.924 -0.568 19542
132 1 . 1 1 30 30 LEU N N 30 121.660 121.660 120.582 1.078 19542
133 1 . 1 1 30 30 LEU HA H 30 4.445 4.445 4.592 -0.147 19542
134 1 . 1 1 30 30 LEU CA C 30 55.203 55.203 54.639 0.564 19542
135 1 . 1 1 30 30 LEU CB C 30 42.982 42.982 43.291 -0.309 19542
136 1 . 1 1 30 30 LEU H H 30 8.028 8.028 7.650 0.378 19542
137 1 . 1 1 31 31 LYS N N 31 120.928 120.928 126.484 -5.556 19542
138 1 . 1 1 31 31 LYS HA H 31 4.378 4.378 4.497 -0.119 19542
139 1 . 1 1 31 31 LYS CA C 31 56.271 56.271 55.015 1.256 19542
140 1 . 1 1 31 31 LYS CB C 31 32.230 32.230 32.047 0.183 19542
141 1 . 1 1 31 31 LYS H H 31 8.306 8.306 8.444 -0.138 19542
142 1 . 1 1 32 32 LEU N N 32 122.843 122.843 126.328 -3.485 19542
143 1 . 1 1 32 32 LEU HA H 32 4.446 4.446 4.488 -0.042 19542
144 1 . 1 1 32 32 LEU CA C 32 54.484 54.484 54.662 -0.178 19542
145 1 . 1 1 32 32 LEU CB C 32 43.404 43.404 42.629 0.775 19542
146 1 . 1 1 32 32 LEU H H 32 8.027 8.027 8.397 -0.370 19542
147 1 . 1 1 33 33 ILE N N 33 123.311 123.311 127.134 -3.823 19542
148 1 . 1 1 33 33 ILE HA H 33 4.383 4.383 4.442 -0.059 19542
149 1 . 1 1 33 33 ILE CA C 33 60.595 60.595 59.697 0.897 19542
150 1 . 1 1 33 33 ILE CB C 33 38.303 38.303 38.263 0.040 19542
151 1 . 1 1 33 33 ILE H H 33 8.327 8.327 8.237 0.090 19542
152 1 . 1 1 34 34 LEU N N 34 128.669 128.669 129.425 -0.756 19542
153 1 . 1 1 34 34 LEU HA H 34 4.794 4.794 4.726 0.068 19542
154 1 . 1 1 34 34 LEU CB C 34 42.873 42.873 41.729 1.144 19542
155 1 . 1 1 34 34 LEU H H 34 8.880 8.880 8.699 0.180 19542
156 1 . 1 1 35 35 GLN N N 35 121.600 121.600 120.796 0.804 19542
157 1 . 1 1 35 35 GLN HA H 35 4.588 4.588 5.014 -0.426 19542
158 1 . 1 1 35 35 GLN CA C 35 61.390 61.390 54.925 6.465 19542
159 1 . 1 1 35 35 GLN CB C 35 33.866 33.866 30.519 3.347 19542
160 1 . 1 1 35 35 GLN H H 35 8.210 8.210 8.150 0.060 19542
161 1 . 1 1 36 36 GLY N N 36 106.726 106.726 109.529 -2.803 19542
162 1 . 1 1 36 36 GLY CA C 36 45.878 45.878 43.554 2.324 19542
163 1 . 1 1 36 36 GLY H H 36 6.121 6.121 7.393 -1.272 19542
164 1 . 1 1 37 37 CYS N N 37 124.584 124.584 118.601 5.983 19542
165 1 . 1 1 37 37 CYS HA H 37 5.874 5.874 5.326 0.548 19542
166 1 . 1 1 37 37 CYS CA C 37 55.955 55.955 57.991 -2.036 19542
167 1 . 1 1 37 37 CYS CB C 37 48.202 48.202 29.916 18.286 19542
168 1 . 1 1 37 37 CYS H H 37 8.505 8.505 8.479 0.026 19542
169 1 . 1 1 38 38 SER N N 38 115.036 115.036 118.130 -3.094 19542
170 1 . 1 1 38 38 SER HA H 38 4.980 4.980 5.038 -0.058 19542
171 1 . 1 1 38 38 SER CA C 38 58.792 58.792 56.706 2.086 19542
172 1 . 1 1 38 38 SER CB C 38 65.971 65.971 65.853 0.118 19542
173 1 . 1 1 38 38 SER H H 38 9.749 9.749 9.332 0.417 19542
174 1 . 1 1 39 39 SER N N 39 117.276 117.276 119.527 -2.251 19542
175 1 . 1 1 39 39 SER HA H 39 4.827 4.827 4.930 -0.103 19542
176 1 . 1 1 39 39 SER CA C 39 60.040 60.040 59.727 0.313 19542
177 1 . 1 1 39 39 SER CB C 39 63.784 63.784 63.787 -0.003 19542
178 1 . 1 1 39 39 SER H H 39 9.161 9.161 8.885 0.276 19542
179 1 . 1 1 40 40 SER N N 40 115.041 115.041 114.971 0.070 19542
180 1 . 1 1 40 40 SER HA H 40 4.660 4.660 4.773 -0.113 19542
181 1 . 1 1 40 40 SER CA C 40 55.868 55.868 57.191 -1.323 19542
182 1 . 1 1 40 40 SER CB C 40 64.868 64.868 65.589 -0.721 19542
183 1 . 1 1 40 40 SER H H 40 7.911 7.911 7.731 0.180 19542
184 1 . 1 1 41 41 CYS N N 41 124.146 124.146 121.022 3.124 19542
185 1 . 1 1 41 41 CYS HA H 41 4.309 4.309 4.455 -0.146 19542
186 1 . 1 1 41 41 CYS CA C 41 57.567 57.567 57.859 -0.292 19542
187 1 . 1 1 41 41 CYS CB C 41 40.000 40.000 28.352 11.648 19542
188 1 . 1 1 41 41 CYS H H 41 8.067 8.067 8.229 -0.162 19542
189 1 . 1 1 42 42 SER N N 42 118.590 118.590 121.146 -2.556 19542
190 1 . 1 1 42 42 SER HA H 42 4.611 4.611 4.474 0.137 19542
191 1 . 1 1 42 42 SER CA C 42 59.020 59.020 57.419 1.601 19542
192 1 . 1 1 42 42 SER CB C 42 64.112 64.112 63.637 0.475 19542
193 1 . 1 1 42 42 SER H H 42 8.491 8.491 8.562 -0.071 19542
194 1 . 1 1 43 43 GLU N N 43 118.830 118.830 125.756 -6.926 19542
195 1 . 1 1 43 43 GLU HA H 43 4.649 4.649 4.249 0.400 19542
196 1 . 1 1 43 43 GLU CA C 43 56.856 56.856 56.797 0.059 19542
197 1 . 1 1 43 43 GLU CB C 43 29.206 29.206 29.128 0.078 19542
198 1 . 1 1 43 43 GLU H H 43 8.861 8.861 8.590 0.271 19542
199 1 . 1 1 44 44 THR N N 44 117.954 117.954 116.608 1.346 19542
200 1 . 1 1 44 44 THR HA H 44 4.619 4.619 4.519 0.100 19542
201 1 . 1 1 44 44 THR CB C 44 72.341 72.341 70.628 1.713 19542
202 1 . 1 1 44 44 THR H H 44 9.030 9.030 7.965 1.065 19542
203 1 . 1 1 45 45 GLU N N 45 127.100 127.100 120.803 6.297 19542
204 1 . 1 1 45 45 GLU HA H 45 4.094 4.094 4.218 -0.124 19542
205 1 . 1 1 45 45 GLU CA C 45 58.934 58.934 58.165 0.769 19542
206 1 . 1 1 45 45 GLU CB C 45 27.009 27.009 29.803 -2.794 19542
207 1 . 1 1 45 45 GLU H H 45 8.837 8.837 8.733 0.104 19542
208 1 . 1 1 46 46 ASN HA H 46 4.902 4.902 4.546 0.356 19542
209 1 . 1 1 46 46 ASN CA C 46 53.244 53.244 54.716 -1.472 19542
210 1 . 1 1 46 46 ASN CB C 46 40.053 40.053 39.086 0.967 19542
211 1 . 1 1 46 46 ASN H H 46 8.018 8.018 8.120 -0.102 19542
212 1 . 1 1 47 47 ASN N N 47 120.765 120.765 118.346 2.419 19542
213 1 . 1 1 47 47 ASN HA H 47 5.362 5.362 5.124 0.238 19542
214 1 . 1 1 47 47 ASN CA C 47 53.979 53.979 52.592 1.387 19542
215 1 . 1 1 47 47 ASN CB C 47 41.749 41.749 39.738 2.011 19542
216 1 . 1 1 47 47 ASN H H 47 7.835 7.835 7.873 -0.038 19542
217 1 . 1 1 48 48 LYS N N 48 123.576 123.576 126.950 -3.374 19542
218 1 . 1 1 48 48 LYS HA H 48 4.842 4.842 4.706 0.136 19542
219 1 . 1 1 48 48 LYS CB C 48 34.398 34.398 34.147 0.251 19542
220 1 . 1 1 48 48 LYS H H 48 8.548 8.548 8.770 -0.222 19542
221 1 . 1 1 49 49 CYS N N 49 116.141 116.141 120.040 -3.899 19542
222 1 . 1 1 49 49 CYS HA H 49 5.553 5.553 5.770 -0.217 19542
223 1 . 1 1 49 49 CYS CA C 49 53.386 53.386 56.729 -3.343 19542
224 1 . 1 1 49 49 CYS CB C 49 44.935 44.935 28.205 16.730 19542
225 1 . 1 1 49 49 CYS H H 49 8.873 8.873 8.590 0.283 19542
226 1 . 1 1 50 50 CYS N N 50 118.484 118.484 121.806 -3.322 19542
227 1 . 1 1 50 50 CYS HA H 50 5.265 5.265 4.985 0.280 19542
228 1 . 1 1 50 50 CYS CA C 50 55.983 55.983 57.284 -1.301 19542
229 1 . 1 1 50 50 CYS CB C 50 46.111 46.111 30.747 15.364 19542
230 1 . 1 1 50 50 CYS H H 50 9.389 9.389 9.428 -0.039 19542
231 1 . 1 1 51 51 SER N N 51 115.213 115.213 116.780 -1.567 19542
232 1 . 1 1 51 51 SER HA H 51 5.016 5.016 4.795 0.222 19542
233 1 . 1 1 51 51 SER CA C 51 58.118 58.118 57.934 0.184 19542
234 1 . 1 1 51 51 SER CB C 51 64.457 64.457 62.846 1.610 19542
235 1 . 1 1 51 51 SER H H 51 9.290 9.290 8.654 0.636 19542
236 1 . 1 1 52 52 THR N N 52 112.156 112.156 117.756 -5.600 19542
237 1 . 1 1 52 52 THR HA H 52 4.692 4.692 4.489 0.203 19542
238 1 . 1 1 52 52 THR CA C 52 59.835 59.835 61.197 -1.362 19542
239 1 . 1 1 52 52 THR CB C 52 71.872 71.872 71.595 0.277 19542
240 1 . 1 1 52 52 THR H H 52 7.624 7.624 7.459 0.165 19542
241 1 . 1 1 53 53 ASP N N 53 119.869 119.869 122.542 -2.673 19542
242 1 . 1 1 53 53 ASP HA H 53 4.970 4.970 4.432 0.538 19542
243 1 . 1 1 53 53 ASP CA C 53 55.485 55.485 55.588 -0.103 19542
244 1 . 1 1 53 53 ASP CB C 53 40.722 40.722 40.815 -0.093 19542
245 1 . 1 1 53 53 ASP H H 53 8.410 8.410 8.604 -0.194 19542
246 1 . 1 1 54 54 ARG N N 54 111.677 111.677 118.120 -6.443 19542
247 1 . 1 1 54 54 ARG HA H 54 3.185 3.185 3.608 -0.423 19542
248 1 . 1 1 54 54 ARG CA C 54 57.962 57.962 57.484 0.479 19542
249 1 . 1 1 54 54 ARG CB C 54 28.429 28.429 27.163 1.267 19542
250 1 . 1 1 54 54 ARG H H 54 9.306 9.306 8.703 0.603 19542
251 1 . 1 1 55 55 CYS HA H 55 4.561 4.561 4.454 0.107 19542
252 1 . 1 1 55 55 CYS CA C 55 57.814 57.814 59.377 -1.563 19542
253 1 . 1 1 55 55 CYS CB C 55 46.236 46.236 27.265 18.971 19542
254 1 . 1 1 55 55 CYS H H 55 7.995 7.995 7.905 0.090 19542
255 1 . 1 1 56 56 ASN N N 56 121.881 121.881 119.509 2.372 19542
256 1 . 1 1 56 56 ASN HA H 56 4.810 4.810 4.656 0.154 19542
257 1 . 1 1 56 56 ASN CA C 56 52.366 52.366 52.591 -0.225 19542
258 1 . 1 1 56 56 ASN CB C 56 37.837 37.837 36.638 1.199 19542
259 1 . 1 1 56 56 ASN H H 56 8.755 8.755 8.635 0.120 19542
stop_
save_