data_25149
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25149
_Entry.PDB_ID 2MT5
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 25149
_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 SER HA H 2 4.417 4.417 4.583 -0.166 25149
2 1 1 . 1 1 2 2 SER CA C 2 58.322 58.322 57.989 0.333 25149
3 1 1 . 1 1 2 2 SER CB C 2 64.169 64.169 63.555 0.614 25149
4 1 1 . 1 1 3 3 VAL N N 3 121.214 121.214 123.378 -2.164 25149
5 1 1 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.098 -0.052 25149
6 1 1 . 1 1 3 3 VAL C C 3 175.879 175.879 176.023 -0.144 25149
7 1 1 . 1 1 3 3 VAL CA C 3 62.138 62.138 62.512 -0.374 25149
8 1 1 . 1 1 3 3 VAL CB C 3 32.958 32.958 32.524 0.434 25149
9 1 1 . 1 1 3 3 VAL H H 3 8.170 8.170 7.447 0.723 25149
10 1 1 . 1 1 4 4 ALA N N 4 127.312 127.312 129.111 -1.799 25149
11 1 1 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.516 -0.319 25149
12 1 1 . 1 1 4 4 ALA C C 4 177.497 177.497 176.408 1.089 25149
13 1 1 . 1 1 4 4 ALA CA C 4 52.439 52.439 51.618 0.820 25149
14 1 1 . 1 1 4 4 ALA CB C 4 19.424 19.424 18.569 0.855 25149
15 1 1 . 1 1 4 4 ALA H H 4 8.294 8.294 8.442 -0.148 25149
16 1 1 . 1 1 5 5 ASN N N 5 117.674 117.674 122.665 -4.991 25149
17 1 1 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.822 -0.257 25149
18 1 1 . 1 1 5 5 ASN C C 5 175.048 175.048 175.043 0.005 25149
19 1 1 . 1 1 5 5 ASN CA C 5 53.725 53.725 52.949 0.776 25149
20 1 1 . 1 1 5 5 ASN CB C 5 39.197 39.197 39.835 -0.638 25149
21 1 1 . 1 1 5 5 ASN H H 5 8.252 8.252 8.243 0.009 25149
22 1 1 . 1 1 6 6 ASP N N 6 119.896 119.896 123.181 -3.285 25149
23 1 1 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.630 -0.110 25149
24 1 1 . 1 1 6 6 ASP C C 6 176.269 176.269 176.115 0.154 25149
25 1 1 . 1 1 6 6 ASP CA C 6 54.497 54.497 54.167 0.330 25149
26 1 1 . 1 1 6 6 ASP CB C 6 41.104 41.104 41.061 0.043 25149
27 1 1 . 1 1 6 6 ASP H H 6 8.215 8.215 8.869 -0.654 25149
28 1 1 . 1 1 7 7 GLU N N 7 119.101 119.101 114.593 4.508 25149
29 1 1 . 1 1 7 7 GLU HA H 7 4.243 4.243 4.135 0.108 25149
30 1 1 . 1 1 7 7 GLU C C 7 175.006 175.006 174.858 0.148 25149
31 1 1 . 1 1 7 7 GLU CA C 7 56.689 56.689 56.502 0.187 25149
32 1 1 . 1 1 7 7 GLU CB C 7 30.379 30.379 29.149 1.230 25149
33 1 1 . 1 1 7 7 GLU H H 7 8.065 8.065 8.316 -0.251 25149
34 1 1 . 1 1 8 8 ASN N N 8 116.852 116.852 117.409 -0.557 25149
35 1 1 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.812 -0.654 25149
36 1 1 . 1 1 8 8 ASN C C 8 172.706 172.706 174.634 -1.928 25149
37 1 1 . 1 1 8 8 ASN CA C 8 51.165 51.165 51.586 -0.421 25149
38 1 1 . 1 1 8 8 ASN CB C 8 40.702 40.702 40.097 0.605 25149
39 1 1 . 1 1 8 8 ASN H H 8 7.505 7.505 7.187 0.318 25149
40 1 1 . 1 1 9 9 CYS N N 9 122.855 122.855 120.001 2.854 25149
41 1 1 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.734 0.060 25149
42 1 1 . 1 1 9 9 CYS C C 9 178.370 178.370 176.294 2.076 25149
43 1 1 . 1 1 9 9 CYS CA C 9 59.552 59.552 60.286 -0.734 25149
44 1 1 . 1 1 9 9 CYS CB C 9 31.526 31.526 28.354 3.172 25149
45 1 1 . 1 1 9 9 CYS H H 9 7.614 7.614 8.097 -0.483 25149
46 1 1 . 1 1 10 10 GLY N N 10 117.295 117.295 107.884 9.411 25149
47 1 1 . 1 1 10 10 GLY C C 10 174.111 174.111 174.650 -0.539 25149
48 1 1 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.590 1.377 25149
49 1 1 . 1 1 10 10 GLY H H 10 9.235 9.235 7.589 1.646 25149
50 1 1 . 1 1 11 11 ILE N N 11 119.811 119.811 119.320 0.491 25149
51 1 1 . 1 1 11 11 ILE HA H 11 3.809 3.809 4.018 -0.209 25149
52 1 1 . 1 1 11 11 ILE C C 11 176.121 176.121 175.834 0.287 25149
53 1 1 . 1 1 11 11 ILE CA C 11 64.041 64.041 63.886 0.155 25149
54 1 1 . 1 1 11 11 ILE CB C 11 39.411 39.411 38.674 0.737 25149
55 1 1 . 1 1 11 11 ILE H H 11 8.285 8.285 7.671 0.614 25149
56 1 1 . 1 1 12 12 CYS N N 12 116.728 116.728 114.036 2.692 25149
57 1 1 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.700 -0.124 25149
58 1 1 . 1 1 12 12 CYS C C 12 175.975 175.975 173.837 2.138 25149
59 1 1 . 1 1 12 12 CYS CA C 12 59.225 59.225 57.075 2.151 25149
60 1 1 . 1 1 12 12 CYS CB C 12 32.246 32.246 30.296 1.950 25149
61 1 1 . 1 1 12 12 CYS H H 12 7.607 7.607 7.696 -0.089 25149
62 1 1 . 1 1 13 13 ARG N N 13 116.073 116.073 118.639 -2.566 25149
63 1 1 . 1 1 13 13 ARG HA H 13 3.742 3.742 3.975 -0.233 25149
64 1 1 . 1 1 13 13 ARG C C 13 174.979 174.979 174.198 0.781 25149
65 1 1 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.789 0.847 25149
66 1 1 . 1 1 13 13 ARG CB C 13 26.326 26.326 26.840 -0.514 25149
67 1 1 . 1 1 13 13 ARG H H 13 7.987 7.987 8.178 -0.191 25149
68 1 1 . 1 1 14 14 MET N N 14 119.313 119.313 117.654 1.659 25149
69 1 1 . 1 1 14 14 MET HA H 14 4.547 4.547 4.622 -0.075 25149
70 1 1 . 1 1 14 14 MET C C 14 176.143 176.143 174.759 1.384 25149
71 1 1 . 1 1 14 14 MET CA C 14 54.208 54.208 54.056 0.152 25149
72 1 1 . 1 1 14 14 MET CB C 14 33.951 33.951 36.414 -2.463 25149
73 1 1 . 1 1 14 14 MET H H 14 8.624 8.624 7.545 1.079 25149
74 1 1 . 1 1 15 15 ALA N N 15 122.683 122.683 125.040 -2.357 25149
75 1 1 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.352 -0.080 25149
76 1 1 . 1 1 15 15 ALA C C 15 180.117 180.117 178.450 1.667 25149
77 1 1 . 1 1 15 15 ALA CA C 15 52.346 52.346 51.665 0.681 25149
78 1 1 . 1 1 15 15 ALA CB C 15 19.487 19.487 19.047 0.441 25149
79 1 1 . 1 1 15 15 ALA H H 15 7.965 7.965 8.268 -0.303 25149
80 1 1 . 1 1 16 16 PHE N N 16 119.313 119.313 122.697 -3.384 25149
81 1 1 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.280 -0.239 25149
82 1 1 . 1 1 16 16 PHE C C 16 176.423 176.423 176.567 -0.144 25149
83 1 1 . 1 1 16 16 PHE CA C 16 59.130 59.130 60.099 -0.969 25149
84 1 1 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.395 -0.005 25149
85 1 1 . 1 1 16 16 PHE H H 16 8.095 8.095 7.547 0.548 25149
86 1 1 . 1 1 17 17 ASN N N 17 112.313 112.313 116.585 -4.272 25149
87 1 1 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.841 -0.205 25149
88 1 1 . 1 1 17 17 ASN C C 17 175.337 175.337 175.293 0.044 25149
89 1 1 . 1 1 17 17 ASN CA C 17 52.961 52.961 53.259 -0.298 25149
90 1 1 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.782 -1.608 25149
91 1 1 . 1 1 17 17 ASN H H 17 7.823 7.823 8.218 -0.395 25149
92 1 1 . 1 1 18 18 GLY N N 18 107.742 107.742 107.375 0.367 25149
93 1 1 . 1 1 18 18 GLY C C 18 173.759 173.759 172.680 1.079 25149
94 1 1 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.331 0.133 25149
95 1 1 . 1 1 18 18 GLY H H 18 7.579 7.579 7.977 -0.398 25149
96 1 1 . 1 1 19 19 CYS N N 19 117.050 117.050 119.274 -2.224 25149
97 1 1 . 1 1 19 19 CYS HA H 19 4.571 4.571 4.622 -0.051 25149
98 1 1 . 1 1 19 19 CYS C C 19 174.039 174.039 175.055 -1.016 25149
99 1 1 . 1 1 19 19 CYS CA C 19 58.433 58.433 58.198 0.235 25149
100 1 1 . 1 1 19 19 CYS CB C 19 30.681 30.681 29.397 1.284 25149
101 1 1 . 1 1 19 19 CYS H H 19 8.198 8.198 8.357 -0.159 25149
102 1 1 . 1 1 20 20 CYS N N 20 123.923 123.923 123.702 0.221 25149
103 1 1 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.018 -0.007 25149
104 1 1 . 1 1 20 20 CYS C C 20 173.736 173.736 174.568 -0.832 25149
105 1 1 . 1 1 20 20 CYS CA C 20 57.999 57.999 58.389 -0.390 25149
106 1 1 . 1 1 20 20 CYS CB C 20 28.205 28.205 27.497 0.708 25149
107 1 1 . 1 1 20 20 CYS H H 20 8.466 8.466 8.643 -0.177 25149
108 1 1 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.325 -0.296 25149
109 1 1 . 1 1 21 21 PRO CA C 21 65.426 65.426 64.859 0.567 25149
110 1 1 . 1 1 21 21 PRO CB C 21 32.801 32.801 32.158 0.642 25149
111 1 1 . 1 1 22 22 ASP N N 22 117.053 117.053 118.317 -1.264 25149
112 1 1 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.696 -0.191 25149
113 1 1 . 1 1 22 22 ASP C C 22 176.501 176.501 175.327 1.174 25149
114 1 1 . 1 1 22 22 ASP CA C 22 55.017 55.017 54.199 0.818 25149
115 1 1 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.127 2.395 25149
116 1 1 . 1 1 22 22 ASP H H 22 8.395 8.395 8.688 -0.293 25149
117 1 1 . 1 1 23 23 CYS N N 23 123.353 123.353 119.521 3.832 25149
118 1 1 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.482 -0.189 25149
119 1 1 . 1 1 23 23 CYS C C 23 175.214 175.214 174.047 1.167 25149
120 1 1 . 1 1 23 23 CYS CA C 23 61.633 61.633 58.465 3.168 25149
121 1 1 . 1 1 23 23 CYS CB C 23 31.542 31.542 29.634 1.909 25149
122 1 1 . 1 1 23 23 CYS H H 23 7.246 7.246 7.091 0.155 25149
123 1 1 . 1 1 24 24 LYS N N 24 117.539 117.539 127.862 -10.323 25149
124 1 1 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.370 -0.140 25149
125 1 1 . 1 1 24 24 LYS C C 24 177.106 177.106 176.046 1.060 25149
126 1 1 . 1 1 24 24 LYS CA C 24 56.921 56.921 55.507 1.414 25149
127 1 1 . 1 1 24 24 LYS CB C 24 34.615 34.615 31.709 2.906 25149
128 1 1 . 1 1 24 24 LYS H H 24 8.173 8.173 8.496 -0.323 25149
129 1 1 . 1 1 25 25 VAL N N 25 120.661 120.661 120.872 -0.211 25149
130 1 1 . 1 1 25 25 VAL HA H 25 4.429 4.429 4.014 0.415 25149
131 1 1 . 1 1 25 25 VAL C C 25 174.027 174.027 175.949 -1.922 25149
132 1 1 . 1 1 25 25 VAL CA C 25 59.934 59.934 61.570 -1.636 25149
133 1 1 . 1 1 25 25 VAL CB C 25 33.507 33.507 32.589 0.918 25149
134 1 1 . 1 1 25 25 VAL H H 25 7.787 7.787 7.658 0.129 25149
135 1 1 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.430 -0.094 25149
136 1 1 . 1 1 26 26 PRO CA C 26 63.279 63.279 63.698 -0.419 25149
137 1 1 . 1 1 26 26 PRO CB C 26 32.077 32.077 32.693 -0.616 25149
138 1 1 . 1 1 27 27 GLY N N 27 109.926 109.926 106.167 3.759 25149
139 1 1 . 1 1 27 27 GLY C C 27 175.169 175.169 173.506 1.663 25149
140 1 1 . 1 1 27 27 GLY CA C 27 45.042 45.042 44.664 0.378 25149
141 1 1 . 1 1 27 27 GLY H H 27 8.569 8.569 7.790 0.779 25149
142 1 1 . 1 1 28 28 ASP N N 28 122.592 122.592 120.670 1.922 25149
143 1 1 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.698 -0.467 25149
144 1 1 . 1 1 28 28 ASP C C 28 176.602 176.602 176.676 -0.074 25149
145 1 1 . 1 1 28 28 ASP CA C 28 56.402 56.402 54.648 1.754 25149
146 1 1 . 1 1 28 28 ASP CB C 28 40.912 40.912 41.767 -0.855 25149
147 1 1 . 1 1 28 28 ASP H H 28 8.214 8.214 8.221 -0.007 25149
148 1 1 . 1 1 29 29 ASP N N 29 117.500 117.500 120.891 -3.391 25149
149 1 1 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.894 -0.447 25149
150 1 1 . 1 1 29 29 ASP C C 29 175.505 175.505 175.158 0.347 25149
151 1 1 . 1 1 29 29 ASP CA C 29 55.266 55.266 54.256 1.010 25149
152 1 1 . 1 1 29 29 ASP CB C 29 41.225 41.225 40.408 0.816 25149
153 1 1 . 1 1 29 29 ASP H H 29 8.271 8.271 8.505 -0.234 25149
154 1 1 . 1 1 30 30 CYS N N 30 124.470 124.470 119.605 4.865 25149
155 1 1 . 1 1 30 30 CYS HA H 30 4.390 4.390 4.945 -0.555 25149
156 1 1 . 1 1 30 30 CYS C C 30 171.755 171.755 173.533 -1.778 25149
157 1 1 . 1 1 30 30 CYS CA C 30 57.676 57.676 55.659 2.017 25149
158 1 1 . 1 1 30 30 CYS CB C 30 29.154 29.154 28.283 0.871 25149
159 1 1 . 1 1 30 30 CYS H H 30 7.912 7.912 8.211 -0.299 25149
160 1 1 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.503 0.184 25149
161 1 1 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.656 0.219 25149
162 1 1 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.333 1.651 25149
163 1 1 . 1 1 32 32 LEU N N 32 120.023 120.023 115.077 4.946 25149
164 1 1 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.590 0.126 25149
165 1 1 . 1 1 32 32 LEU C C 32 176.300 176.300 174.997 1.303 25149
166 1 1 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.632 0.289 25149
167 1 1 . 1 1 32 32 LEU CB C 32 43.336 43.336 44.602 -1.266 25149
168 1 1 . 1 1 32 32 LEU H H 32 8.580 8.580 7.888 0.692 25149
169 1 1 . 1 1 33 33 VAL N N 33 116.217 116.217 119.009 -2.792 25149
170 1 1 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.576 0.087 25149
171 1 1 . 1 1 33 33 VAL C C 33 171.374 171.374 173.918 -2.544 25149
172 1 1 . 1 1 33 33 VAL CA C 33 60.449 60.449 60.404 0.045 25149
173 1 1 . 1 1 33 33 VAL CB C 33 36.448 36.448 35.703 0.746 25149
174 1 1 . 1 1 33 33 VAL H H 33 8.594 8.594 8.445 0.149 25149
175 1 1 . 1 1 34 34 TRP N N 34 122.711 122.711 126.041 -3.330 25149
176 1 1 . 1 1 34 34 TRP HA H 34 5.339 5.339 5.038 0.301 25149
177 1 1 . 1 1 34 34 TRP C C 34 176.770 176.770 175.311 1.459 25149
178 1 1 . 1 1 34 34 TRP CA C 34 57.267 57.267 55.632 1.635 25149
179 1 1 . 1 1 34 34 TRP CB C 34 33.780 33.780 33.316 0.464 25149
180 1 1 . 1 1 34 34 TRP H H 34 8.756 8.756 8.527 0.229 25149
181 1 1 . 1 1 35 35 GLY N N 35 107.569 107.569 105.803 1.766 25149
182 1 1 . 1 1 35 35 GLY C C 35 177.397 177.397 174.327 3.070 25149
183 1 1 . 1 1 35 35 GLY CA C 35 44.070 44.070 44.077 -0.007 25149
184 1 1 . 1 1 35 35 GLY H H 35 8.857 8.857 8.519 0.338 25149
185 1 1 . 1 1 36 36 GLN N N 36 122.723 122.723 118.083 4.640 25149
186 1 1 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.020 -0.274 25149
187 1 1 . 1 1 36 36 GLN C C 36 176.445 176.445 176.240 0.205 25149
188 1 1 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.528 -0.099 25149
189 1 1 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.639 -1.008 25149
190 1 1 . 1 1 36 36 GLN H H 36 8.338 8.338 8.600 -0.262 25149
191 1 1 . 1 1 37 37 CYS N N 37 115.763 115.763 113.353 2.410 25149
192 1 1 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.869 -0.585 25149
193 1 1 . 1 1 37 37 CYS C C 37 175.281 175.281 175.896 -0.615 25149
194 1 1 . 1 1 37 37 CYS CA C 37 58.395 58.395 55.815 2.580 25149
195 1 1 . 1 1 37 37 CYS CB C 37 31.143 31.143 31.260 -0.117 25149
196 1 1 . 1 1 37 37 CYS H H 37 7.622 7.622 7.732 -0.110 25149
197 1 1 . 1 1 38 38 SER N N 38 114.540 114.540 114.988 -0.448 25149
198 1 1 . 1 1 38 38 SER HA H 38 4.004 4.004 4.240 -0.236 25149
199 1 1 . 1 1 38 38 SER C C 38 173.389 173.389 174.207 -0.818 25149
200 1 1 . 1 1 38 38 SER CA C 38 62.285 62.285 60.811 1.474 25149
201 1 1 . 1 1 38 38 SER H H 38 7.716 7.716 8.630 -0.914 25149
202 1 1 . 1 1 39 39 HIS N N 39 121.947 121.947 120.637 1.310 25149
203 1 1 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.339 0.105 25149
204 1 1 . 1 1 39 39 HIS C C 39 172.326 172.326 173.895 -1.569 25149
205 1 1 . 1 1 39 39 HIS CA C 39 61.320 61.320 57.240 4.080 25149
206 1 1 . 1 1 39 39 HIS CB C 39 31.523 31.523 29.564 1.959 25149
207 1 1 . 1 1 39 39 HIS H H 39 7.829 7.829 7.665 0.164 25149
208 1 1 . 1 1 40 40 CYS N N 40 121.859 121.859 123.431 -1.572 25149
209 1 1 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.489 0.120 25149
210 1 1 . 1 1 40 40 CYS C C 40 171.900 171.900 172.150 -0.250 25149
211 1 1 . 1 1 40 40 CYS CA C 40 55.791 55.791 56.123 -0.332 25149
212 1 1 . 1 1 40 40 CYS CB C 40 28.964 28.964 28.314 0.650 25149
213 1 1 . 1 1 40 40 CYS H H 40 8.049 8.049 8.697 -0.648 25149
214 1 1 . 1 1 41 41 PHE N N 41 120.690 120.690 120.971 -0.281 25149
215 1 1 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.668 0.509 25149
216 1 1 . 1 1 41 41 PHE C C 41 176.613 176.613 174.830 1.783 25149
217 1 1 . 1 1 41 41 PHE CA C 41 56.033 56.033 55.131 0.902 25149
218 1 1 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.502 2.258 25149
219 1 1 . 1 1 41 41 PHE H H 41 8.368 8.368 8.477 -0.109 25149
220 1 1 . 1 1 42 42 HIS N N 42 117.057 117.057 120.172 -3.115 25149
221 1 1 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.480 0.189 25149
222 1 1 . 1 1 42 42 HIS C C 42 177.464 177.464 176.186 1.278 25149
223 1 1 . 1 1 42 42 HIS CA C 42 60.425 60.425 56.591 3.834 25149
224 1 1 . 1 1 42 42 HIS CB C 42 29.740 29.740 29.893 -0.153 25149
225 1 1 . 1 1 42 42 HIS H H 42 8.384 8.384 8.015 0.369 25149
226 1 1 . 1 1 43 43 MET N N 43 128.543 128.543 126.205 2.338 25149
227 1 1 . 1 1 43 43 MET HA H 43 3.965 3.965 4.027 -0.062 25149
228 1 1 . 1 1 43 43 MET C C 43 177.845 177.845 177.336 0.509 25149
229 1 1 . 1 1 43 43 MET CA C 43 59.209 59.209 60.510 -1.301 25149
230 1 1 . 1 1 43 43 MET CB C 43 33.009 33.009 32.719 0.290 25149
231 1 1 . 1 1 43 43 MET H H 43 9.439 9.439 8.428 1.011 25149
232 1 1 . 1 1 44 44 HIS N N 44 116.500 116.500 117.091 -0.591 25149
233 1 1 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.133 0.123 25149
234 1 1 . 1 1 44 44 HIS C C 44 178.405 178.405 177.784 0.621 25149
235 1 1 . 1 1 44 44 HIS CA C 44 58.793 58.793 58.746 0.047 25149
236 1 1 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.196 3.551 25149
237 1 1 . 1 1 44 44 HIS H H 44 9.747 9.747 8.021 1.726 25149
238 1 1 . 1 1 45 45 CYS N N 45 115.950 115.950 117.249 -1.299 25149
239 1 1 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.156 -0.156 25149
240 1 1 . 1 1 45 45 CYS C C 45 177.957 177.957 176.784 1.173 25149
241 1 1 . 1 1 45 45 CYS CA C 45 62.923 62.923 63.312 -0.389 25149
242 1 1 . 1 1 45 45 CYS CB C 45 29.102 29.102 26.432 2.670 25149
243 1 1 . 1 1 45 45 CYS H H 45 6.845 6.845 8.253 -1.408 25149
244 1 1 . 1 1 46 46 ILE N N 46 119.362 119.362 121.345 -1.983 25149
245 1 1 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.635 0.030 25149
246 1 1 . 1 1 46 46 ILE C C 46 176.613 176.613 177.744 -1.131 25149
247 1 1 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.505 -4.263 25149
248 1 1 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.716 -0.397 25149
249 1 1 . 1 1 46 46 ILE H H 46 7.816 7.816 7.905 -0.089 25149
250 1 1 . 1 1 47 47 LEU N N 47 122.180 122.180 120.285 1.895 25149
251 1 1 . 1 1 47 47 LEU HA H 47 3.873 3.873 3.938 -0.065 25149
252 1 1 . 1 1 47 47 LEU C C 47 179.726 179.726 178.649 1.077 25149
253 1 1 . 1 1 47 47 LEU CA C 47 58.633 58.633 58.879 -0.246 25149
254 1 1 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.625 -0.502 25149
255 1 1 . 1 1 47 47 LEU H H 47 8.266 8.266 8.596 -0.330 25149
256 1 1 . 1 1 48 48 LYS N N 48 118.251 118.251 118.406 -0.155 25149
257 1 1 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.145 -0.281 25149
258 1 1 . 1 1 48 48 LYS C C 48 179.423 179.423 178.657 0.766 25149
259 1 1 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.369 0.618 25149
260 1 1 . 1 1 48 48 LYS CB C 48 32.765 32.765 31.921 0.844 25149
261 1 1 . 1 1 48 48 LYS H H 48 7.147 7.147 8.146 -0.999 25149
262 1 1 . 1 1 49 49 TRP N N 49 120.745 120.745 120.824 -0.079 25149
263 1 1 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.389 -0.309 25149
264 1 1 . 1 1 49 49 TRP C C 49 178.147 178.147 178.061 0.086 25149
265 1 1 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.474 0.071 25149
266 1 1 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.180 0.235 25149
267 1 1 . 1 1 49 49 TRP H H 49 7.709 7.709 7.588 0.121 25149
268 1 1 . 1 1 50 50 LEU N N 50 117.236 117.236 118.364 -1.128 25149
269 1 1 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.724 -0.119 25149
270 1 1 . 1 1 50 50 LEU C C 50 179.658 179.658 177.472 2.186 25149
271 1 1 . 1 1 50 50 LEU CA C 50 57.330 57.330 55.016 2.314 25149
272 1 1 . 1 1 50 50 LEU CB C 50 41.416 41.416 42.055 -0.639 25149
273 1 1 . 1 1 50 50 LEU H H 50 8.512 8.512 7.932 0.580 25149
274 1 1 . 1 1 51 51 HIS N N 51 115.650 115.650 116.804 -1.154 25149
275 1 1 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.544 -0.270 25149
276 1 1 . 1 1 51 51 HIS C C 51 175.942 175.942 176.272 -0.330 25149
277 1 1 . 1 1 51 51 HIS CA C 51 57.320 57.320 57.255 0.065 25149
278 1 1 . 1 1 51 51 HIS CB C 51 29.487 29.487 29.588 -0.101 25149
279 1 1 . 1 1 51 51 HIS H H 51 7.713 7.713 8.625 -0.912 25149
280 1 1 . 1 1 52 52 ALA N N 52 119.779 119.779 119.997 -0.218 25149
281 1 1 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.509 -0.486 25149
282 1 1 . 1 1 52 52 ALA C C 52 177.834 177.834 176.816 1.018 25149
283 1 1 . 1 1 52 52 ALA CA C 52 52.865 52.865 52.817 0.048 25149
284 1 1 . 1 1 52 52 ALA CB C 52 18.951 18.951 20.487 -1.536 25149
285 1 1 . 1 1 52 52 ALA H H 52 7.191 7.191 7.815 -0.624 25149
286 1 1 . 1 1 53 53 GLN N N 53 117.047 117.047 118.697 -1.650 25149
287 1 1 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.452 -0.519 25149
288 1 1 . 1 1 53 53 GLN C C 53 175.998 175.998 175.551 0.447 25149
289 1 1 . 1 1 53 53 GLN CA C 53 55.482 55.482 54.947 0.535 25149
290 1 1 . 1 1 53 53 GLN CB C 53 28.887 28.887 28.942 -0.056 25149
291 1 1 . 1 1 53 53 GLN H H 53 7.317 7.317 7.589 -0.272 25149
292 1 1 . 1 1 54 54 GLN N N 54 118.463 118.463 123.047 -4.584 25149
293 1 1 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.014 -0.025 25149
294 1 1 . 1 1 54 54 GLN C C 54 176.300 176.300 177.102 -0.802 25149
295 1 1 . 1 1 54 54 GLN CA C 54 57.314 57.314 57.581 -0.267 25149
296 1 1 . 1 1 54 54 GLN CB C 54 28.823 28.823 28.664 0.159 25149
297 1 1 . 1 1 54 54 GLN H H 54 7.949 7.949 8.703 -0.754 25149
298 1 1 . 1 1 55 55 VAL N N 55 116.755 116.755 117.445 -0.690 25149
299 1 1 . 1 1 55 55 VAL HA H 55 3.884 3.884 3.737 0.147 25149
300 1 1 . 1 1 55 55 VAL C C 55 175.774 175.774 176.562 -0.788 25149
301 1 1 . 1 1 55 55 VAL CA C 55 63.210 63.210 64.274 -1.064 25149
302 1 1 . 1 1 55 55 VAL CB C 55 32.870 32.870 31.083 1.787 25149
303 1 1 . 1 1 55 55 VAL H H 55 7.801 7.801 8.033 -0.232 25149
304 1 1 . 1 1 56 56 GLN N N 56 120.192 120.192 118.449 1.743 25149
305 1 1 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.551 -0.434 25149
306 1 1 . 1 1 56 56 GLN C C 56 175.236 175.236 175.784 -0.548 25149
307 1 1 . 1 1 56 56 GLN CA C 56 55.697 55.697 55.633 0.064 25149
308 1 1 . 1 1 56 56 GLN CB C 56 29.319 29.319 29.931 -0.612 25149
309 1 1 . 1 1 56 56 GLN H H 56 8.018 8.018 8.031 -0.013 25149
310 1 1 . 1 1 57 57 GLN N N 57 121.276 121.276 120.812 0.464 25149
311 1 1 . 1 1 57 57 GLN HA H 57 4.204 4.204 4.232 -0.028 25149
312 1 1 . 1 1 57 57 GLN C C 57 175.819 175.819 175.536 0.283 25149
313 1 1 . 1 1 57 57 GLN CA C 57 55.617 55.617 55.628 -0.011 25149
314 1 1 . 1 1 57 57 GLN CB C 57 29.094 29.094 29.418 -0.324 25149
315 1 1 . 1 1 57 57 GLN H H 57 8.471 8.471 8.659 -0.188 25149
316 1 1 . 1 1 58 58 HIS N N 58 120.001 120.001 119.974 0.027 25149
317 1 1 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.360 0.814 25149
318 1 1 . 1 1 58 58 HIS C C 58 173.636 173.636 176.011 -2.375 25149
319 1 1 . 1 1 58 58 HIS CA C 58 54.353 54.353 57.350 -2.997 25149
320 1 1 . 1 1 58 58 HIS CB C 58 33.057 33.057 29.439 3.618 25149
321 1 1 . 1 1 58 58 HIS H H 58 8.366 8.366 7.847 0.519 25149
322 1 1 . 1 1 59 59 CYS N N 59 121.924 121.924 122.767 -0.843 25149
323 1 1 . 1 1 59 59 CYS HA H 59 4.442 4.442 3.976 0.466 25149
324 1 1 . 1 1 59 59 CYS C C 59 176.334 176.334 174.607 1.727 25149
325 1 1 . 1 1 59 59 CYS CA C 59 56.772 56.772 60.860 -4.088 25149
326 1 1 . 1 1 59 59 CYS CB C 59 32.642 32.642 28.444 4.198 25149
327 1 1 . 1 1 59 59 CYS H H 59 9.035 9.035 8.253 0.782 25149
328 1 1 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.278 -0.465 25149
329 1 1 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.462 0.199 25149
330 1 1 . 1 1 60 60 PRO CB C 60 30.659 30.659 31.214 -0.555 25149
331 1 1 . 1 1 61 61 MET N N 61 117.676 117.676 115.762 1.914 25149
332 1 1 . 1 1 61 61 MET HA H 61 4.317 4.317 4.394 -0.077 25149
333 1 1 . 1 1 61 61 MET C C 61 177.117 177.117 175.772 1.345 25149
334 1 1 . 1 1 61 61 MET CA C 61 56.408 56.408 55.527 0.881 25149
335 1 1 . 1 1 61 61 MET CB C 61 32.551 32.551 32.978 -0.427 25149
336 1 1 . 1 1 61 61 MET H H 61 9.135 9.135 7.357 1.778 25149
337 1 1 . 1 1 62 62 CYS N N 62 117.214 117.214 119.717 -2.503 25149
338 1 1 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.531 0.343 25149
339 1 1 . 1 1 62 62 CYS C C 62 175.740 175.740 175.434 0.306 25149
340 1 1 . 1 1 62 62 CYS CA C 62 58.273 58.273 57.437 0.836 25149
341 1 1 . 1 1 62 62 CYS CB C 62 32.776 32.776 30.519 2.257 25149
342 1 1 . 1 1 62 62 CYS H H 62 8.011 8.011 7.737 0.274 25149
343 1 1 . 1 1 63 63 ARG N N 63 116.555 116.555 119.721 -3.166 25149
344 1 1 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.333 -0.408 25149
345 1 1 . 1 1 63 63 ARG C C 63 175.326 175.326 175.492 -0.166 25149
346 1 1 . 1 1 63 63 ARG CA C 63 58.073 58.073 56.383 1.690 25149
347 1 1 . 1 1 63 63 ARG CB C 63 27.136 27.136 29.573 -2.438 25149
348 1 1 . 1 1 63 63 ARG H H 63 8.086 8.086 8.234 -0.148 25149
349 1 1 . 1 1 64 64 GLN N N 64 118.932 118.932 118.414 0.518 25149
350 1 1 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.549 -0.290 25149
351 1 1 . 1 1 64 64 GLN C C 64 176.054 176.054 175.732 0.322 25149
352 1 1 . 1 1 64 64 GLN CA C 64 56.316 56.316 54.317 1.999 25149
353 1 1 . 1 1 64 64 GLN CB C 64 30.083 30.083 29.517 0.566 25149
354 1 1 . 1 1 64 64 GLN H H 64 8.003 8.003 7.766 0.237 25149
355 1 1 . 1 1 65 65 GLU N N 65 122.038 122.038 123.055 -1.017 25149
356 1 1 . 1 1 65 65 GLU HA H 65 4.003 4.003 4.158 -0.155 25149
357 1 1 . 1 1 65 65 GLU C C 65 176.781 176.781 176.660 0.121 25149
358 1 1 . 1 1 65 65 GLU CA C 65 57.682 57.682 56.880 0.802 25149
359 1 1 . 1 1 65 65 GLU CB C 65 29.900 29.900 29.878 0.022 25149
360 1 1 . 1 1 65 65 GLU H H 65 8.657 8.657 8.743 -0.086 25149
361 1 1 . 1 1 66 66 TRP N N 66 125.730 125.730 128.466 -2.736 25149
362 1 1 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.293 0.111 25149
363 1 1 . 1 1 66 66 TRP C C 66 175.460 175.460 174.940 0.520 25149
364 1 1 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.782 -0.157 25149
365 1 1 . 1 1 66 66 TRP CB C 66 29.358 29.358 29.879 -0.521 25149
366 1 1 . 1 1 66 66 TRP H H 66 8.499 8.499 8.232 0.267 25149
367 1 1 . 1 1 67 67 LYS N N 67 127.396 127.396 127.387 0.009 25149
368 1 1 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.057 -0.039 25149
369 1 1 . 1 1 67 67 LYS C C 67 175.180 175.180 175.289 -0.109 25149
370 1 1 . 1 1 67 67 LYS CA C 67 54.514 54.514 54.004 0.510 25149
371 1 1 . 1 1 67 67 LYS CB C 67 36.231 36.231 34.392 1.839 25149
372 1 1 . 1 1 67 67 LYS H H 67 6.930 6.930 8.471 -1.541 25149
373 1 1 . 1 1 68 68 PHE N N 68 121.511 121.511 127.088 -5.577 25149
374 1 1 . 1 1 68 68 PHE HA H 68 4.108 4.108 3.983 0.125 25149
375 1 1 . 1 1 68 68 PHE C C 68 176.613 176.613 175.584 1.029 25149
376 1 1 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.877 2.084 25149
377 1 1 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.328 1.934 25149
378 1 1 . 1 1 68 68 PHE H H 68 8.430 8.430 8.531 -0.101 25149
379 1 1 . 1 1 69 69 LYS N N 69 124.210 124.210 122.026 2.184 25149
380 1 1 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.099 -0.104 25149
381 1 1 . 1 1 69 69 LYS C C 69 175.651 175.651 176.414 -0.763 25149
382 1 1 . 1 1 69 69 LYS CA C 69 57.320 57.320 57.005 0.315 25149
383 1 1 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.745 -0.384 25149
384 1 1 . 1 1 69 69 LYS H H 69 8.738 8.738 7.993 0.745 25149
385 1 2 . 1 1 2 2 SER HA H 2 4.417 4.417 4.616 -0.199 25149
386 1 2 . 1 1 2 2 SER CA C 2 58.322 58.322 58.178 0.144 25149
387 1 2 . 1 1 2 2 SER CB C 2 64.169 64.169 63.388 0.781 25149
388 1 2 . 1 1 3 3 VAL N N 3 121.214 121.214 123.036 -1.822 25149
389 1 2 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.253 -0.207 25149
390 1 2 . 1 1 3 3 VAL C C 3 175.879 175.879 175.020 0.859 25149
391 1 2 . 1 1 3 3 VAL CA C 3 62.138 62.138 61.865 0.273 25149
392 1 2 . 1 1 3 3 VAL CB C 3 32.958 32.958 32.005 0.953 25149
393 1 2 . 1 1 3 3 VAL H H 3 8.170 8.170 7.609 0.561 25149
394 1 2 . 1 1 4 4 ALA N N 4 127.312 127.312 130.032 -2.720 25149
395 1 2 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.600 -0.403 25149
396 1 2 . 1 1 4 4 ALA C C 4 177.497 177.497 175.504 1.993 25149
397 1 2 . 1 1 4 4 ALA CA C 4 52.439 52.439 51.708 0.731 25149
398 1 2 . 1 1 4 4 ALA CB C 4 19.424 19.424 21.202 -1.778 25149
399 1 2 . 1 1 4 4 ALA H H 4 8.294 8.294 8.152 0.142 25149
400 1 2 . 1 1 5 5 ASN N N 5 117.674 117.674 119.966 -2.292 25149
401 1 2 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.891 -0.326 25149
402 1 2 . 1 1 5 5 ASN C C 5 175.048 175.048 174.023 1.025 25149
403 1 2 . 1 1 5 5 ASN CA C 5 53.725 53.725 53.348 0.377 25149
404 1 2 . 1 1 5 5 ASN CB C 5 39.197 39.197 39.744 -0.547 25149
405 1 2 . 1 1 5 5 ASN H H 5 8.252 8.252 8.534 -0.282 25149
406 1 2 . 1 1 6 6 ASP N N 6 119.896 119.896 121.927 -2.031 25149
407 1 2 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.618 -0.098 25149
408 1 2 . 1 1 6 6 ASP C C 6 176.269 176.269 175.937 0.332 25149
409 1 2 . 1 1 6 6 ASP CA C 6 54.497 54.497 54.191 0.306 25149
410 1 2 . 1 1 6 6 ASP CB C 6 41.104 41.104 41.690 -0.586 25149
411 1 2 . 1 1 6 6 ASP H H 6 8.215 8.215 8.668 -0.453 25149
412 1 2 . 1 1 7 7 GLU N N 7 119.101 119.101 118.317 0.784 25149
413 1 2 . 1 1 7 7 GLU HA H 7 4.243 4.243 4.267 -0.024 25149
414 1 2 . 1 1 7 7 GLU C C 7 175.006 175.006 174.446 0.560 25149
415 1 2 . 1 1 7 7 GLU CA C 7 56.689 56.689 56.148 0.541 25149
416 1 2 . 1 1 7 7 GLU CB C 7 30.379 30.379 29.786 0.593 25149
417 1 2 . 1 1 7 7 GLU H H 7 8.065 8.065 8.375 -0.310 25149
418 1 2 . 1 1 8 8 ASN N N 8 116.852 116.852 116.062 0.790 25149
419 1 2 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.380 -0.222 25149
420 1 2 . 1 1 8 8 ASN C C 8 172.706 172.706 174.903 -2.197 25149
421 1 2 . 1 1 8 8 ASN CA C 8 51.165 51.165 51.822 -0.657 25149
422 1 2 . 1 1 8 8 ASN CB C 8 40.702 40.702 39.804 0.898 25149
423 1 2 . 1 1 8 8 ASN H H 8 7.505 7.505 7.678 -0.173 25149
424 1 2 . 1 1 9 9 CYS N N 9 122.855 122.855 121.556 1.299 25149
425 1 2 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.938 -0.144 25149
426 1 2 . 1 1 9 9 CYS C C 9 178.370 178.370 176.383 1.987 25149
427 1 2 . 1 1 9 9 CYS CA C 9 59.552 59.552 60.472 -0.920 25149
428 1 2 . 1 1 9 9 CYS CB C 9 31.526 31.526 28.709 2.817 25149
429 1 2 . 1 1 9 9 CYS H H 9 7.614 7.614 7.824 -0.210 25149
430 1 2 . 1 1 10 10 GLY N N 10 117.295 117.295 108.123 9.172 25149
431 1 2 . 1 1 10 10 GLY C C 10 174.111 174.111 174.743 -0.632 25149
432 1 2 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.618 1.349 25149
433 1 2 . 1 1 10 10 GLY H H 10 9.235 9.235 7.594 1.641 25149
434 1 2 . 1 1 11 11 ILE N N 11 119.811 119.811 120.197 -0.386 25149
435 1 2 . 1 1 11 11 ILE HA H 11 3.809 3.809 4.027 -0.218 25149
436 1 2 . 1 1 11 11 ILE C C 11 176.121 176.121 176.182 -0.061 25149
437 1 2 . 1 1 11 11 ILE CA C 11 64.041 64.041 63.834 0.207 25149
438 1 2 . 1 1 11 11 ILE CB C 11 39.411 39.411 38.781 0.630 25149
439 1 2 . 1 1 11 11 ILE H H 11 8.285 8.285 7.566 0.719 25149
440 1 2 . 1 1 12 12 CYS N N 12 116.728 116.728 115.151 1.577 25149
441 1 2 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.776 -0.200 25149
442 1 2 . 1 1 12 12 CYS C C 12 175.975 175.975 173.873 2.102 25149
443 1 2 . 1 1 12 12 CYS CA C 12 59.225 59.225 57.152 2.073 25149
444 1 2 . 1 1 12 12 CYS CB C 12 32.246 32.246 29.602 2.644 25149
445 1 2 . 1 1 12 12 CYS H H 12 7.607 7.607 7.759 -0.152 25149
446 1 2 . 1 1 13 13 ARG N N 13 116.073 116.073 116.514 -0.441 25149
447 1 2 . 1 1 13 13 ARG HA H 13 3.742 3.742 4.002 -0.260 25149
448 1 2 . 1 1 13 13 ARG C C 13 174.979 174.979 174.637 0.342 25149
449 1 2 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.934 0.702 25149
450 1 2 . 1 1 13 13 ARG CB C 13 26.326 26.326 27.082 -0.756 25149
451 1 2 . 1 1 13 13 ARG H H 13 7.987 7.987 8.061 -0.074 25149
452 1 2 . 1 1 14 14 MET N N 14 119.313 119.313 117.348 1.965 25149
453 1 2 . 1 1 14 14 MET HA H 14 4.547 4.547 4.574 -0.027 25149
454 1 2 . 1 1 14 14 MET C C 14 176.143 176.143 175.543 0.600 25149
455 1 2 . 1 1 14 14 MET CA C 14 54.208 54.208 54.156 0.052 25149
456 1 2 . 1 1 14 14 MET CB C 14 33.951 33.951 34.441 -0.490 25149
457 1 2 . 1 1 14 14 MET H H 14 8.624 8.624 7.615 1.009 25149
458 1 2 . 1 1 15 15 ALA N N 15 122.683 122.683 126.864 -4.181 25149
459 1 2 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.030 0.242 25149
460 1 2 . 1 1 15 15 ALA C C 15 180.117 180.117 178.492 1.625 25149
461 1 2 . 1 1 15 15 ALA CA C 15 52.346 52.346 52.090 0.256 25149
462 1 2 . 1 1 15 15 ALA CB C 15 19.487 19.487 19.245 0.242 25149
463 1 2 . 1 1 15 15 ALA H H 15 7.965 7.965 8.327 -0.362 25149
464 1 2 . 1 1 16 16 PHE N N 16 119.313 119.313 120.984 -1.671 25149
465 1 2 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.350 -0.309 25149
466 1 2 . 1 1 16 16 PHE C C 16 176.423 176.423 176.802 -0.379 25149
467 1 2 . 1 1 16 16 PHE CA C 16 59.130 59.130 59.223 -0.093 25149
468 1 2 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.158 0.232 25149
469 1 2 . 1 1 16 16 PHE H H 16 8.095 8.095 7.569 0.526 25149
470 1 2 . 1 1 17 17 ASN N N 17 112.313 112.313 115.577 -3.264 25149
471 1 2 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.863 -0.227 25149
472 1 2 . 1 1 17 17 ASN C C 17 175.337 175.337 175.419 -0.082 25149
473 1 2 . 1 1 17 17 ASN CA C 17 52.961 52.961 53.222 -0.261 25149
474 1 2 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.722 -1.548 25149
475 1 2 . 1 1 17 17 ASN H H 17 7.823 7.823 8.323 -0.500 25149
476 1 2 . 1 1 18 18 GLY N N 18 107.742 107.742 107.197 0.545 25149
477 1 2 . 1 1 18 18 GLY C C 18 173.759 173.759 172.292 1.467 25149
478 1 2 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.142 0.322 25149
479 1 2 . 1 1 18 18 GLY H H 18 7.579 7.579 7.961 -0.382 25149
480 1 2 . 1 1 19 19 CYS N N 19 117.050 117.050 119.487 -2.437 25149
481 1 2 . 1 1 19 19 CYS HA H 19 4.571 4.571 4.729 -0.158 25149
482 1 2 . 1 1 19 19 CYS C C 19 174.039 174.039 175.382 -1.343 25149
483 1 2 . 1 1 19 19 CYS CA C 19 58.433 58.433 57.659 0.774 25149
484 1 2 . 1 1 19 19 CYS CB C 19 30.681 30.681 29.456 1.225 25149
485 1 2 . 1 1 19 19 CYS H H 19 8.198 8.198 8.368 -0.170 25149
486 1 2 . 1 1 20 20 CYS N N 20 123.923 123.923 123.800 0.123 25149
487 1 2 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.128 -0.117 25149
488 1 2 . 1 1 20 20 CYS C C 20 173.736 173.736 175.442 -1.706 25149
489 1 2 . 1 1 20 20 CYS CA C 20 57.999 57.999 58.450 -0.451 25149
490 1 2 . 1 1 20 20 CYS CB C 20 28.205 28.205 26.353 1.852 25149
491 1 2 . 1 1 20 20 CYS H H 20 8.466 8.466 8.632 -0.166 25149
492 1 2 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.303 -0.274 25149
493 1 2 . 1 1 21 21 PRO CA C 21 65.426 65.426 65.071 0.355 25149
494 1 2 . 1 1 21 21 PRO CB C 21 32.801 32.801 32.190 0.612 25149
495 1 2 . 1 1 22 22 ASP N N 22 117.053 117.053 117.881 -0.828 25149
496 1 2 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.591 -0.086 25149
497 1 2 . 1 1 22 22 ASP C C 22 176.501 176.501 175.359 1.142 25149
498 1 2 . 1 1 22 22 ASP CA C 22 55.017 55.017 54.303 0.714 25149
499 1 2 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.682 1.839 25149
500 1 2 . 1 1 22 22 ASP H H 22 8.395 8.395 8.540 -0.145 25149
501 1 2 . 1 1 23 23 CYS N N 23 123.353 123.353 119.018 4.335 25149
502 1 2 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.466 -0.173 25149
503 1 2 . 1 1 23 23 CYS C C 23 175.214 175.214 175.443 -0.229 25149
504 1 2 . 1 1 23 23 CYS CA C 23 61.633 61.633 57.814 3.819 25149
505 1 2 . 1 1 23 23 CYS CB C 23 31.542 31.542 29.578 1.964 25149
506 1 2 . 1 1 23 23 CYS H H 23 7.246 7.246 7.085 0.161 25149
507 1 2 . 1 1 24 24 LYS N N 24 117.539 117.539 128.340 -10.801 25149
508 1 2 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.057 0.173 25149
509 1 2 . 1 1 24 24 LYS C C 24 177.106 177.106 176.979 0.127 25149
510 1 2 . 1 1 24 24 LYS CA C 24 56.921 56.921 57.078 -0.157 25149
511 1 2 . 1 1 24 24 LYS CB C 24 34.615 34.615 31.880 2.735 25149
512 1 2 . 1 1 24 24 LYS H H 24 8.173 8.173 8.602 -0.429 25149
513 1 2 . 1 1 25 25 VAL N N 25 120.661 120.661 121.459 -0.798 25149
514 1 2 . 1 1 25 25 VAL HA H 25 4.429 4.429 3.821 0.608 25149
515 1 2 . 1 1 25 25 VAL C C 25 174.027 174.027 174.377 -0.350 25149
516 1 2 . 1 1 25 25 VAL CA C 25 59.934 59.934 62.395 -2.461 25149
517 1 2 . 1 1 25 25 VAL CB C 25 33.507 33.507 31.492 2.015 25149
518 1 2 . 1 1 25 25 VAL H H 25 7.787 7.787 7.534 0.253 25149
519 1 2 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.475 -0.139 25149
520 1 2 . 1 1 26 26 PRO CA C 26 63.279 63.279 63.619 -0.340 25149
521 1 2 . 1 1 26 26 PRO CB C 26 32.077 32.077 32.263 -0.186 25149
522 1 2 . 1 1 27 27 GLY N N 27 109.926 109.926 108.088 1.838 25149
523 1 2 . 1 1 27 27 GLY C C 27 175.169 175.169 172.623 2.546 25149
524 1 2 . 1 1 27 27 GLY CA C 27 45.042 45.042 45.211 -0.169 25149
525 1 2 . 1 1 27 27 GLY H H 27 8.569 8.569 7.655 0.914 25149
526 1 2 . 1 1 28 28 ASP N N 28 122.592 122.592 118.513 4.079 25149
527 1 2 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.814 -0.583 25149
528 1 2 . 1 1 28 28 ASP C C 28 176.602 176.602 175.447 1.155 25149
529 1 2 . 1 1 28 28 ASP CA C 28 56.402 56.402 54.264 2.138 25149
530 1 2 . 1 1 28 28 ASP CB C 28 40.912 40.912 42.080 -1.168 25149
531 1 2 . 1 1 28 28 ASP H H 28 8.214 8.214 8.354 -0.140 25149
532 1 2 . 1 1 29 29 ASP N N 29 117.500 117.500 121.920 -4.420 25149
533 1 2 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.787 -0.340 25149
534 1 2 . 1 1 29 29 ASP C C 29 175.505 175.505 175.675 -0.170 25149
535 1 2 . 1 1 29 29 ASP CA C 29 55.266 55.266 53.997 1.269 25149
536 1 2 . 1 1 29 29 ASP CB C 29 41.225 41.225 40.097 1.128 25149
537 1 2 . 1 1 29 29 ASP H H 29 8.271 8.271 8.368 -0.097 25149
538 1 2 . 1 1 30 30 CYS N N 30 124.470 124.470 121.871 2.599 25149
539 1 2 . 1 1 30 30 CYS HA H 30 4.390 4.390 4.880 -0.490 25149
540 1 2 . 1 1 30 30 CYS C C 30 171.755 171.755 172.771 -1.016 25149
541 1 2 . 1 1 30 30 CYS CA C 30 57.676 57.676 56.124 1.552 25149
542 1 2 . 1 1 30 30 CYS CB C 30 29.154 29.154 28.657 0.497 25149
543 1 2 . 1 1 30 30 CYS H H 30 7.912 7.912 8.459 -0.547 25149
544 1 2 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.591 0.096 25149
545 1 2 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.529 0.346 25149
546 1 2 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.308 1.676 25149
547 1 2 . 1 1 32 32 LEU N N 32 120.023 120.023 117.487 2.536 25149
548 1 2 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.591 0.125 25149
549 1 2 . 1 1 32 32 LEU C C 32 176.300 176.300 175.435 0.865 25149
550 1 2 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.712 0.209 25149
551 1 2 . 1 1 32 32 LEU CB C 32 43.336 43.336 43.017 0.319 25149
552 1 2 . 1 1 32 32 LEU H H 32 8.580 8.580 7.938 0.642 25149
553 1 2 . 1 1 33 33 VAL N N 33 116.217 116.217 117.608 -1.391 25149
554 1 2 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.407 0.256 25149
555 1 2 . 1 1 33 33 VAL C C 33 171.374 171.374 173.716 -2.342 25149
556 1 2 . 1 1 33 33 VAL CA C 33 60.449 60.449 60.836 -0.387 25149
557 1 2 . 1 1 33 33 VAL CB C 33 36.448 36.448 35.934 0.514 25149
558 1 2 . 1 1 33 33 VAL H H 33 8.594 8.594 7.972 0.622 25149
559 1 2 . 1 1 34 34 TRP N N 34 122.711 122.711 125.903 -3.192 25149
560 1 2 . 1 1 34 34 TRP HA H 34 5.339 5.339 5.134 0.205 25149
561 1 2 . 1 1 34 34 TRP C C 34 176.770 176.770 175.658 1.112 25149
562 1 2 . 1 1 34 34 TRP CA C 34 57.267 57.267 55.762 1.505 25149
563 1 2 . 1 1 34 34 TRP CB C 34 33.780 33.780 32.930 0.850 25149
564 1 2 . 1 1 34 34 TRP H H 34 8.756 8.756 8.695 0.061 25149
565 1 2 . 1 1 35 35 GLY N N 35 107.569 107.569 107.277 0.292 25149
566 1 2 . 1 1 35 35 GLY C C 35 177.397 177.397 173.791 3.606 25149
567 1 2 . 1 1 35 35 GLY CA C 35 44.070 44.070 44.010 0.061 25149
568 1 2 . 1 1 35 35 GLY H H 35 8.857 8.857 8.391 0.466 25149
569 1 2 . 1 1 36 36 GLN N N 36 122.723 122.723 117.991 4.732 25149
570 1 2 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.064 -0.318 25149
571 1 2 . 1 1 36 36 GLN C C 36 176.445 176.445 176.157 0.288 25149
572 1 2 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.239 0.190 25149
573 1 2 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.490 -0.859 25149
574 1 2 . 1 1 36 36 GLN H H 36 8.338 8.338 8.352 -0.014 25149
575 1 2 . 1 1 37 37 CYS N N 37 115.763 115.763 115.122 0.641 25149
576 1 2 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.894 -0.610 25149
577 1 2 . 1 1 37 37 CYS C C 37 175.281 175.281 175.217 0.064 25149
578 1 2 . 1 1 37 37 CYS CA C 37 58.395 58.395 55.968 2.427 25149
579 1 2 . 1 1 37 37 CYS CB C 37 31.143 31.143 30.835 0.308 25149
580 1 2 . 1 1 37 37 CYS H H 37 7.622 7.622 7.844 -0.222 25149
581 1 2 . 1 1 38 38 SER N N 38 114.540 114.540 114.597 -0.057 25149
582 1 2 . 1 1 38 38 SER HA H 38 4.004 4.004 4.341 -0.337 25149
583 1 2 . 1 1 38 38 SER C C 38 173.389 173.389 174.266 -0.877 25149
584 1 2 . 1 1 38 38 SER CA C 38 62.285 62.285 59.952 2.333 25149
585 1 2 . 1 1 38 38 SER H H 38 7.716 7.716 8.592 -0.876 25149
586 1 2 . 1 1 39 39 HIS N N 39 121.947 121.947 120.825 1.122 25149
587 1 2 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.527 -0.083 25149
588 1 2 . 1 1 39 39 HIS C C 39 172.326 172.326 173.592 -1.266 25149
589 1 2 . 1 1 39 39 HIS CA C 39 61.320 61.320 57.205 4.115 25149
590 1 2 . 1 1 39 39 HIS CB C 39 31.523 31.523 30.317 1.206 25149
591 1 2 . 1 1 39 39 HIS H H 39 7.829 7.829 7.942 -0.113 25149
592 1 2 . 1 1 40 40 CYS N N 40 121.859 121.859 124.008 -2.149 25149
593 1 2 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.605 0.004 25149
594 1 2 . 1 1 40 40 CYS C C 40 171.900 171.900 172.471 -0.571 25149
595 1 2 . 1 1 40 40 CYS CA C 40 55.791 55.791 55.845 -0.054 25149
596 1 2 . 1 1 40 40 CYS CB C 40 28.964 28.964 27.835 1.129 25149
597 1 2 . 1 1 40 40 CYS H H 40 8.049 8.049 8.693 -0.644 25149
598 1 2 . 1 1 41 41 PHE N N 41 120.690 120.690 120.828 -0.138 25149
599 1 2 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.584 0.593 25149
600 1 2 . 1 1 41 41 PHE C C 41 176.613 176.613 175.222 1.391 25149
601 1 2 . 1 1 41 41 PHE CA C 41 56.033 56.033 54.901 1.132 25149
602 1 2 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.263 2.497 25149
603 1 2 . 1 1 41 41 PHE H H 41 8.368 8.368 8.398 -0.030 25149
604 1 2 . 1 1 42 42 HIS N N 42 117.057 117.057 122.384 -5.327 25149
605 1 2 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.324 0.345 25149
606 1 2 . 1 1 42 42 HIS C C 42 177.464 177.464 176.367 1.097 25149
607 1 2 . 1 1 42 42 HIS CA C 42 60.425 60.425 56.686 3.739 25149
608 1 2 . 1 1 42 42 HIS CB C 42 29.740 29.740 29.923 -0.183 25149
609 1 2 . 1 1 42 42 HIS H H 42 8.384 8.384 7.847 0.537 25149
610 1 2 . 1 1 43 43 MET N N 43 128.543 128.543 125.814 2.729 25149
611 1 2 . 1 1 43 43 MET HA H 43 3.965 3.965 3.982 -0.017 25149
612 1 2 . 1 1 43 43 MET C C 43 177.845 177.845 177.483 0.362 25149
613 1 2 . 1 1 43 43 MET CA C 43 59.209 59.209 60.233 -1.024 25149
614 1 2 . 1 1 43 43 MET CB C 43 33.009 33.009 32.578 0.431 25149
615 1 2 . 1 1 43 43 MET H H 43 9.439 9.439 8.356 1.083 25149
616 1 2 . 1 1 44 44 HIS N N 44 116.500 116.500 117.009 -0.509 25149
617 1 2 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.181 0.075 25149
618 1 2 . 1 1 44 44 HIS C C 44 178.405 178.405 177.726 0.679 25149
619 1 2 . 1 1 44 44 HIS CA C 44 58.793 58.793 58.997 -0.204 25149
620 1 2 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.188 3.559 25149
621 1 2 . 1 1 44 44 HIS H H 44 9.747 9.747 7.986 1.761 25149
622 1 2 . 1 1 45 45 CYS N N 45 115.950 115.950 117.344 -1.394 25149
623 1 2 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.190 -0.190 25149
624 1 2 . 1 1 45 45 CYS C C 45 177.957 177.957 177.064 0.893 25149
625 1 2 . 1 1 45 45 CYS CA C 45 62.923 62.923 62.709 0.214 25149
626 1 2 . 1 1 45 45 CYS CB C 45 29.102 29.102 26.677 2.425 25149
627 1 2 . 1 1 45 45 CYS H H 45 6.845 6.845 8.266 -1.421 25149
628 1 2 . 1 1 46 46 ILE N N 46 119.362 119.362 121.358 -1.996 25149
629 1 2 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.720 -0.055 25149
630 1 2 . 1 1 46 46 ILE C C 46 176.613 176.613 177.812 -1.199 25149
631 1 2 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.522 -4.280 25149
632 1 2 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.771 -0.452 25149
633 1 2 . 1 1 46 46 ILE H H 46 7.816 7.816 7.936 -0.120 25149
634 1 2 . 1 1 47 47 LEU N N 47 122.180 122.180 120.259 1.921 25149
635 1 2 . 1 1 47 47 LEU HA H 47 3.873 3.873 4.203 -0.330 25149
636 1 2 . 1 1 47 47 LEU C C 47 179.726 179.726 178.945 0.781 25149
637 1 2 . 1 1 47 47 LEU CA C 47 58.633 58.633 59.136 -0.503 25149
638 1 2 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.898 -0.775 25149
639 1 2 . 1 1 47 47 LEU H H 47 8.266 8.266 8.687 -0.421 25149
640 1 2 . 1 1 48 48 LYS N N 48 118.251 118.251 118.735 -0.484 25149
641 1 2 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.265 -0.401 25149
642 1 2 . 1 1 48 48 LYS C C 48 179.423 179.423 178.818 0.605 25149
643 1 2 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.903 0.084 25149
644 1 2 . 1 1 48 48 LYS CB C 48 32.765 32.765 32.068 0.697 25149
645 1 2 . 1 1 48 48 LYS H H 48 7.147 7.147 8.229 -1.082 25149
646 1 2 . 1 1 49 49 TRP N N 49 120.745 120.745 121.410 -0.665 25149
647 1 2 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.354 -0.274 25149
648 1 2 . 1 1 49 49 TRP C C 49 178.147 178.147 177.711 0.436 25149
649 1 2 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.859 -0.314 25149
650 1 2 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.353 0.062 25149
651 1 2 . 1 1 49 49 TRP H H 49 7.709 7.709 8.121 -0.412 25149
652 1 2 . 1 1 50 50 LEU N N 50 117.236 117.236 117.173 0.063 25149
653 1 2 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.602 0.003 25149
654 1 2 . 1 1 50 50 LEU C C 50 179.658 179.658 177.166 2.492 25149
655 1 2 . 1 1 50 50 LEU CA C 50 57.330 57.330 55.030 2.300 25149
656 1 2 . 1 1 50 50 LEU CB C 50 41.416 41.416 42.135 -0.719 25149
657 1 2 . 1 1 50 50 LEU H H 50 8.512 8.512 7.886 0.626 25149
658 1 2 . 1 1 51 51 HIS N N 51 115.650 115.650 118.203 -2.553 25149
659 1 2 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.439 -0.165 25149
660 1 2 . 1 1 51 51 HIS C C 51 175.942 175.942 176.377 -0.435 25149
661 1 2 . 1 1 51 51 HIS CA C 51 57.320 57.320 57.788 -0.468 25149
662 1 2 . 1 1 51 51 HIS CB C 51 29.487 29.487 30.146 -0.659 25149
663 1 2 . 1 1 51 51 HIS H H 51 7.713 7.713 8.429 -0.716 25149
664 1 2 . 1 1 52 52 ALA N N 52 119.779 119.779 121.127 -1.348 25149
665 1 2 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.186 -0.163 25149
666 1 2 . 1 1 52 52 ALA C C 52 177.834 177.834 176.293 1.541 25149
667 1 2 . 1 1 52 52 ALA CA C 52 52.865 52.865 53.676 -0.811 25149
668 1 2 . 1 1 52 52 ALA CB C 52 18.951 18.951 19.610 -0.659 25149
669 1 2 . 1 1 52 52 ALA H H 52 7.191 7.191 7.976 -0.785 25149
670 1 2 . 1 1 53 53 GLN N N 53 117.047 117.047 115.787 1.260 25149
671 1 2 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.391 -0.458 25149
672 1 2 . 1 1 53 53 GLN C C 53 175.998 175.998 174.770 1.228 25149
673 1 2 . 1 1 53 53 GLN CA C 53 55.482 55.482 54.715 0.767 25149
674 1 2 . 1 1 53 53 GLN CB C 53 28.887 28.887 30.783 -1.896 25149
675 1 2 . 1 1 53 53 GLN H H 53 7.317 7.317 7.200 0.117 25149
676 1 2 . 1 1 54 54 GLN N N 54 118.463 118.463 120.800 -2.337 25149
677 1 2 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.269 -0.280 25149
678 1 2 . 1 1 54 54 GLN C C 54 176.300 176.300 176.173 0.127 25149
679 1 2 . 1 1 54 54 GLN CA C 54 57.314 57.314 56.240 1.074 25149
680 1 2 . 1 1 54 54 GLN CB C 54 28.823 28.823 28.729 0.094 25149
681 1 2 . 1 1 54 54 GLN H H 54 7.949 7.949 8.535 -0.586 25149
682 1 2 . 1 1 55 55 VAL N N 55 116.755 116.755 119.664 -2.909 25149
683 1 2 . 1 1 55 55 VAL HA H 55 3.884 3.884 3.750 0.134 25149
684 1 2 . 1 1 55 55 VAL C C 55 175.774 175.774 176.669 -0.895 25149
685 1 2 . 1 1 55 55 VAL CA C 55 63.210 63.210 64.573 -1.363 25149
686 1 2 . 1 1 55 55 VAL CB C 55 32.870 32.870 31.635 1.235 25149
687 1 2 . 1 1 55 55 VAL H H 55 7.801 7.801 7.871 -0.070 25149
688 1 2 . 1 1 56 56 GLN N N 56 120.192 120.192 118.101 2.091 25149
689 1 2 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.550 -0.433 25149
690 1 2 . 1 1 56 56 GLN C C 56 175.236 175.236 175.489 -0.253 25149
691 1 2 . 1 1 56 56 GLN CA C 56 55.697 55.697 55.338 0.359 25149
692 1 2 . 1 1 56 56 GLN CB C 56 29.319 29.319 30.041 -0.722 25149
693 1 2 . 1 1 56 56 GLN H H 56 8.018 8.018 7.942 0.076 25149
694 1 2 . 1 1 57 57 GLN N N 57 121.276 121.276 120.627 0.649 25149
695 1 2 . 1 1 57 57 GLN HA H 57 4.204 4.204 4.238 -0.034 25149
696 1 2 . 1 1 57 57 GLN C C 57 175.819 175.819 175.602 0.217 25149
697 1 2 . 1 1 57 57 GLN CA C 57 55.617 55.617 55.711 -0.094 25149
698 1 2 . 1 1 57 57 GLN CB C 57 29.094 29.094 29.154 -0.060 25149
699 1 2 . 1 1 57 57 GLN H H 57 8.471 8.471 8.694 -0.223 25149
700 1 2 . 1 1 58 58 HIS N N 58 120.001 120.001 119.228 0.773 25149
701 1 2 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.385 0.789 25149
702 1 2 . 1 1 58 58 HIS C C 58 173.636 173.636 176.143 -2.507 25149
703 1 2 . 1 1 58 58 HIS CA C 58 54.353 54.353 57.052 -2.699 25149
704 1 2 . 1 1 58 58 HIS CB C 58 33.057 33.057 29.137 3.920 25149
705 1 2 . 1 1 58 58 HIS H H 58 8.366 8.366 8.129 0.237 25149
706 1 2 . 1 1 59 59 CYS N N 59 121.924 121.924 122.625 -0.701 25149
707 1 2 . 1 1 59 59 CYS HA H 59 4.442 4.442 4.092 0.350 25149
708 1 2 . 1 1 59 59 CYS C C 59 176.334 176.334 174.953 1.381 25149
709 1 2 . 1 1 59 59 CYS CA C 59 56.772 56.772 60.273 -3.501 25149
710 1 2 . 1 1 59 59 CYS CB C 59 32.642 32.642 27.665 4.977 25149
711 1 2 . 1 1 59 59 CYS H H 59 9.035 9.035 8.240 0.795 25149
712 1 2 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.316 -0.503 25149
713 1 2 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.940 -0.279 25149
714 1 2 . 1 1 60 60 PRO CB C 60 30.659 30.659 31.287 -0.628 25149
715 1 2 . 1 1 61 61 MET N N 61 117.676 117.676 117.096 0.580 25149
716 1 2 . 1 1 61 61 MET HA H 61 4.317 4.317 4.394 -0.077 25149
717 1 2 . 1 1 61 61 MET C C 61 177.117 177.117 176.219 0.898 25149
718 1 2 . 1 1 61 61 MET CA C 61 56.408 56.408 55.871 0.537 25149
719 1 2 . 1 1 61 61 MET CB C 61 32.551 32.551 32.450 0.101 25149
720 1 2 . 1 1 61 61 MET H H 61 9.135 9.135 7.440 1.695 25149
721 1 2 . 1 1 62 62 CYS N N 62 117.214 117.214 118.204 -0.990 25149
722 1 2 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.574 0.300 25149
723 1 2 . 1 1 62 62 CYS C C 62 175.740 175.740 175.365 0.375 25149
724 1 2 . 1 1 62 62 CYS CA C 62 58.273 58.273 57.337 0.936 25149
725 1 2 . 1 1 62 62 CYS CB C 62 32.776 32.776 30.244 2.532 25149
726 1 2 . 1 1 62 62 CYS H H 62 8.011 8.011 7.713 0.298 25149
727 1 2 . 1 1 63 63 ARG N N 63 116.555 116.555 119.558 -3.003 25149
728 1 2 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.242 -0.317 25149
729 1 2 . 1 1 63 63 ARG C C 63 175.326 175.326 176.284 -0.958 25149
730 1 2 . 1 1 63 63 ARG CA C 63 58.073 58.073 56.843 1.230 25149
731 1 2 . 1 1 63 63 ARG CB C 63 27.136 27.136 30.348 -3.212 25149
732 1 2 . 1 1 63 63 ARG H H 63 8.086 8.086 8.321 -0.235 25149
733 1 2 . 1 1 64 64 GLN N N 64 118.932 118.932 120.820 -1.888 25149
734 1 2 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.270 -0.011 25149
735 1 2 . 1 1 64 64 GLN C C 64 176.054 176.054 176.097 -0.043 25149
736 1 2 . 1 1 64 64 GLN CA C 64 56.316 56.316 56.291 0.025 25149
737 1 2 . 1 1 64 64 GLN CB C 64 30.083 30.083 28.802 1.281 25149
738 1 2 . 1 1 64 64 GLN H H 64 8.003 8.003 8.099 -0.096 25149
739 1 2 . 1 1 65 65 GLU N N 65 122.038 122.038 121.553 0.485 25149
740 1 2 . 1 1 65 65 GLU HA H 65 4.003 4.003 4.080 -0.077 25149
741 1 2 . 1 1 65 65 GLU C C 65 176.781 176.781 175.930 0.851 25149
742 1 2 . 1 1 65 65 GLU CA C 65 57.682 57.682 56.396 1.286 25149
743 1 2 . 1 1 65 65 GLU CB C 65 29.900 29.900 28.669 1.231 25149
744 1 2 . 1 1 65 65 GLU H H 65 8.657 8.657 8.560 0.097 25149
745 1 2 . 1 1 66 66 TRP N N 66 125.730 125.730 128.552 -2.822 25149
746 1 2 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.231 0.173 25149
747 1 2 . 1 1 66 66 TRP C C 66 175.460 175.460 175.566 -0.106 25149
748 1 2 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.500 0.125 25149
749 1 2 . 1 1 66 66 TRP CB C 66 29.358 29.358 29.988 -0.630 25149
750 1 2 . 1 1 66 66 TRP H H 66 8.499 8.499 8.062 0.437 25149
751 1 2 . 1 1 67 67 LYS N N 67 127.396 127.396 126.825 0.571 25149
752 1 2 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.000 0.018 25149
753 1 2 . 1 1 67 67 LYS C C 67 175.180 175.180 175.383 -0.203 25149
754 1 2 . 1 1 67 67 LYS CA C 67 54.514 54.514 53.827 0.687 25149
755 1 2 . 1 1 67 67 LYS CB C 67 36.231 36.231 34.748 1.483 25149
756 1 2 . 1 1 67 67 LYS H H 67 6.930 6.930 8.612 -1.682 25149
757 1 2 . 1 1 68 68 PHE N N 68 121.511 121.511 124.127 -2.616 25149
758 1 2 . 1 1 68 68 PHE HA H 68 4.108 4.108 3.930 0.178 25149
759 1 2 . 1 1 68 68 PHE C C 68 176.613 176.613 175.176 1.437 25149
760 1 2 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.702 2.259 25149
761 1 2 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.466 1.796 25149
762 1 2 . 1 1 68 68 PHE H H 68 8.430 8.430 8.503 -0.073 25149
763 1 2 . 1 1 69 69 LYS N N 69 124.210 124.210 121.984 2.226 25149
764 1 2 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.062 -0.067 25149
765 1 2 . 1 1 69 69 LYS C C 69 175.651 175.651 176.301 -0.650 25149
766 1 2 . 1 1 69 69 LYS CA C 69 57.320 57.320 57.091 0.229 25149
767 1 2 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.457 -0.096 25149
768 1 2 . 1 1 69 69 LYS H H 69 8.738 8.738 7.957 0.781 25149
769 1 3 . 1 1 2 2 SER HA H 2 4.417 4.417 4.878 -0.461 25149
770 1 3 . 1 1 2 2 SER CA C 2 58.322 58.322 58.358 -0.036 25149
771 1 3 . 1 1 2 2 SER CB C 2 64.169 64.169 64.108 0.062 25149
772 1 3 . 1 1 3 3 VAL N N 3 121.214 121.214 123.333 -2.119 25149
773 1 3 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.320 -0.274 25149
774 1 3 . 1 1 3 3 VAL C C 3 175.879 175.879 174.078 1.801 25149
775 1 3 . 1 1 3 3 VAL CA C 3 62.138 62.138 62.537 -0.399 25149
776 1 3 . 1 1 3 3 VAL CB C 3 32.958 32.958 34.429 -1.471 25149
777 1 3 . 1 1 3 3 VAL H H 3 8.170 8.170 8.239 -0.069 25149
778 1 3 . 1 1 4 4 ALA N N 4 127.312 127.312 127.355 -0.043 25149
779 1 3 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.551 -0.354 25149
780 1 3 . 1 1 4 4 ALA C C 4 177.497 177.497 174.810 2.687 25149
781 1 3 . 1 1 4 4 ALA CA C 4 52.439 52.439 51.844 0.595 25149
782 1 3 . 1 1 4 4 ALA CB C 4 19.424 19.424 21.632 -2.208 25149
783 1 3 . 1 1 4 4 ALA H H 4 8.294 8.294 8.740 -0.446 25149
784 1 3 . 1 1 5 5 ASN N N 5 117.674 117.674 118.001 -0.327 25149
785 1 3 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.704 -0.139 25149
786 1 3 . 1 1 5 5 ASN C C 5 175.048 175.048 175.384 -0.336 25149
787 1 3 . 1 1 5 5 ASN CA C 5 53.725 53.725 54.069 -0.344 25149
788 1 3 . 1 1 5 5 ASN CB C 5 39.197 39.197 39.388 -0.191 25149
789 1 3 . 1 1 5 5 ASN H H 5 8.252 8.252 8.473 -0.221 25149
790 1 3 . 1 1 6 6 ASP N N 6 119.896 119.896 115.756 4.140 25149
791 1 3 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.328 0.192 25149
792 1 3 . 1 1 6 6 ASP C C 6 176.269 176.269 176.178 0.091 25149
793 1 3 . 1 1 6 6 ASP CA C 6 54.497 54.497 55.675 -1.178 25149
794 1 3 . 1 1 6 6 ASP CB C 6 41.104 41.104 39.602 1.502 25149
795 1 3 . 1 1 6 6 ASP H H 6 8.215 8.215 8.673 -0.458 25149
796 1 3 . 1 1 7 7 GLU N N 7 119.101 119.101 114.317 4.784 25149
797 1 3 . 1 1 7 7 GLU HA H 7 4.243 4.243 4.094 0.149 25149
798 1 3 . 1 1 7 7 GLU C C 7 175.006 175.006 174.541 0.465 25149
799 1 3 . 1 1 7 7 GLU CA C 7 56.689 56.689 57.481 -0.792 25149
800 1 3 . 1 1 7 7 GLU CB C 7 30.379 30.379 29.799 0.580 25149
801 1 3 . 1 1 7 7 GLU H H 7 8.065 8.065 8.137 -0.072 25149
802 1 3 . 1 1 8 8 ASN N N 8 116.852 116.852 115.737 1.115 25149
803 1 3 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.462 -0.304 25149
804 1 3 . 1 1 8 8 ASN C C 8 172.706 172.706 174.903 -2.197 25149
805 1 3 . 1 1 8 8 ASN CA C 8 51.165 51.165 50.996 0.169 25149
806 1 3 . 1 1 8 8 ASN CB C 8 40.702 40.702 39.265 1.437 25149
807 1 3 . 1 1 8 8 ASN H H 8 7.505 7.505 7.521 -0.016 25149
808 1 3 . 1 1 9 9 CYS N N 9 122.855 122.855 121.477 1.378 25149
809 1 3 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.703 0.091 25149
810 1 3 . 1 1 9 9 CYS C C 9 178.370 178.370 176.514 1.856 25149
811 1 3 . 1 1 9 9 CYS CA C 9 59.552 59.552 60.936 -1.384 25149
812 1 3 . 1 1 9 9 CYS CB C 9 31.526 31.526 29.076 2.450 25149
813 1 3 . 1 1 9 9 CYS H H 9 7.614 7.614 7.633 -0.019 25149
814 1 3 . 1 1 10 10 GLY N N 10 117.295 117.295 110.392 6.903 25149
815 1 3 . 1 1 10 10 GLY C C 10 174.111 174.111 175.217 -1.106 25149
816 1 3 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.766 1.201 25149
817 1 3 . 1 1 10 10 GLY H H 10 9.235 9.235 7.833 1.402 25149
818 1 3 . 1 1 11 11 ILE N N 11 119.811 119.811 121.283 -1.472 25149
819 1 3 . 1 1 11 11 ILE HA H 11 3.809 3.809 4.069 -0.260 25149
820 1 3 . 1 1 11 11 ILE C C 11 176.121 176.121 176.049 0.072 25149
821 1 3 . 1 1 11 11 ILE CA C 11 64.041 64.041 64.173 -0.132 25149
822 1 3 . 1 1 11 11 ILE CB C 11 39.411 39.411 38.817 0.594 25149
823 1 3 . 1 1 11 11 ILE H H 11 8.285 8.285 7.407 0.878 25149
824 1 3 . 1 1 12 12 CYS N N 12 116.728 116.728 115.943 0.785 25149
825 1 3 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.597 -0.021 25149
826 1 3 . 1 1 12 12 CYS C C 12 175.975 175.975 173.857 2.118 25149
827 1 3 . 1 1 12 12 CYS CA C 12 59.225 59.225 57.605 1.619 25149
828 1 3 . 1 1 12 12 CYS CB C 12 32.246 32.246 29.807 2.439 25149
829 1 3 . 1 1 12 12 CYS H H 12 7.607 7.607 7.748 -0.141 25149
830 1 3 . 1 1 13 13 ARG N N 13 116.073 116.073 117.496 -1.423 25149
831 1 3 . 1 1 13 13 ARG HA H 13 3.742 3.742 4.009 -0.267 25149
832 1 3 . 1 1 13 13 ARG C C 13 174.979 174.979 174.621 0.358 25149
833 1 3 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.675 0.961 25149
834 1 3 . 1 1 13 13 ARG CB C 13 26.326 26.326 26.392 -0.066 25149
835 1 3 . 1 1 13 13 ARG H H 13 7.987 7.987 8.231 -0.244 25149
836 1 3 . 1 1 14 14 MET N N 14 119.313 119.313 118.314 0.999 25149
837 1 3 . 1 1 14 14 MET HA H 14 4.547 4.547 4.585 -0.038 25149
838 1 3 . 1 1 14 14 MET C C 14 176.143 176.143 174.965 1.178 25149
839 1 3 . 1 1 14 14 MET CA C 14 54.208 54.208 54.641 -0.433 25149
840 1 3 . 1 1 14 14 MET CB C 14 33.951 33.951 35.391 -1.440 25149
841 1 3 . 1 1 14 14 MET H H 14 8.624 8.624 7.567 1.057 25149
842 1 3 . 1 1 15 15 ALA N N 15 122.683 122.683 125.742 -3.059 25149
843 1 3 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.175 0.097 25149
844 1 3 . 1 1 15 15 ALA C C 15 180.117 180.117 178.170 1.947 25149
845 1 3 . 1 1 15 15 ALA CA C 15 52.346 52.346 51.390 0.956 25149
846 1 3 . 1 1 15 15 ALA CB C 15 19.487 19.487 19.370 0.117 25149
847 1 3 . 1 1 15 15 ALA H H 15 7.965 7.965 8.351 -0.386 25149
848 1 3 . 1 1 16 16 PHE N N 16 119.313 119.313 121.372 -2.059 25149
849 1 3 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.088 -0.047 25149
850 1 3 . 1 1 16 16 PHE C C 16 176.423 176.423 176.344 0.079 25149
851 1 3 . 1 1 16 16 PHE CA C 16 59.130 59.130 59.334 -0.204 25149
852 1 3 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.381 0.009 25149
853 1 3 . 1 1 16 16 PHE H H 16 8.095 8.095 8.258 -0.163 25149
854 1 3 . 1 1 17 17 ASN N N 17 112.313 112.313 115.897 -3.584 25149
855 1 3 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.907 -0.271 25149
856 1 3 . 1 1 17 17 ASN C C 17 175.337 175.337 175.002 0.335 25149
857 1 3 . 1 1 17 17 ASN CA C 17 52.961 52.961 53.350 -0.389 25149
858 1 3 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.631 -1.457 25149
859 1 3 . 1 1 17 17 ASN H H 17 7.823 7.823 8.086 -0.263 25149
860 1 3 . 1 1 18 18 GLY N N 18 107.742 107.742 106.818 0.924 25149
861 1 3 . 1 1 18 18 GLY C C 18 173.759 173.759 172.561 1.198 25149
862 1 3 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.049 0.415 25149
863 1 3 . 1 1 18 18 GLY H H 18 7.579 7.579 8.197 -0.618 25149
864 1 3 . 1 1 19 19 CYS N N 19 117.050 117.050 117.936 -0.886 25149
865 1 3 . 1 1 19 19 CYS HA H 19 4.571 4.571 4.743 -0.172 25149
866 1 3 . 1 1 19 19 CYS C C 19 174.039 174.039 174.808 -0.769 25149
867 1 3 . 1 1 19 19 CYS CA C 19 58.433 58.433 56.976 1.457 25149
868 1 3 . 1 1 19 19 CYS CB C 19 30.681 30.681 29.925 0.756 25149
869 1 3 . 1 1 19 19 CYS H H 19 8.198 8.198 8.247 -0.049 25149
870 1 3 . 1 1 20 20 CYS N N 20 123.923 123.923 124.110 -0.187 25149
871 1 3 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.036 -0.025 25149
872 1 3 . 1 1 20 20 CYS C C 20 173.736 173.736 174.864 -1.128 25149
873 1 3 . 1 1 20 20 CYS CA C 20 57.999 57.999 59.398 -1.399 25149
874 1 3 . 1 1 20 20 CYS CB C 20 28.205 28.205 26.711 1.494 25149
875 1 3 . 1 1 20 20 CYS H H 20 8.466 8.466 8.329 0.137 25149
876 1 3 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.292 -0.263 25149
877 1 3 . 1 1 21 21 PRO CA C 21 65.426 65.426 64.884 0.542 25149
878 1 3 . 1 1 21 21 PRO CB C 21 32.801 32.801 32.071 0.730 25149
879 1 3 . 1 1 22 22 ASP N N 22 117.053 117.053 117.511 -0.458 25149
880 1 3 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.668 -0.163 25149
881 1 3 . 1 1 22 22 ASP C C 22 176.501 176.501 175.972 0.529 25149
882 1 3 . 1 1 22 22 ASP CA C 22 55.017 55.017 54.194 0.823 25149
883 1 3 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.043 2.479 25149
884 1 3 . 1 1 22 22 ASP H H 22 8.395 8.395 8.566 -0.171 25149
885 1 3 . 1 1 23 23 CYS N N 23 123.353 123.353 120.521 2.832 25149
886 1 3 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.513 -0.220 25149
887 1 3 . 1 1 23 23 CYS C C 23 175.214 175.214 173.605 1.609 25149
888 1 3 . 1 1 23 23 CYS CA C 23 61.633 61.633 56.934 4.699 25149
889 1 3 . 1 1 23 23 CYS CB C 23 31.542 31.542 27.118 4.424 25149
890 1 3 . 1 1 23 23 CYS H H 23 7.246 7.246 7.136 0.110 25149
891 1 3 . 1 1 24 24 LYS N N 24 117.539 117.539 126.892 -9.353 25149
892 1 3 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.263 -0.033 25149
893 1 3 . 1 1 24 24 LYS C C 24 177.106 177.106 175.117 1.989 25149
894 1 3 . 1 1 24 24 LYS CA C 24 56.921 56.921 56.672 0.249 25149
895 1 3 . 1 1 24 24 LYS CB C 24 34.615 34.615 31.712 2.903 25149
896 1 3 . 1 1 24 24 LYS H H 24 8.173 8.173 8.229 -0.056 25149
897 1 3 . 1 1 25 25 VAL N N 25 120.661 120.661 125.706 -5.045 25149
898 1 3 . 1 1 25 25 VAL HA H 25 4.429 4.429 4.472 -0.043 25149
899 1 3 . 1 1 25 25 VAL C C 25 174.027 174.027 174.254 -0.227 25149
900 1 3 . 1 1 25 25 VAL CA C 25 59.934 59.934 58.838 1.096 25149
901 1 3 . 1 1 25 25 VAL CB C 25 33.507 33.507 33.861 -0.354 25149
902 1 3 . 1 1 25 25 VAL H H 25 7.787 7.787 7.953 -0.166 25149
903 1 3 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.388 -0.052 25149
904 1 3 . 1 1 26 26 PRO CA C 26 63.279 63.279 63.755 -0.477 25149
905 1 3 . 1 1 26 26 PRO CB C 26 32.077 32.077 32.138 -0.061 25149
906 1 3 . 1 1 27 27 GLY N N 27 109.926 109.926 109.517 0.409 25149
907 1 3 . 1 1 27 27 GLY C C 27 175.169 175.169 172.807 2.362 25149
908 1 3 . 1 1 27 27 GLY CA C 27 45.042 45.042 44.407 0.635 25149
909 1 3 . 1 1 27 27 GLY H H 27 8.569 8.569 7.787 0.782 25149
910 1 3 . 1 1 28 28 ASP N N 28 122.592 122.592 117.106 5.486 25149
911 1 3 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.718 -0.487 25149
912 1 3 . 1 1 28 28 ASP C C 28 176.602 176.602 175.561 1.041 25149
913 1 3 . 1 1 28 28 ASP CA C 28 56.402 56.402 54.070 2.332 25149
914 1 3 . 1 1 28 28 ASP CB C 28 40.912 40.912 41.751 -0.839 25149
915 1 3 . 1 1 28 28 ASP H H 28 8.214 8.214 8.361 -0.147 25149
916 1 3 . 1 1 29 29 ASP N N 29 117.500 117.500 122.078 -4.578 25149
917 1 3 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.494 -0.047 25149
918 1 3 . 1 1 29 29 ASP C C 29 175.505 175.505 175.903 -0.398 25149
919 1 3 . 1 1 29 29 ASP CA C 29 55.266 55.266 54.842 0.424 25149
920 1 3 . 1 1 29 29 ASP CB C 29 41.225 41.225 39.429 1.796 25149
921 1 3 . 1 1 29 29 ASP H H 29 8.271 8.271 8.287 -0.016 25149
922 1 3 . 1 1 30 30 CYS N N 30 124.470 124.470 122.734 1.736 25149
923 1 3 . 1 1 30 30 CYS HA H 30 4.390 4.390 4.704 -0.314 25149
924 1 3 . 1 1 30 30 CYS C C 30 171.755 171.755 172.705 -0.950 25149
925 1 3 . 1 1 30 30 CYS CA C 30 57.676 57.676 57.447 0.229 25149
926 1 3 . 1 1 30 30 CYS CB C 30 29.154 29.154 28.707 0.447 25149
927 1 3 . 1 1 30 30 CYS H H 30 7.912 7.912 8.289 -0.377 25149
928 1 3 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.613 0.074 25149
929 1 3 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.864 0.011 25149
930 1 3 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.457 1.527 25149
931 1 3 . 1 1 32 32 LEU N N 32 120.023 120.023 117.919 2.104 25149
932 1 3 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.465 0.251 25149
933 1 3 . 1 1 32 32 LEU C C 32 176.300 176.300 174.943 1.357 25149
934 1 3 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.733 0.188 25149
935 1 3 . 1 1 32 32 LEU CB C 32 43.336 43.336 43.606 -0.270 25149
936 1 3 . 1 1 32 32 LEU H H 32 8.580 8.580 7.927 0.653 25149
937 1 3 . 1 1 33 33 VAL N N 33 116.217 116.217 118.376 -2.159 25149
938 1 3 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.503 0.160 25149
939 1 3 . 1 1 33 33 VAL C C 33 171.374 171.374 174.094 -2.720 25149
940 1 3 . 1 1 33 33 VAL CA C 33 60.449 60.449 60.427 0.022 25149
941 1 3 . 1 1 33 33 VAL CB C 33 36.448 36.448 35.816 0.631 25149
942 1 3 . 1 1 33 33 VAL H H 33 8.594 8.594 8.089 0.505 25149
943 1 3 . 1 1 34 34 TRP N N 34 122.711 122.711 126.436 -3.725 25149
944 1 3 . 1 1 34 34 TRP HA H 34 5.339 5.339 5.185 0.154 25149
945 1 3 . 1 1 34 34 TRP C C 34 176.770 176.770 175.636 1.134 25149
946 1 3 . 1 1 34 34 TRP CA C 34 57.267 57.267 55.916 1.351 25149
947 1 3 . 1 1 34 34 TRP CB C 34 33.780 33.780 33.531 0.249 25149
948 1 3 . 1 1 34 34 TRP H H 34 8.756 8.756 8.680 0.076 25149
949 1 3 . 1 1 35 35 GLY N N 35 107.569 107.569 107.016 0.553 25149
950 1 3 . 1 1 35 35 GLY C C 35 177.397 177.397 173.786 3.611 25149
951 1 3 . 1 1 35 35 GLY CA C 35 44.070 44.070 44.098 -0.028 25149
952 1 3 . 1 1 35 35 GLY H H 35 8.857 8.857 8.471 0.386 25149
953 1 3 . 1 1 36 36 GLN N N 36 122.723 122.723 118.160 4.563 25149
954 1 3 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.024 -0.278 25149
955 1 3 . 1 1 36 36 GLN C C 36 176.445 176.445 176.083 0.362 25149
956 1 3 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.229 0.200 25149
957 1 3 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.540 -0.909 25149
958 1 3 . 1 1 36 36 GLN H H 36 8.338 8.338 8.600 -0.262 25149
959 1 3 . 1 1 37 37 CYS N N 37 115.763 115.763 113.395 2.368 25149
960 1 3 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.901 -0.617 25149
961 1 3 . 1 1 37 37 CYS C C 37 175.281 175.281 175.938 -0.657 25149
962 1 3 . 1 1 37 37 CYS CA C 37 58.395 58.395 55.673 2.721 25149
963 1 3 . 1 1 37 37 CYS CB C 37 31.143 31.143 30.951 0.192 25149
964 1 3 . 1 1 37 37 CYS H H 37 7.622 7.622 7.645 -0.023 25149
965 1 3 . 1 1 38 38 SER N N 38 114.540 114.540 115.159 -0.619 25149
966 1 3 . 1 1 38 38 SER HA H 38 4.004 4.004 4.228 -0.224 25149
967 1 3 . 1 1 38 38 SER C C 38 173.389 173.389 174.343 -0.954 25149
968 1 3 . 1 1 38 38 SER CA C 38 62.285 62.285 59.771 2.514 25149
969 1 3 . 1 1 38 38 SER H H 38 7.716 7.716 8.495 -0.779 25149
970 1 3 . 1 1 39 39 HIS N N 39 121.947 121.947 119.196 2.751 25149
971 1 3 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.443 0.001 25149
972 1 3 . 1 1 39 39 HIS C C 39 172.326 172.326 174.065 -1.739 25149
973 1 3 . 1 1 39 39 HIS CA C 39 61.320 61.320 57.075 4.245 25149
974 1 3 . 1 1 39 39 HIS CB C 39 31.523 31.523 29.898 1.625 25149
975 1 3 . 1 1 39 39 HIS H H 39 7.829 7.829 7.944 -0.115 25149
976 1 3 . 1 1 40 40 CYS N N 40 121.859 121.859 124.046 -2.187 25149
977 1 3 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.429 0.180 25149
978 1 3 . 1 1 40 40 CYS C C 40 171.900 171.900 172.389 -0.489 25149
979 1 3 . 1 1 40 40 CYS CA C 40 55.791 55.791 55.956 -0.165 25149
980 1 3 . 1 1 40 40 CYS CB C 40 28.964 28.964 27.749 1.215 25149
981 1 3 . 1 1 40 40 CYS H H 40 8.049 8.049 8.722 -0.673 25149
982 1 3 . 1 1 41 41 PHE N N 41 120.690 120.690 120.660 0.030 25149
983 1 3 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.649 0.528 25149
984 1 3 . 1 1 41 41 PHE C C 41 176.613 176.613 174.726 1.887 25149
985 1 3 . 1 1 41 41 PHE CA C 41 56.033 56.033 55.889 0.144 25149
986 1 3 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.653 2.107 25149
987 1 3 . 1 1 41 41 PHE H H 41 8.368 8.368 8.345 0.023 25149
988 1 3 . 1 1 42 42 HIS N N 42 117.057 117.057 121.973 -4.916 25149
989 1 3 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.372 0.297 25149
990 1 3 . 1 1 42 42 HIS C C 42 177.464 177.464 176.076 1.388 25149
991 1 3 . 1 1 42 42 HIS CA C 42 60.425 60.425 58.103 2.322 25149
992 1 3 . 1 1 42 42 HIS CB C 42 29.740 29.740 29.804 -0.064 25149
993 1 3 . 1 1 42 42 HIS H H 42 8.384 8.384 8.928 -0.544 25149
994 1 3 . 1 1 43 43 MET N N 43 128.543 128.543 125.823 2.720 25149
995 1 3 . 1 1 43 43 MET HA H 43 3.965 3.965 4.006 -0.041 25149
996 1 3 . 1 1 43 43 MET C C 43 177.845 177.845 177.390 0.455 25149
997 1 3 . 1 1 43 43 MET CA C 43 59.209 59.209 60.508 -1.299 25149
998 1 3 . 1 1 43 43 MET CB C 43 33.009 33.009 32.668 0.341 25149
999 1 3 . 1 1 43 43 MET H H 43 9.439 9.439 8.097 1.342 25149
1000 1 3 . 1 1 44 44 HIS N N 44 116.500 116.500 117.203 -0.703 25149
1001 1 3 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.173 0.083 25149
1002 1 3 . 1 1 44 44 HIS C C 44 178.405 178.405 177.698 0.707 25149
1003 1 3 . 1 1 44 44 HIS CA C 44 58.793 58.793 59.011 -0.218 25149
1004 1 3 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.167 3.580 25149
1005 1 3 . 1 1 44 44 HIS H H 44 9.747 9.747 7.886 1.861 25149
1006 1 3 . 1 1 45 45 CYS N N 45 115.950 115.950 117.522 -1.572 25149
1007 1 3 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.108 -0.108 25149
1008 1 3 . 1 1 45 45 CYS C C 45 177.957 177.957 177.167 0.790 25149
1009 1 3 . 1 1 45 45 CYS CA C 45 62.923 62.923 63.116 -0.193 25149
1010 1 3 . 1 1 45 45 CYS CB C 45 29.102 29.102 26.601 2.501 25149
1011 1 3 . 1 1 45 45 CYS H H 45 6.845 6.845 8.307 -1.462 25149
1012 1 3 . 1 1 46 46 ILE N N 46 119.362 119.362 121.364 -2.002 25149
1013 1 3 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.721 -0.056 25149
1014 1 3 . 1 1 46 46 ILE C C 46 176.613 176.613 177.516 -0.903 25149
1015 1 3 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.448 -4.206 25149
1016 1 3 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.694 -0.375 25149
1017 1 3 . 1 1 46 46 ILE H H 46 7.816 7.816 7.962 -0.146 25149
1018 1 3 . 1 1 47 47 LEU N N 47 122.180 122.180 120.715 1.465 25149
1019 1 3 . 1 1 47 47 LEU HA H 47 3.873 3.873 4.174 -0.301 25149
1020 1 3 . 1 1 47 47 LEU C C 47 179.726 179.726 178.992 0.734 25149
1021 1 3 . 1 1 47 47 LEU CA C 47 58.633 58.633 59.168 -0.535 25149
1022 1 3 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.931 -0.807 25149
1023 1 3 . 1 1 47 47 LEU H H 47 8.266 8.266 8.632 -0.366 25149
1024 1 3 . 1 1 48 48 LYS N N 48 118.251 118.251 118.715 -0.464 25149
1025 1 3 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.267 -0.403 25149
1026 1 3 . 1 1 48 48 LYS C C 48 179.423 179.423 178.810 0.613 25149
1027 1 3 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.560 0.427 25149
1028 1 3 . 1 1 48 48 LYS CB C 48 32.765 32.765 32.069 0.696 25149
1029 1 3 . 1 1 48 48 LYS H H 48 7.147 7.147 8.609 -1.462 25149
1030 1 3 . 1 1 49 49 TRP N N 49 120.745 120.745 121.299 -0.554 25149
1031 1 3 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.355 -0.275 25149
1032 1 3 . 1 1 49 49 TRP C C 49 178.147 178.147 178.241 -0.094 25149
1033 1 3 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.754 -0.209 25149
1034 1 3 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.388 0.027 25149
1035 1 3 . 1 1 49 49 TRP H H 49 7.709 7.709 8.149 -0.440 25149
1036 1 3 . 1 1 50 50 LEU N N 50 117.236 117.236 116.553 0.683 25149
1037 1 3 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.634 -0.029 25149
1038 1 3 . 1 1 50 50 LEU C C 50 179.658 179.658 176.874 2.784 25149
1039 1 3 . 1 1 50 50 LEU CA C 50 57.330 57.330 55.217 2.113 25149
1040 1 3 . 1 1 50 50 LEU CB C 50 41.416 41.416 41.947 -0.531 25149
1041 1 3 . 1 1 50 50 LEU H H 50 8.512 8.512 7.856 0.656 25149
1042 1 3 . 1 1 51 51 HIS N N 51 115.650 115.650 117.881 -2.231 25149
1043 1 3 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.469 -0.195 25149
1044 1 3 . 1 1 51 51 HIS C C 51 175.942 175.942 175.496 0.446 25149
1045 1 3 . 1 1 51 51 HIS CA C 51 57.320 57.320 57.478 -0.158 25149
1046 1 3 . 1 1 51 51 HIS CB C 51 29.487 29.487 30.736 -1.249 25149
1047 1 3 . 1 1 51 51 HIS H H 51 7.713 7.713 8.355 -0.642 25149
1048 1 3 . 1 1 52 52 ALA N N 52 119.779 119.779 120.809 -1.030 25149
1049 1 3 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.417 -0.394 25149
1050 1 3 . 1 1 52 52 ALA C C 52 177.834 177.834 176.615 1.219 25149
1051 1 3 . 1 1 52 52 ALA CA C 52 52.865 52.865 52.404 0.461 25149
1052 1 3 . 1 1 52 52 ALA CB C 52 18.951 18.951 20.341 -1.390 25149
1053 1 3 . 1 1 52 52 ALA H H 52 7.191 7.191 7.820 -0.629 25149
1054 1 3 . 1 1 53 53 GLN N N 53 117.047 117.047 118.919 -1.872 25149
1055 1 3 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.084 -0.151 25149
1056 1 3 . 1 1 53 53 GLN C C 53 175.998 175.998 176.303 -0.305 25149
1057 1 3 . 1 1 53 53 GLN CA C 53 55.482 55.482 55.990 -0.508 25149
1058 1 3 . 1 1 53 53 GLN CB C 53 28.887 28.887 28.413 0.474 25149
1059 1 3 . 1 1 53 53 GLN H H 53 7.317 7.317 7.940 -0.623 25149
1060 1 3 . 1 1 54 54 GLN N N 54 118.463 118.463 122.010 -3.547 25149
1061 1 3 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.186 -0.197 25149
1062 1 3 . 1 1 54 54 GLN C C 54 176.300 176.300 176.101 0.199 25149
1063 1 3 . 1 1 54 54 GLN CA C 54 57.314 57.314 55.892 1.422 25149
1064 1 3 . 1 1 54 54 GLN CB C 54 28.823 28.823 28.531 0.292 25149
1065 1 3 . 1 1 54 54 GLN H H 54 7.949 7.949 8.595 -0.646 25149
1066 1 3 . 1 1 55 55 VAL N N 55 116.755 116.755 118.828 -2.073 25149
1067 1 3 . 1 1 55 55 VAL HA H 55 3.884 3.884 3.993 -0.109 25149
1068 1 3 . 1 1 55 55 VAL C C 55 175.774 175.774 176.731 -0.957 25149
1069 1 3 . 1 1 55 55 VAL CA C 55 63.210 63.210 60.902 2.308 25149
1070 1 3 . 1 1 55 55 VAL CB C 55 32.870 32.870 31.731 1.139 25149
1071 1 3 . 1 1 55 55 VAL H H 55 7.801 7.801 7.525 0.276 25149
1072 1 3 . 1 1 56 56 GLN N N 56 120.192 120.192 119.247 0.945 25149
1073 1 3 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.167 -0.050 25149
1074 1 3 . 1 1 56 56 GLN C C 56 175.236 175.236 176.368 -1.132 25149
1075 1 3 . 1 1 56 56 GLN CA C 56 55.697 55.697 56.479 -0.782 25149
1076 1 3 . 1 1 56 56 GLN CB C 56 29.319 29.319 29.241 0.078 25149
1077 1 3 . 1 1 56 56 GLN H H 56 8.018 8.018 8.333 -0.315 25149
1078 1 3 . 1 1 57 57 GLN N N 57 121.276 121.276 116.885 4.391 25149
1079 1 3 . 1 1 57 57 GLN HA H 57 4.204 4.204 4.074 0.130 25149
1080 1 3 . 1 1 57 57 GLN C C 57 175.819 175.819 175.819 0.000 25149
1081 1 3 . 1 1 57 57 GLN CA C 57 55.617 55.617 56.572 -0.955 25149
1082 1 3 . 1 1 57 57 GLN CB C 57 29.094 29.094 28.960 0.134 25149
1083 1 3 . 1 1 57 57 GLN H H 57 8.471 8.471 8.617 -0.146 25149
1084 1 3 . 1 1 58 58 HIS N N 58 120.001 120.001 119.189 0.812 25149
1085 1 3 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.361 0.813 25149
1086 1 3 . 1 1 58 58 HIS C C 58 173.636 173.636 176.071 -2.435 25149
1087 1 3 . 1 1 58 58 HIS CA C 58 54.353 54.353 57.309 -2.956 25149
1088 1 3 . 1 1 58 58 HIS CB C 58 33.057 33.057 29.442 3.615 25149
1089 1 3 . 1 1 58 58 HIS H H 58 8.366 8.366 7.893 0.473 25149
1090 1 3 . 1 1 59 59 CYS N N 59 121.924 121.924 122.844 -0.920 25149
1091 1 3 . 1 1 59 59 CYS HA H 59 4.442 4.442 4.060 0.382 25149
1092 1 3 . 1 1 59 59 CYS C C 59 176.334 176.334 174.788 1.546 25149
1093 1 3 . 1 1 59 59 CYS CA C 59 56.772 56.772 61.057 -4.285 25149
1094 1 3 . 1 1 59 59 CYS CB C 59 32.642 32.642 28.525 4.117 25149
1095 1 3 . 1 1 59 59 CYS H H 59 9.035 9.035 8.232 0.803 25149
1096 1 3 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.367 -0.554 25149
1097 1 3 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.595 0.066 25149
1098 1 3 . 1 1 60 60 PRO CB C 60 30.659 30.659 31.172 -0.513 25149
1099 1 3 . 1 1 61 61 MET N N 61 117.676 117.676 115.730 1.946 25149
1100 1 3 . 1 1 61 61 MET HA H 61 4.317 4.317 4.437 -0.120 25149
1101 1 3 . 1 1 61 61 MET C C 61 177.117 177.117 175.657 1.460 25149
1102 1 3 . 1 1 61 61 MET CA C 61 56.408 56.408 56.204 0.204 25149
1103 1 3 . 1 1 61 61 MET CB C 61 32.551 32.551 33.740 -1.189 25149
1104 1 3 . 1 1 61 61 MET H H 61 9.135 9.135 7.548 1.587 25149
1105 1 3 . 1 1 62 62 CYS N N 62 117.214 117.214 119.303 -2.089 25149
1106 1 3 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.466 0.408 25149
1107 1 3 . 1 1 62 62 CYS C C 62 175.740 175.740 175.546 0.194 25149
1108 1 3 . 1 1 62 62 CYS CA C 62 58.273 58.273 58.561 -0.288 25149
1109 1 3 . 1 1 62 62 CYS CB C 62 32.776 32.776 28.874 3.902 25149
1110 1 3 . 1 1 62 62 CYS H H 62 8.011 8.011 8.074 -0.063 25149
1111 1 3 . 1 1 63 63 ARG N N 63 116.555 116.555 119.211 -2.656 25149
1112 1 3 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.211 -0.286 25149
1113 1 3 . 1 1 63 63 ARG C C 63 175.326 175.326 175.984 -0.658 25149
1114 1 3 . 1 1 63 63 ARG CA C 63 58.073 58.073 56.624 1.449 25149
1115 1 3 . 1 1 63 63 ARG CB C 63 27.136 27.136 30.152 -3.016 25149
1116 1 3 . 1 1 63 63 ARG H H 63 8.086 8.086 8.259 -0.173 25149
1117 1 3 . 1 1 64 64 GLN N N 64 118.932 118.932 118.781 0.151 25149
1118 1 3 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.462 -0.203 25149
1119 1 3 . 1 1 64 64 GLN C C 64 176.054 176.054 176.098 -0.044 25149
1120 1 3 . 1 1 64 64 GLN CA C 64 56.316 56.316 54.647 1.669 25149
1121 1 3 . 1 1 64 64 GLN CB C 64 30.083 30.083 28.735 1.348 25149
1122 1 3 . 1 1 64 64 GLN H H 64 8.003 8.003 7.806 0.197 25149
1123 1 3 . 1 1 65 65 GLU N N 65 122.038 122.038 123.934 -1.896 25149
1124 1 3 . 1 1 65 65 GLU HA H 65 4.003 4.003 4.262 -0.259 25149
1125 1 3 . 1 1 65 65 GLU C C 65 176.781 176.781 176.886 -0.105 25149
1126 1 3 . 1 1 65 65 GLU CA C 65 57.682 57.682 56.542 1.140 25149
1127 1 3 . 1 1 65 65 GLU CB C 65 29.900 29.900 30.089 -0.189 25149
1128 1 3 . 1 1 65 65 GLU H H 65 8.657 8.657 8.776 -0.119 25149
1129 1 3 . 1 1 66 66 TRP N N 66 125.730 125.730 128.281 -2.551 25149
1130 1 3 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.305 0.099 25149
1131 1 3 . 1 1 66 66 TRP C C 66 175.460 175.460 175.244 0.216 25149
1132 1 3 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.825 -0.200 25149
1133 1 3 . 1 1 66 66 TRP CB C 66 29.358 29.358 29.861 -0.503 25149
1134 1 3 . 1 1 66 66 TRP H H 66 8.499 8.499 8.476 0.023 25149
1135 1 3 . 1 1 67 67 LYS N N 67 127.396 127.396 127.159 0.237 25149
1136 1 3 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.142 -0.124 25149
1137 1 3 . 1 1 67 67 LYS C C 67 175.180 175.180 174.962 0.218 25149
1138 1 3 . 1 1 67 67 LYS CA C 67 54.514 54.514 53.875 0.639 25149
1139 1 3 . 1 1 67 67 LYS CB C 67 36.231 36.231 34.592 1.639 25149
1140 1 3 . 1 1 67 67 LYS H H 67 6.930 6.930 8.698 -1.768 25149
1141 1 3 . 1 1 68 68 PHE N N 68 121.511 121.511 126.710 -5.199 25149
1142 1 3 . 1 1 68 68 PHE HA H 68 4.108 4.108 3.947 0.161 25149
1143 1 3 . 1 1 68 68 PHE C C 68 176.613 176.613 175.337 1.276 25149
1144 1 3 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.867 2.094 25149
1145 1 3 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.592 1.670 25149
1146 1 3 . 1 1 68 68 PHE H H 68 8.430 8.430 8.571 -0.141 25149
1147 1 3 . 1 1 69 69 LYS N N 69 124.210 124.210 122.060 2.150 25149
1148 1 3 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.097 -0.102 25149
1149 1 3 . 1 1 69 69 LYS C C 69 175.651 175.651 176.610 -0.959 25149
1150 1 3 . 1 1 69 69 LYS CA C 69 57.320 57.320 57.013 0.307 25149
1151 1 3 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.565 -0.203 25149
1152 1 3 . 1 1 69 69 LYS H H 69 8.738 8.738 7.995 0.743 25149
1153 1 4 . 1 1 2 2 SER HA H 2 4.417 4.417 4.175 0.242 25149
1154 1 4 . 1 1 2 2 SER CA C 2 58.322 58.322 58.554 -0.232 25149
1155 1 4 . 1 1 2 2 SER CB C 2 64.169 64.169 63.085 1.084 25149
1156 1 4 . 1 1 3 3 VAL N N 3 121.214 121.214 120.203 1.011 25149
1157 1 4 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.302 -0.256 25149
1158 1 4 . 1 1 3 3 VAL C C 3 175.879 175.879 174.684 1.195 25149
1159 1 4 . 1 1 3 3 VAL CA C 3 62.138 62.138 61.531 0.607 25149
1160 1 4 . 1 1 3 3 VAL CB C 3 32.958 32.958 33.202 -0.244 25149
1161 1 4 . 1 1 3 3 VAL H H 3 8.170 8.170 7.533 0.637 25149
1162 1 4 . 1 1 4 4 ALA N N 4 127.312 127.312 129.020 -1.708 25149
1163 1 4 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.632 -0.435 25149
1164 1 4 . 1 1 4 4 ALA C C 4 177.497 177.497 176.337 1.160 25149
1165 1 4 . 1 1 4 4 ALA CA C 4 52.439 52.439 51.153 1.286 25149
1166 1 4 . 1 1 4 4 ALA CB C 4 19.424 19.424 20.371 -0.947 25149
1167 1 4 . 1 1 4 4 ALA H H 4 8.294 8.294 8.311 -0.017 25149
1168 1 4 . 1 1 5 5 ASN N N 5 117.674 117.674 122.961 -5.287 25149
1169 1 4 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.785 -0.220 25149
1170 1 4 . 1 1 5 5 ASN C C 5 175.048 175.048 174.914 0.134 25149
1171 1 4 . 1 1 5 5 ASN CA C 5 53.725 53.725 53.112 0.613 25149
1172 1 4 . 1 1 5 5 ASN CB C 5 39.197 39.197 39.362 -0.166 25149
1173 1 4 . 1 1 5 5 ASN H H 5 8.252 8.252 8.689 -0.437 25149
1174 1 4 . 1 1 6 6 ASP N N 6 119.896 119.896 122.437 -2.541 25149
1175 1 4 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.670 -0.150 25149
1176 1 4 . 1 1 6 6 ASP C C 6 176.269 176.269 175.941 0.328 25149
1177 1 4 . 1 1 6 6 ASP CA C 6 54.497 54.497 54.176 0.321 25149
1178 1 4 . 1 1 6 6 ASP CB C 6 41.104 41.104 41.293 -0.189 25149
1179 1 4 . 1 1 6 6 ASP H H 6 8.215 8.215 8.668 -0.453 25149
1180 1 4 . 1 1 7 7 GLU N N 7 119.101 119.101 119.998 -0.897 25149
1181 1 4 . 1 1 7 7 GLU HA H 7 4.243 4.243 4.380 -0.137 25149
1182 1 4 . 1 1 7 7 GLU C C 7 175.006 175.006 174.578 0.428 25149
1183 1 4 . 1 1 7 7 GLU CA C 7 56.689 56.689 56.132 0.557 25149
1184 1 4 . 1 1 7 7 GLU CB C 7 30.379 30.379 29.114 1.265 25149
1185 1 4 . 1 1 7 7 GLU H H 7 8.065 8.065 8.208 -0.143 25149
1186 1 4 . 1 1 8 8 ASN N N 8 116.852 116.852 115.530 1.322 25149
1187 1 4 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.228 -0.070 25149
1188 1 4 . 1 1 8 8 ASN C C 8 172.706 172.706 174.440 -1.734 25149
1189 1 4 . 1 1 8 8 ASN CA C 8 51.165 51.165 51.506 -0.341 25149
1190 1 4 . 1 1 8 8 ASN CB C 8 40.702 40.702 40.842 -0.140 25149
1191 1 4 . 1 1 8 8 ASN H H 8 7.505 7.505 7.489 0.016 25149
1192 1 4 . 1 1 9 9 CYS N N 9 122.855 122.855 120.629 2.226 25149
1193 1 4 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.623 0.171 25149
1194 1 4 . 1 1 9 9 CYS C C 9 178.370 178.370 176.468 1.902 25149
1195 1 4 . 1 1 9 9 CYS CA C 9 59.552 59.552 60.425 -0.873 25149
1196 1 4 . 1 1 9 9 CYS CB C 9 31.526 31.526 28.946 2.580 25149
1197 1 4 . 1 1 9 9 CYS H H 9 7.614 7.614 7.639 -0.025 25149
1198 1 4 . 1 1 10 10 GLY N N 10 117.295 117.295 111.435 5.860 25149
1199 1 4 . 1 1 10 10 GLY C C 10 174.111 174.111 174.623 -0.512 25149
1200 1 4 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.731 1.236 25149
1201 1 4 . 1 1 10 10 GLY H H 10 9.235 9.235 8.075 1.160 25149
1202 1 4 . 1 1 11 11 ILE N N 11 119.811 119.811 121.441 -1.630 25149
1203 1 4 . 1 1 11 11 ILE HA H 11 3.809 3.809 4.280 -0.471 25149
1204 1 4 . 1 1 11 11 ILE C C 11 176.121 176.121 176.725 -0.604 25149
1205 1 4 . 1 1 11 11 ILE CA C 11 64.041 64.041 63.065 0.976 25149
1206 1 4 . 1 1 11 11 ILE CB C 11 39.411 39.411 39.000 0.411 25149
1207 1 4 . 1 1 11 11 ILE H H 11 8.285 8.285 7.769 0.516 25149
1208 1 4 . 1 1 12 12 CYS N N 12 116.728 116.728 117.067 -0.339 25149
1209 1 4 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.708 -0.132 25149
1210 1 4 . 1 1 12 12 CYS C C 12 175.975 175.975 173.975 2.000 25149
1211 1 4 . 1 1 12 12 CYS CA C 12 59.225 59.225 57.409 1.816 25149
1212 1 4 . 1 1 12 12 CYS CB C 12 32.246 32.246 28.862 3.384 25149
1213 1 4 . 1 1 12 12 CYS H H 12 7.607 7.607 7.832 -0.225 25149
1214 1 4 . 1 1 13 13 ARG N N 13 116.073 116.073 117.981 -1.908 25149
1215 1 4 . 1 1 13 13 ARG HA H 13 3.742 3.742 4.049 -0.307 25149
1216 1 4 . 1 1 13 13 ARG C C 13 174.979 174.979 174.756 0.223 25149
1217 1 4 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.768 0.868 25149
1218 1 4 . 1 1 13 13 ARG CB C 13 26.326 26.326 26.883 -0.557 25149
1219 1 4 . 1 1 13 13 ARG H H 13 7.987 7.987 8.290 -0.303 25149
1220 1 4 . 1 1 14 14 MET N N 14 119.313 119.313 118.590 0.723 25149
1221 1 4 . 1 1 14 14 MET HA H 14 4.547 4.547 4.539 0.008 25149
1222 1 4 . 1 1 14 14 MET C C 14 176.143 176.143 175.356 0.787 25149
1223 1 4 . 1 1 14 14 MET CA C 14 54.208 54.208 54.005 0.203 25149
1224 1 4 . 1 1 14 14 MET CB C 14 33.951 33.951 34.370 -0.419 25149
1225 1 4 . 1 1 14 14 MET H H 14 8.624 8.624 7.532 1.092 25149
1226 1 4 . 1 1 15 15 ALA N N 15 122.683 122.683 129.351 -6.668 25149
1227 1 4 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.120 0.152 25149
1228 1 4 . 1 1 15 15 ALA C C 15 180.117 180.117 178.255 1.862 25149
1229 1 4 . 1 1 15 15 ALA CA C 15 52.346 52.346 51.845 0.501 25149
1230 1 4 . 1 1 15 15 ALA CB C 15 19.487 19.487 19.154 0.334 25149
1231 1 4 . 1 1 15 15 ALA H H 15 7.965 7.965 8.383 -0.418 25149
1232 1 4 . 1 1 16 16 PHE N N 16 119.313 119.313 122.069 -2.756 25149
1233 1 4 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.210 -0.169 25149
1234 1 4 . 1 1 16 16 PHE C C 16 176.423 176.423 176.716 -0.293 25149
1235 1 4 . 1 1 16 16 PHE CA C 16 59.130 59.130 59.336 -0.206 25149
1236 1 4 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.544 -0.154 25149
1237 1 4 . 1 1 16 16 PHE H H 16 8.095 8.095 8.179 -0.084 25149
1238 1 4 . 1 1 17 17 ASN N N 17 112.313 112.313 116.673 -4.360 25149
1239 1 4 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.802 -0.166 25149
1240 1 4 . 1 1 17 17 ASN C C 17 175.337 175.337 175.118 0.219 25149
1241 1 4 . 1 1 17 17 ASN CA C 17 52.961 52.961 53.397 -0.436 25149
1242 1 4 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.935 -1.761 25149
1243 1 4 . 1 1 17 17 ASN H H 17 7.823 7.823 8.100 -0.277 25149
1244 1 4 . 1 1 18 18 GLY N N 18 107.742 107.742 108.443 -0.701 25149
1245 1 4 . 1 1 18 18 GLY C C 18 173.759 173.759 172.591 1.168 25149
1246 1 4 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.791 -0.327 25149
1247 1 4 . 1 1 18 18 GLY H H 18 7.579 7.579 8.229 -0.650 25149
1248 1 4 . 1 1 19 19 CYS N N 19 117.050 117.050 116.614 0.436 25149
1249 1 4 . 1 1 19 19 CYS HA H 19 4.571 4.571 4.921 -0.350 25149
1250 1 4 . 1 1 19 19 CYS C C 19 174.039 174.039 174.171 -0.132 25149
1251 1 4 . 1 1 19 19 CYS CA C 19 58.433 58.433 56.379 2.054 25149
1252 1 4 . 1 1 19 19 CYS CB C 19 30.681 30.681 30.535 0.146 25149
1253 1 4 . 1 1 19 19 CYS H H 19 8.198 8.198 8.105 0.093 25149
1254 1 4 . 1 1 20 20 CYS N N 20 123.923 123.923 121.626 2.297 25149
1255 1 4 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.421 -0.410 25149
1256 1 4 . 1 1 20 20 CYS C C 20 173.736 173.736 174.775 -1.039 25149
1257 1 4 . 1 1 20 20 CYS CA C 20 57.999 57.999 58.183 -0.184 25149
1258 1 4 . 1 1 20 20 CYS CB C 20 28.205 28.205 27.078 1.127 25149
1259 1 4 . 1 1 20 20 CYS H H 20 8.466 8.466 8.653 -0.187 25149
1260 1 4 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.223 -0.194 25149
1261 1 4 . 1 1 21 21 PRO CA C 21 65.426 65.426 64.148 1.278 25149
1262 1 4 . 1 1 21 21 PRO CB C 21 32.801 32.801 32.346 0.455 25149
1263 1 4 . 1 1 22 22 ASP N N 22 117.053 117.053 119.056 -2.003 25149
1264 1 4 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.373 0.132 25149
1265 1 4 . 1 1 22 22 ASP C C 22 176.501 176.501 176.075 0.426 25149
1266 1 4 . 1 1 22 22 ASP CA C 22 55.017 55.017 55.663 -0.646 25149
1267 1 4 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.258 2.264 25149
1268 1 4 . 1 1 22 22 ASP H H 22 8.395 8.395 8.416 -0.021 25149
1269 1 4 . 1 1 23 23 CYS N N 23 123.353 123.353 117.281 6.072 25149
1270 1 4 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.238 0.055 25149
1271 1 4 . 1 1 23 23 CYS C C 23 175.214 175.214 175.317 -0.103 25149
1272 1 4 . 1 1 23 23 CYS CA C 23 61.633 61.633 58.751 2.882 25149
1273 1 4 . 1 1 23 23 CYS CB C 23 31.542 31.542 29.161 2.381 25149
1274 1 4 . 1 1 23 23 CYS H H 23 7.246 7.246 7.916 -0.670 25149
1275 1 4 . 1 1 24 24 LYS N N 24 117.539 117.539 126.373 -8.834 25149
1276 1 4 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.120 0.110 25149
1277 1 4 . 1 1 24 24 LYS C C 24 177.106 177.106 176.280 0.826 25149
1278 1 4 . 1 1 24 24 LYS CA C 24 56.921 56.921 56.051 0.870 25149
1279 1 4 . 1 1 24 24 LYS CB C 24 34.615 34.615 31.854 2.761 25149
1280 1 4 . 1 1 24 24 LYS H H 24 8.173 8.173 8.315 -0.142 25149
1281 1 4 . 1 1 25 25 VAL N N 25 120.661 120.661 122.618 -1.957 25149
1282 1 4 . 1 1 25 25 VAL HA H 25 4.429 4.429 3.793 0.636 25149
1283 1 4 . 1 1 25 25 VAL C C 25 174.027 174.027 174.741 -0.714 25149
1284 1 4 . 1 1 25 25 VAL CA C 25 59.934 59.934 62.518 -2.584 25149
1285 1 4 . 1 1 25 25 VAL CB C 25 33.507 33.507 31.499 2.008 25149
1286 1 4 . 1 1 25 25 VAL H H 25 7.787 7.787 7.496 0.291 25149
1287 1 4 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.461 -0.125 25149
1288 1 4 . 1 1 26 26 PRO CA C 26 63.279 63.279 63.640 -0.361 25149
1289 1 4 . 1 1 26 26 PRO CB C 26 32.077 32.077 32.320 -0.243 25149
1290 1 4 . 1 1 27 27 GLY N N 27 109.926 109.926 108.127 1.799 25149
1291 1 4 . 1 1 27 27 GLY C C 27 175.169 175.169 173.196 1.973 25149
1292 1 4 . 1 1 27 27 GLY CA C 27 45.042 45.042 45.637 -0.595 25149
1293 1 4 . 1 1 27 27 GLY H H 27 8.569 8.569 7.918 0.651 25149
1294 1 4 . 1 1 28 28 ASP N N 28 122.592 122.592 117.542 5.050 25149
1295 1 4 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.740 -0.509 25149
1296 1 4 . 1 1 28 28 ASP C C 28 176.602 176.602 176.032 0.570 25149
1297 1 4 . 1 1 28 28 ASP CA C 28 56.402 56.402 54.245 2.157 25149
1298 1 4 . 1 1 28 28 ASP CB C 28 40.912 40.912 41.691 -0.779 25149
1299 1 4 . 1 1 28 28 ASP H H 28 8.214 8.214 8.184 0.030 25149
1300 1 4 . 1 1 29 29 ASP N N 29 117.500 117.500 120.868 -3.368 25149
1301 1 4 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.815 -0.368 25149
1302 1 4 . 1 1 29 29 ASP C C 29 175.505 175.505 175.455 0.050 25149
1303 1 4 . 1 1 29 29 ASP CA C 29 55.266 55.266 53.711 1.555 25149
1304 1 4 . 1 1 29 29 ASP CB C 29 41.225 41.225 40.157 1.068 25149
1305 1 4 . 1 1 29 29 ASP H H 29 8.271 8.271 8.561 -0.290 25149
1306 1 4 . 1 1 30 30 CYS N N 30 124.470 124.470 123.486 0.984 25149
1307 1 4 . 1 1 30 30 CYS HA H 30 4.390 4.390 5.005 -0.615 25149
1308 1 4 . 1 1 30 30 CYS C C 30 171.755 171.755 173.044 -1.289 25149
1309 1 4 . 1 1 30 30 CYS CA C 30 57.676 57.676 55.891 1.785 25149
1310 1 4 . 1 1 30 30 CYS CB C 30 29.154 29.154 29.335 -0.181 25149
1311 1 4 . 1 1 30 30 CYS H H 30 7.912 7.912 8.351 -0.439 25149
1312 1 4 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.573 0.114 25149
1313 1 4 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.786 0.089 25149
1314 1 4 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.292 1.692 25149
1315 1 4 . 1 1 32 32 LEU N N 32 120.023 120.023 115.828 4.195 25149
1316 1 4 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.658 0.058 25149
1317 1 4 . 1 1 32 32 LEU C C 32 176.300 176.300 175.179 1.121 25149
1318 1 4 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.338 0.583 25149
1319 1 4 . 1 1 32 32 LEU CB C 32 43.336 43.336 43.685 -0.350 25149
1320 1 4 . 1 1 32 32 LEU H H 32 8.580 8.580 7.902 0.678 25149
1321 1 4 . 1 1 33 33 VAL N N 33 116.217 116.217 118.559 -2.342 25149
1322 1 4 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.649 0.014 25149
1323 1 4 . 1 1 33 33 VAL C C 33 171.374 171.374 174.153 -2.779 25149
1324 1 4 . 1 1 33 33 VAL CA C 33 60.449 60.449 59.797 0.652 25149
1325 1 4 . 1 1 33 33 VAL CB C 33 36.448 36.448 35.016 1.432 25149
1326 1 4 . 1 1 33 33 VAL H H 33 8.594 8.594 8.229 0.365 25149
1327 1 4 . 1 1 34 34 TRP N N 34 122.711 122.711 124.859 -2.148 25149
1328 1 4 . 1 1 34 34 TRP HA H 34 5.339 5.339 5.131 0.208 25149
1329 1 4 . 1 1 34 34 TRP C C 34 176.770 176.770 175.666 1.104 25149
1330 1 4 . 1 1 34 34 TRP CA C 34 57.267 57.267 56.053 1.214 25149
1331 1 4 . 1 1 34 34 TRP CB C 34 33.780 33.780 33.672 0.107 25149
1332 1 4 . 1 1 34 34 TRP H H 34 8.756 8.756 8.773 -0.017 25149
1333 1 4 . 1 1 35 35 GLY N N 35 107.569 107.569 107.956 -0.387 25149
1334 1 4 . 1 1 35 35 GLY C C 35 177.397 177.397 173.920 3.477 25149
1335 1 4 . 1 1 35 35 GLY CA C 35 44.070 44.070 44.175 -0.105 25149
1336 1 4 . 1 1 35 35 GLY H H 35 8.857 8.857 8.472 0.385 25149
1337 1 4 . 1 1 36 36 GLN N N 36 122.723 122.723 118.991 3.732 25149
1338 1 4 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.056 -0.310 25149
1339 1 4 . 1 1 36 36 GLN C C 36 176.445 176.445 176.117 0.328 25149
1340 1 4 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.110 0.319 25149
1341 1 4 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.361 -0.730 25149
1342 1 4 . 1 1 36 36 GLN H H 36 8.338 8.338 8.492 -0.154 25149
1343 1 4 . 1 1 37 37 CYS N N 37 115.763 115.763 114.817 0.946 25149
1344 1 4 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.873 -0.589 25149
1345 1 4 . 1 1 37 37 CYS C C 37 175.281 175.281 175.662 -0.381 25149
1346 1 4 . 1 1 37 37 CYS CA C 37 58.395 58.395 56.328 2.067 25149
1347 1 4 . 1 1 37 37 CYS CB C 37 31.143 31.143 30.970 0.173 25149
1348 1 4 . 1 1 37 37 CYS H H 37 7.622 7.622 7.715 -0.093 25149
1349 1 4 . 1 1 38 38 SER N N 38 114.540 114.540 115.387 -0.847 25149
1350 1 4 . 1 1 38 38 SER HA H 38 4.004 4.004 4.293 -0.289 25149
1351 1 4 . 1 1 38 38 SER C C 38 173.389 173.389 174.287 -0.898 25149
1352 1 4 . 1 1 38 38 SER CA C 38 62.285 62.285 60.452 1.833 25149
1353 1 4 . 1 1 38 38 SER H H 38 7.716 7.716 8.552 -0.836 25149
1354 1 4 . 1 1 39 39 HIS N N 39 121.947 121.947 118.520 3.427 25149
1355 1 4 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.375 0.069 25149
1356 1 4 . 1 1 39 39 HIS C C 39 172.326 172.326 173.773 -1.447 25149
1357 1 4 . 1 1 39 39 HIS CA C 39 61.320 61.320 56.703 4.617 25149
1358 1 4 . 1 1 39 39 HIS CB C 39 31.523 31.523 29.789 1.734 25149
1359 1 4 . 1 1 39 39 HIS H H 39 7.829 7.829 8.240 -0.411 25149
1360 1 4 . 1 1 40 40 CYS N N 40 121.859 121.859 123.381 -1.522 25149
1361 1 4 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.509 0.100 25149
1362 1 4 . 1 1 40 40 CYS C C 40 171.900 171.900 172.617 -0.717 25149
1363 1 4 . 1 1 40 40 CYS CA C 40 55.791 55.791 55.636 0.155 25149
1364 1 4 . 1 1 40 40 CYS CB C 40 28.964 28.964 29.023 -0.059 25149
1365 1 4 . 1 1 40 40 CYS H H 40 8.049 8.049 8.383 -0.334 25149
1366 1 4 . 1 1 41 41 PHE N N 41 120.690 120.690 121.639 -0.949 25149
1367 1 4 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.513 0.664 25149
1368 1 4 . 1 1 41 41 PHE C C 41 176.613 176.613 174.600 2.013 25149
1369 1 4 . 1 1 41 41 PHE CA C 41 56.033 56.033 56.213 -0.180 25149
1370 1 4 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.781 1.979 25149
1371 1 4 . 1 1 41 41 PHE H H 41 8.368 8.368 8.430 -0.062 25149
1372 1 4 . 1 1 42 42 HIS N N 42 117.057 117.057 122.636 -5.579 25149
1373 1 4 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.330 0.339 25149
1374 1 4 . 1 1 42 42 HIS C C 42 177.464 177.464 176.532 0.932 25149
1375 1 4 . 1 1 42 42 HIS CA C 42 60.425 60.425 57.467 2.958 25149
1376 1 4 . 1 1 42 42 HIS CB C 42 29.740 29.740 29.277 0.463 25149
1377 1 4 . 1 1 42 42 HIS H H 42 8.384 8.384 8.463 -0.079 25149
1378 1 4 . 1 1 43 43 MET N N 43 128.543 128.543 126.194 2.349 25149
1379 1 4 . 1 1 43 43 MET HA H 43 3.965 3.965 4.013 -0.048 25149
1380 1 4 . 1 1 43 43 MET C C 43 177.845 177.845 177.378 0.467 25149
1381 1 4 . 1 1 43 43 MET CA C 43 59.209 59.209 60.545 -1.336 25149
1382 1 4 . 1 1 43 43 MET CB C 43 33.009 33.009 32.714 0.295 25149
1383 1 4 . 1 1 43 43 MET H H 43 9.439 9.439 8.480 0.959 25149
1384 1 4 . 1 1 44 44 HIS N N 44 116.500 116.500 116.830 -0.330 25149
1385 1 4 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.302 -0.046 25149
1386 1 4 . 1 1 44 44 HIS C C 44 178.405 178.405 177.897 0.508 25149
1387 1 4 . 1 1 44 44 HIS CA C 44 58.793 58.793 59.101 -0.308 25149
1388 1 4 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.160 3.587 25149
1389 1 4 . 1 1 44 44 HIS H H 44 9.747 9.747 8.029 1.718 25149
1390 1 4 . 1 1 45 45 CYS N N 45 115.950 115.950 117.582 -1.632 25149
1391 1 4 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.150 -0.150 25149
1392 1 4 . 1 1 45 45 CYS C C 45 177.957 177.957 176.773 1.184 25149
1393 1 4 . 1 1 45 45 CYS CA C 45 62.923 62.923 63.959 -1.036 25149
1394 1 4 . 1 1 45 45 CYS CB C 45 29.102 29.102 26.898 2.204 25149
1395 1 4 . 1 1 45 45 CYS H H 45 6.845 6.845 8.192 -1.347 25149
1396 1 4 . 1 1 46 46 ILE N N 46 119.362 119.362 121.658 -2.296 25149
1397 1 4 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.730 -0.065 25149
1398 1 4 . 1 1 46 46 ILE C C 46 176.613 176.613 177.531 -0.918 25149
1399 1 4 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.375 -4.133 25149
1400 1 4 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.682 -0.363 25149
1401 1 4 . 1 1 46 46 ILE H H 46 7.816 7.816 8.106 -0.290 25149
1402 1 4 . 1 1 47 47 LEU N N 47 122.180 122.180 120.487 1.693 25149
1403 1 4 . 1 1 47 47 LEU HA H 47 3.873 3.873 4.157 -0.284 25149
1404 1 4 . 1 1 47 47 LEU C C 47 179.726 179.726 178.981 0.745 25149
1405 1 4 . 1 1 47 47 LEU CA C 47 58.633 58.633 59.103 -0.470 25149
1406 1 4 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.955 -0.832 25149
1407 1 4 . 1 1 47 47 LEU H H 47 8.266 8.266 8.614 -0.348 25149
1408 1 4 . 1 1 48 48 LYS N N 48 118.251 118.251 118.556 -0.305 25149
1409 1 4 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.224 -0.360 25149
1410 1 4 . 1 1 48 48 LYS C C 48 179.423 179.423 178.622 0.801 25149
1411 1 4 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.867 0.120 25149
1412 1 4 . 1 1 48 48 LYS CB C 48 32.765 32.765 32.009 0.756 25149
1413 1 4 . 1 1 48 48 LYS H H 48 7.147 7.147 8.373 -1.226 25149
1414 1 4 . 1 1 49 49 TRP N N 49 120.745 120.745 120.688 0.057 25149
1415 1 4 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.380 -0.300 25149
1416 1 4 . 1 1 49 49 TRP C C 49 178.147 178.147 177.774 0.373 25149
1417 1 4 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.385 0.160 25149
1418 1 4 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.186 0.229 25149
1419 1 4 . 1 1 49 49 TRP H H 49 7.709 7.709 7.559 0.150 25149
1420 1 4 . 1 1 50 50 LEU N N 50 117.236 117.236 117.343 -0.107 25149
1421 1 4 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.568 0.037 25149
1422 1 4 . 1 1 50 50 LEU C C 50 179.658 179.658 177.030 2.628 25149
1423 1 4 . 1 1 50 50 LEU CA C 50 57.330 57.330 55.056 2.273 25149
1424 1 4 . 1 1 50 50 LEU CB C 50 41.416 41.416 42.066 -0.651 25149
1425 1 4 . 1 1 50 50 LEU H H 50 8.512 8.512 7.873 0.639 25149
1426 1 4 . 1 1 51 51 HIS N N 51 115.650 115.650 118.078 -2.428 25149
1427 1 4 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.533 -0.259 25149
1428 1 4 . 1 1 51 51 HIS C C 51 175.942 175.942 176.247 -0.305 25149
1429 1 4 . 1 1 51 51 HIS CA C 51 57.320 57.320 57.175 0.145 25149
1430 1 4 . 1 1 51 51 HIS CB C 51 29.487 29.487 30.252 -0.765 25149
1431 1 4 . 1 1 51 51 HIS H H 51 7.713 7.713 8.417 -0.704 25149
1432 1 4 . 1 1 52 52 ALA N N 52 119.779 119.779 122.551 -2.772 25149
1433 1 4 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.074 -0.051 25149
1434 1 4 . 1 1 52 52 ALA C C 52 177.834 177.834 177.536 0.298 25149
1435 1 4 . 1 1 52 52 ALA CA C 52 52.865 52.865 53.723 -0.858 25149
1436 1 4 . 1 1 52 52 ALA CB C 52 18.951 18.951 19.265 -0.314 25149
1437 1 4 . 1 1 52 52 ALA H H 52 7.191 7.191 8.014 -0.823 25149
1438 1 4 . 1 1 53 53 GLN N N 53 117.047 117.047 114.400 2.647 25149
1439 1 4 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.632 -0.699 25149
1440 1 4 . 1 1 53 53 GLN C C 53 175.998 175.998 174.781 1.217 25149
1441 1 4 . 1 1 53 53 GLN CA C 53 55.482 55.482 54.336 1.146 25149
1442 1 4 . 1 1 53 53 GLN CB C 53 28.887 28.887 30.493 -1.606 25149
1443 1 4 . 1 1 53 53 GLN H H 53 7.317 7.317 7.973 -0.656 25149
1444 1 4 . 1 1 54 54 GLN N N 54 118.463 118.463 118.640 -0.177 25149
1445 1 4 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.267 -0.278 25149
1446 1 4 . 1 1 54 54 GLN C C 54 176.300 176.300 176.721 -0.421 25149
1447 1 4 . 1 1 54 54 GLN CA C 54 57.314 57.314 55.740 1.574 25149
1448 1 4 . 1 1 54 54 GLN CB C 54 28.823 28.823 28.754 0.069 25149
1449 1 4 . 1 1 54 54 GLN H H 54 7.949 7.949 8.519 -0.570 25149
1450 1 4 . 1 1 55 55 VAL N N 55 116.755 116.755 116.008 0.747 25149
1451 1 4 . 1 1 55 55 VAL HA H 55 3.884 3.884 3.897 -0.013 25149
1452 1 4 . 1 1 55 55 VAL C C 55 175.774 175.774 175.483 0.291 25149
1453 1 4 . 1 1 55 55 VAL CA C 55 63.210 63.210 61.538 1.672 25149
1454 1 4 . 1 1 55 55 VAL CB C 55 32.870 32.870 32.216 0.654 25149
1455 1 4 . 1 1 55 55 VAL H H 55 7.801 7.801 7.287 0.514 25149
1456 1 4 . 1 1 56 56 GLN N N 56 120.192 120.192 121.129 -0.937 25149
1457 1 4 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.251 -0.134 25149
1458 1 4 . 1 1 56 56 GLN C C 56 175.236 175.236 176.295 -1.059 25149
1459 1 4 . 1 1 56 56 GLN CA C 56 55.697 55.697 56.783 -1.086 25149
1460 1 4 . 1 1 56 56 GLN CB C 56 29.319 29.319 28.638 0.681 25149
1461 1 4 . 1 1 56 56 GLN H H 56 8.018 8.018 8.445 -0.427 25149
1462 1 4 . 1 1 57 57 GLN N N 57 121.276 121.276 119.650 1.626 25149
1463 1 4 . 1 1 57 57 GLN HA H 57 4.204 4.204 3.889 0.315 25149
1464 1 4 . 1 1 57 57 GLN C C 57 175.819 175.819 176.061 -0.242 25149
1465 1 4 . 1 1 57 57 GLN CA C 57 55.617 55.617 56.713 -1.096 25149
1466 1 4 . 1 1 57 57 GLN CB C 57 29.094 29.094 28.445 0.649 25149
1467 1 4 . 1 1 57 57 GLN H H 57 8.471 8.471 8.372 0.099 25149
1468 1 4 . 1 1 58 58 HIS N N 58 120.001 120.001 118.299 1.702 25149
1469 1 4 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.349 0.825 25149
1470 1 4 . 1 1 58 58 HIS C C 58 173.636 173.636 176.215 -2.579 25149
1471 1 4 . 1 1 58 58 HIS CA C 58 54.353 54.353 56.753 -2.400 25149
1472 1 4 . 1 1 58 58 HIS CB C 58 33.057 33.057 28.981 4.076 25149
1473 1 4 . 1 1 58 58 HIS H H 58 8.366 8.366 7.973 0.393 25149
1474 1 4 . 1 1 59 59 CYS N N 59 121.924 121.924 122.764 -0.840 25149
1475 1 4 . 1 1 59 59 CYS HA H 59 4.442 4.442 3.928 0.514 25149
1476 1 4 . 1 1 59 59 CYS C C 59 176.334 176.334 174.829 1.505 25149
1477 1 4 . 1 1 59 59 CYS CA C 59 56.772 56.772 60.721 -3.949 25149
1478 1 4 . 1 1 59 59 CYS CB C 59 32.642 32.642 27.684 4.958 25149
1479 1 4 . 1 1 59 59 CYS H H 59 9.035 9.035 8.234 0.801 25149
1480 1 4 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.215 -0.402 25149
1481 1 4 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.684 -0.023 25149
1482 1 4 . 1 1 60 60 PRO CB C 60 30.659 30.659 31.289 -0.630 25149
1483 1 4 . 1 1 61 61 MET N N 61 117.676 117.676 117.115 0.561 25149
1484 1 4 . 1 1 61 61 MET HA H 61 4.317 4.317 4.330 -0.013 25149
1485 1 4 . 1 1 61 61 MET C C 61 177.117 177.117 175.906 1.211 25149
1486 1 4 . 1 1 61 61 MET CA C 61 56.408 56.408 56.617 -0.209 25149
1487 1 4 . 1 1 61 61 MET CB C 61 32.551 32.551 33.160 -0.609 25149
1488 1 4 . 1 1 61 61 MET H H 61 9.135 9.135 7.408 1.727 25149
1489 1 4 . 1 1 62 62 CYS N N 62 117.214 117.214 118.897 -1.683 25149
1490 1 4 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.433 0.441 25149
1491 1 4 . 1 1 62 62 CYS C C 62 175.740 175.740 175.117 0.623 25149
1492 1 4 . 1 1 62 62 CYS CA C 62 58.273 58.273 59.026 -0.753 25149
1493 1 4 . 1 1 62 62 CYS CB C 62 32.776 32.776 27.901 4.875 25149
1494 1 4 . 1 1 62 62 CYS H H 62 8.011 8.011 7.718 0.293 25149
1495 1 4 . 1 1 63 63 ARG N N 63 116.555 116.555 118.014 -1.459 25149
1496 1 4 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.361 -0.436 25149
1497 1 4 . 1 1 63 63 ARG C C 63 175.326 175.326 175.151 0.175 25149
1498 1 4 . 1 1 63 63 ARG CA C 63 58.073 58.073 55.642 2.431 25149
1499 1 4 . 1 1 63 63 ARG CB C 63 27.136 27.136 30.717 -3.581 25149
1500 1 4 . 1 1 63 63 ARG H H 63 8.086 8.086 8.253 -0.167 25149
1501 1 4 . 1 1 64 64 GLN N N 64 118.932 118.932 119.119 -0.187 25149
1502 1 4 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.602 -0.343 25149
1503 1 4 . 1 1 64 64 GLN C C 64 176.054 176.054 175.602 0.452 25149
1504 1 4 . 1 1 64 64 GLN CA C 64 56.316 56.316 54.692 1.624 25149
1505 1 4 . 1 1 64 64 GLN CB C 64 30.083 30.083 30.593 -0.510 25149
1506 1 4 . 1 1 64 64 GLN H H 64 8.003 8.003 7.806 0.197 25149
1507 1 4 . 1 1 65 65 GLU N N 65 122.038 122.038 122.757 -0.719 25149
1508 1 4 . 1 1 65 65 GLU HA H 65 4.003 4.003 4.089 -0.086 25149
1509 1 4 . 1 1 65 65 GLU C C 65 176.781 176.781 176.292 0.489 25149
1510 1 4 . 1 1 65 65 GLU CA C 65 57.682 57.682 56.768 0.914 25149
1511 1 4 . 1 1 65 65 GLU CB C 65 29.900 29.900 29.546 0.354 25149
1512 1 4 . 1 1 65 65 GLU H H 65 8.657 8.657 8.717 -0.060 25149
1513 1 4 . 1 1 66 66 TRP N N 66 125.730 125.730 128.157 -2.427 25149
1514 1 4 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.260 0.144 25149
1515 1 4 . 1 1 66 66 TRP C C 66 175.460 175.460 175.156 0.304 25149
1516 1 4 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.523 0.102 25149
1517 1 4 . 1 1 66 66 TRP CB C 66 29.358 29.358 29.896 -0.538 25149
1518 1 4 . 1 1 66 66 TRP H H 66 8.499 8.499 8.125 0.374 25149
1519 1 4 . 1 1 67 67 LYS N N 67 127.396 127.396 127.026 0.370 25149
1520 1 4 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.071 -0.053 25149
1521 1 4 . 1 1 67 67 LYS C C 67 175.180 175.180 175.201 -0.021 25149
1522 1 4 . 1 1 67 67 LYS CA C 67 54.514 54.514 53.821 0.693 25149
1523 1 4 . 1 1 67 67 LYS CB C 67 36.231 36.231 34.801 1.430 25149
1524 1 4 . 1 1 67 67 LYS H H 67 6.930 6.930 8.533 -1.603 25149
1525 1 4 . 1 1 68 68 PHE N N 68 121.511 121.511 127.042 -5.531 25149
1526 1 4 . 1 1 68 68 PHE HA H 68 4.108 4.108 3.985 0.123 25149
1527 1 4 . 1 1 68 68 PHE C C 68 176.613 176.613 175.499 1.114 25149
1528 1 4 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.673 2.288 25149
1529 1 4 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.453 1.809 25149
1530 1 4 . 1 1 68 68 PHE H H 68 8.430 8.430 8.502 -0.072 25149
1531 1 4 . 1 1 69 69 LYS N N 69 124.210 124.210 122.285 1.925 25149
1532 1 4 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.098 -0.103 25149
1533 1 4 . 1 1 69 69 LYS C C 69 175.651 175.651 176.543 -0.892 25149
1534 1 4 . 1 1 69 69 LYS CA C 69 57.320 57.320 57.196 0.124 25149
1535 1 4 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.479 -0.118 25149
1536 1 4 . 1 1 69 69 LYS H H 69 8.738 8.738 8.061 0.677 25149
1537 1 5 . 1 1 2 2 SER HA H 2 4.417 4.417 4.603 -0.186 25149
1538 1 5 . 1 1 2 2 SER CA C 2 58.322 58.322 58.912 -0.590 25149
1539 1 5 . 1 1 2 2 SER CB C 2 64.169 64.169 63.869 0.300 25149
1540 1 5 . 1 1 3 3 VAL N N 3 121.214 121.214 123.107 -1.893 25149
1541 1 5 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.220 -0.174 25149
1542 1 5 . 1 1 3 3 VAL C C 3 175.879 175.879 174.930 0.949 25149
1543 1 5 . 1 1 3 3 VAL CA C 3 62.138 62.138 62.383 -0.245 25149
1544 1 5 . 1 1 3 3 VAL CB C 3 32.958 32.958 33.090 -0.132 25149
1545 1 5 . 1 1 3 3 VAL H H 3 8.170 8.170 8.065 0.105 25149
1546 1 5 . 1 1 4 4 ALA N N 4 127.312 127.312 129.146 -1.834 25149
1547 1 5 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.272 -0.075 25149
1548 1 5 . 1 1 4 4 ALA C C 4 177.497 177.497 176.221 1.276 25149
1549 1 5 . 1 1 4 4 ALA CA C 4 52.439 52.439 52.656 -0.217 25149
1550 1 5 . 1 1 4 4 ALA CB C 4 19.424 19.424 19.242 0.182 25149
1551 1 5 . 1 1 4 4 ALA H H 4 8.294 8.294 8.446 -0.152 25149
1552 1 5 . 1 1 5 5 ASN N N 5 117.674 117.674 122.167 -4.493 25149
1553 1 5 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.742 -0.177 25149
1554 1 5 . 1 1 5 5 ASN C C 5 175.048 175.048 174.695 0.353 25149
1555 1 5 . 1 1 5 5 ASN CA C 5 53.725 53.725 53.216 0.509 25149
1556 1 5 . 1 1 5 5 ASN CB C 5 39.197 39.197 39.174 0.023 25149
1557 1 5 . 1 1 5 5 ASN H H 5 8.252 8.252 8.548 -0.296 25149
1558 1 5 . 1 1 6 6 ASP N N 6 119.896 119.896 122.553 -2.657 25149
1559 1 5 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.734 -0.214 25149
1560 1 5 . 1 1 6 6 ASP C C 6 176.269 176.269 176.005 0.264 25149
1561 1 5 . 1 1 6 6 ASP CA C 6 54.497 54.497 54.221 0.276 25149
1562 1 5 . 1 1 6 6 ASP CB C 6 41.104 41.104 41.725 -0.621 25149
1563 1 5 . 1 1 6 6 ASP H H 6 8.215 8.215 8.775 -0.560 25149
1564 1 5 . 1 1 7 7 GLU N N 7 119.101 119.101 118.909 0.192 25149
1565 1 5 . 1 1 7 7 GLU HA H 7 4.243 4.243 4.466 -0.223 25149
1566 1 5 . 1 1 7 7 GLU C C 7 175.006 175.006 174.575 0.431 25149
1567 1 5 . 1 1 7 7 GLU CA C 7 56.689 56.689 56.691 -0.002 25149
1568 1 5 . 1 1 7 7 GLU CB C 7 30.379 30.379 29.746 0.633 25149
1569 1 5 . 1 1 7 7 GLU H H 7 8.065 8.065 8.359 -0.294 25149
1570 1 5 . 1 1 8 8 ASN N N 8 116.852 116.852 115.112 1.740 25149
1571 1 5 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.255 -0.097 25149
1572 1 5 . 1 1 8 8 ASN C C 8 172.706 172.706 174.955 -2.249 25149
1573 1 5 . 1 1 8 8 ASN CA C 8 51.165 51.165 50.786 0.379 25149
1574 1 5 . 1 1 8 8 ASN CB C 8 40.702 40.702 39.290 1.412 25149
1575 1 5 . 1 1 8 8 ASN H H 8 7.505 7.505 7.395 0.110 25149
1576 1 5 . 1 1 9 9 CYS N N 9 122.855 122.855 120.715 2.140 25149
1577 1 5 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.710 0.084 25149
1578 1 5 . 1 1 9 9 CYS C C 9 178.370 178.370 176.658 1.712 25149
1579 1 5 . 1 1 9 9 CYS CA C 9 59.552 59.552 60.580 -1.028 25149
1580 1 5 . 1 1 9 9 CYS CB C 9 31.526 31.526 28.509 3.017 25149
1581 1 5 . 1 1 9 9 CYS H H 9 7.614 7.614 7.370 0.244 25149
1582 1 5 . 1 1 10 10 GLY N N 10 117.295 117.295 109.582 7.713 25149
1583 1 5 . 1 1 10 10 GLY C C 10 174.111 174.111 174.229 -0.118 25149
1584 1 5 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.456 1.511 25149
1585 1 5 . 1 1 10 10 GLY H H 10 9.235 9.235 7.828 1.407 25149
1586 1 5 . 1 1 11 11 ILE N N 11 119.811 119.811 119.804 0.007 25149
1587 1 5 . 1 1 11 11 ILE HA H 11 3.809 3.809 4.076 -0.267 25149
1588 1 5 . 1 1 11 11 ILE C C 11 176.121 176.121 175.993 0.128 25149
1589 1 5 . 1 1 11 11 ILE CA C 11 64.041 64.041 63.517 0.524 25149
1590 1 5 . 1 1 11 11 ILE CB C 11 39.411 39.411 38.929 0.482 25149
1591 1 5 . 1 1 11 11 ILE H H 11 8.285 8.285 7.386 0.899 25149
1592 1 5 . 1 1 12 12 CYS N N 12 116.728 116.728 115.811 0.917 25149
1593 1 5 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.559 0.017 25149
1594 1 5 . 1 1 12 12 CYS C C 12 175.975 175.975 173.827 2.148 25149
1595 1 5 . 1 1 12 12 CYS CA C 12 59.225 59.225 57.474 1.751 25149
1596 1 5 . 1 1 12 12 CYS CB C 12 32.246 32.246 29.528 2.718 25149
1597 1 5 . 1 1 12 12 CYS H H 12 7.607 7.607 7.774 -0.167 25149
1598 1 5 . 1 1 13 13 ARG N N 13 116.073 116.073 118.024 -1.951 25149
1599 1 5 . 1 1 13 13 ARG HA H 13 3.742 3.742 3.953 -0.211 25149
1600 1 5 . 1 1 13 13 ARG C C 13 174.979 174.979 174.640 0.339 25149
1601 1 5 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.792 0.844 25149
1602 1 5 . 1 1 13 13 ARG CB C 13 26.326 26.326 26.871 -0.545 25149
1603 1 5 . 1 1 13 13 ARG H H 13 7.987 7.987 8.200 -0.213 25149
1604 1 5 . 1 1 14 14 MET N N 14 119.313 119.313 118.564 0.749 25149
1605 1 5 . 1 1 14 14 MET HA H 14 4.547 4.547 4.549 -0.002 25149
1606 1 5 . 1 1 14 14 MET C C 14 176.143 176.143 175.288 0.855 25149
1607 1 5 . 1 1 14 14 MET CA C 14 54.208 54.208 53.679 0.528 25149
1608 1 5 . 1 1 14 14 MET CB C 14 33.951 33.951 34.629 -0.678 25149
1609 1 5 . 1 1 14 14 MET H H 14 8.624 8.624 7.487 1.137 25149
1610 1 5 . 1 1 15 15 ALA N N 15 122.683 122.683 129.459 -6.776 25149
1611 1 5 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.056 0.216 25149
1612 1 5 . 1 1 15 15 ALA C C 15 180.117 180.117 178.101 2.016 25149
1613 1 5 . 1 1 15 15 ALA CA C 15 52.346 52.346 52.071 0.276 25149
1614 1 5 . 1 1 15 15 ALA CB C 15 19.487 19.487 18.994 0.493 25149
1615 1 5 . 1 1 15 15 ALA H H 15 7.965 7.965 8.361 -0.396 25149
1616 1 5 . 1 1 16 16 PHE N N 16 119.313 119.313 120.440 -1.127 25149
1617 1 5 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.123 -0.082 25149
1618 1 5 . 1 1 16 16 PHE C C 16 176.423 176.423 176.488 -0.065 25149
1619 1 5 . 1 1 16 16 PHE CA C 16 59.130 59.130 59.688 -0.557 25149
1620 1 5 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.539 -0.150 25149
1621 1 5 . 1 1 16 16 PHE H H 16 8.095 8.095 8.045 0.050 25149
1622 1 5 . 1 1 17 17 ASN N N 17 112.313 112.313 115.675 -3.362 25149
1623 1 5 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.887 -0.251 25149
1624 1 5 . 1 1 17 17 ASN C C 17 175.337 175.337 174.977 0.360 25149
1625 1 5 . 1 1 17 17 ASN CA C 17 52.961 52.961 53.293 -0.332 25149
1626 1 5 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.471 -1.297 25149
1627 1 5 . 1 1 17 17 ASN H H 17 7.823 7.823 8.113 -0.290 25149
1628 1 5 . 1 1 18 18 GLY N N 18 107.742 107.742 107.541 0.201 25149
1629 1 5 . 1 1 18 18 GLY C C 18 173.759 173.759 172.474 1.285 25149
1630 1 5 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.204 0.260 25149
1631 1 5 . 1 1 18 18 GLY H H 18 7.579 7.579 7.928 -0.349 25149
1632 1 5 . 1 1 19 19 CYS N N 19 117.050 117.050 118.223 -1.173 25149
1633 1 5 . 1 1 19 19 CYS HA H 19 4.571 4.571 4.671 -0.100 25149
1634 1 5 . 1 1 19 19 CYS C C 19 174.039 174.039 174.983 -0.944 25149
1635 1 5 . 1 1 19 19 CYS CA C 19 58.433 58.433 57.772 0.661 25149
1636 1 5 . 1 1 19 19 CYS CB C 19 30.681 30.681 29.996 0.685 25149
1637 1 5 . 1 1 19 19 CYS H H 19 8.198 8.198 8.227 -0.029 25149
1638 1 5 . 1 1 20 20 CYS N N 20 123.923 123.923 121.465 2.458 25149
1639 1 5 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.407 -0.396 25149
1640 1 5 . 1 1 20 20 CYS C C 20 173.736 173.736 174.624 -0.888 25149
1641 1 5 . 1 1 20 20 CYS CA C 20 57.999 57.999 57.492 0.507 25149
1642 1 5 . 1 1 20 20 CYS CB C 20 28.205 28.205 27.893 0.312 25149
1643 1 5 . 1 1 20 20 CYS H H 20 8.466 8.466 8.551 -0.085 25149
1644 1 5 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.377 -0.348 25149
1645 1 5 . 1 1 21 21 PRO CA C 21 65.426 65.426 64.076 1.350 25149
1646 1 5 . 1 1 21 21 PRO CB C 21 32.801 32.801 31.885 0.916 25149
1647 1 5 . 1 1 22 22 ASP N N 22 117.053 117.053 119.745 -2.692 25149
1648 1 5 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.378 0.127 25149
1649 1 5 . 1 1 22 22 ASP C C 22 176.501 176.501 177.012 -0.511 25149
1650 1 5 . 1 1 22 22 ASP CA C 22 55.017 55.017 55.468 -0.451 25149
1651 1 5 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.528 1.994 25149
1652 1 5 . 1 1 22 22 ASP H H 22 8.395 8.395 8.488 -0.093 25149
1653 1 5 . 1 1 23 23 CYS N N 23 123.353 123.353 120.045 3.308 25149
1654 1 5 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.264 0.029 25149
1655 1 5 . 1 1 23 23 CYS C C 23 175.214 175.214 174.565 0.649 25149
1656 1 5 . 1 1 23 23 CYS CA C 23 61.633 61.633 60.182 1.450 25149
1657 1 5 . 1 1 23 23 CYS CB C 23 31.542 31.542 28.506 3.036 25149
1658 1 5 . 1 1 23 23 CYS H H 23 7.246 7.246 7.982 -0.736 25149
1659 1 5 . 1 1 24 24 LYS N N 24 117.539 117.539 127.851 -10.312 25149
1660 1 5 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.508 -0.278 25149
1661 1 5 . 1 1 24 24 LYS C C 24 177.106 177.106 175.170 1.936 25149
1662 1 5 . 1 1 24 24 LYS CA C 24 56.921 56.921 55.314 1.607 25149
1663 1 5 . 1 1 24 24 LYS CB C 24 34.615 34.615 31.654 2.961 25149
1664 1 5 . 1 1 24 24 LYS H H 24 8.173 8.173 8.349 -0.176 25149
1665 1 5 . 1 1 25 25 VAL N N 25 120.661 120.661 122.776 -2.115 25149
1666 1 5 . 1 1 25 25 VAL HA H 25 4.429 4.429 4.530 -0.101 25149
1667 1 5 . 1 1 25 25 VAL C C 25 174.027 174.027 173.607 0.420 25149
1668 1 5 . 1 1 25 25 VAL CA C 25 59.934 59.934 58.243 1.691 25149
1669 1 5 . 1 1 25 25 VAL CB C 25 33.507 33.507 33.672 -0.165 25149
1670 1 5 . 1 1 25 25 VAL H H 25 7.787 7.787 7.967 -0.180 25149
1671 1 5 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.477 -0.141 25149
1672 1 5 . 1 1 26 26 PRO CA C 26 63.279 63.279 63.039 0.240 25149
1673 1 5 . 1 1 26 26 PRO CB C 26 32.077 32.077 31.087 0.990 25149
1674 1 5 . 1 1 27 27 GLY N N 27 109.926 109.926 113.595 -3.669 25149
1675 1 5 . 1 1 27 27 GLY C C 27 175.169 175.169 172.893 2.276 25149
1676 1 5 . 1 1 27 27 GLY CA C 27 45.042 45.042 44.401 0.641 25149
1677 1 5 . 1 1 27 27 GLY H H 27 8.569 8.569 7.956 0.613 25149
1678 1 5 . 1 1 28 28 ASP N N 28 122.592 122.592 119.479 3.113 25149
1679 1 5 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.680 -0.449 25149
1680 1 5 . 1 1 28 28 ASP C C 28 176.602 176.602 176.628 -0.026 25149
1681 1 5 . 1 1 28 28 ASP CA C 28 56.402 56.402 54.371 2.031 25149
1682 1 5 . 1 1 28 28 ASP CB C 28 40.912 40.912 41.652 -0.740 25149
1683 1 5 . 1 1 28 28 ASP H H 28 8.214 8.214 8.438 -0.224 25149
1684 1 5 . 1 1 29 29 ASP N N 29 117.500 117.500 119.556 -2.056 25149
1685 1 5 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.399 0.048 25149
1686 1 5 . 1 1 29 29 ASP C C 29 175.505 175.505 176.465 -0.960 25149
1687 1 5 . 1 1 29 29 ASP CA C 29 55.266 55.266 56.243 -0.977 25149
1688 1 5 . 1 1 29 29 ASP CB C 29 41.225 41.225 40.977 0.248 25149
1689 1 5 . 1 1 29 29 ASP H H 29 8.271 8.271 8.232 0.039 25149
1690 1 5 . 1 1 30 30 CYS N N 30 124.470 124.470 119.386 5.084 25149
1691 1 5 . 1 1 30 30 CYS HA H 30 4.390 4.390 4.413 -0.023 25149
1692 1 5 . 1 1 30 30 CYS C C 30 171.755 171.755 172.824 -1.069 25149
1693 1 5 . 1 1 30 30 CYS CA C 30 57.676 57.676 57.917 -0.241 25149
1694 1 5 . 1 1 30 30 CYS CB C 30 29.154 29.154 26.330 2.824 25149
1695 1 5 . 1 1 30 30 CYS H H 30 7.912 7.912 8.496 -0.584 25149
1696 1 5 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.508 0.179 25149
1697 1 5 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.746 0.129 25149
1698 1 5 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.541 1.444 25149
1699 1 5 . 1 1 32 32 LEU N N 32 120.023 120.023 117.837 2.186 25149
1700 1 5 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.558 0.158 25149
1701 1 5 . 1 1 32 32 LEU C C 32 176.300 176.300 174.972 1.328 25149
1702 1 5 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.769 0.152 25149
1703 1 5 . 1 1 32 32 LEU CB C 32 43.336 43.336 43.644 -0.308 25149
1704 1 5 . 1 1 32 32 LEU H H 32 8.580 8.580 7.973 0.607 25149
1705 1 5 . 1 1 33 33 VAL N N 33 116.217 116.217 117.679 -1.462 25149
1706 1 5 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.541 0.122 25149
1707 1 5 . 1 1 33 33 VAL C C 33 171.374 171.374 173.948 -2.574 25149
1708 1 5 . 1 1 33 33 VAL CA C 33 60.449 60.449 60.241 0.208 25149
1709 1 5 . 1 1 33 33 VAL CB C 33 36.448 36.448 36.256 0.192 25149
1710 1 5 . 1 1 33 33 VAL H H 33 8.594 8.594 8.039 0.555 25149
1711 1 5 . 1 1 34 34 TRP N N 34 122.711 122.711 125.080 -2.369 25149
1712 1 5 . 1 1 34 34 TRP HA H 34 5.339 5.339 4.931 0.408 25149
1713 1 5 . 1 1 34 34 TRP C C 34 176.770 176.770 175.452 1.318 25149
1714 1 5 . 1 1 34 34 TRP CA C 34 57.267 57.267 55.749 1.518 25149
1715 1 5 . 1 1 34 34 TRP CB C 34 33.780 33.780 33.352 0.428 25149
1716 1 5 . 1 1 34 34 TRP H H 34 8.756 8.756 8.924 -0.168 25149
1717 1 5 . 1 1 35 35 GLY N N 35 107.569 107.569 106.859 0.710 25149
1718 1 5 . 1 1 35 35 GLY C C 35 177.397 177.397 174.897 2.500 25149
1719 1 5 . 1 1 35 35 GLY CA C 35 44.070 44.070 43.850 0.220 25149
1720 1 5 . 1 1 35 35 GLY H H 35 8.857 8.857 8.576 0.281 25149
1721 1 5 . 1 1 36 36 GLN N N 36 122.723 122.723 119.051 3.672 25149
1722 1 5 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.020 -0.274 25149
1723 1 5 . 1 1 36 36 GLN C C 36 176.445 176.445 175.595 0.850 25149
1724 1 5 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.294 0.135 25149
1725 1 5 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.115 -0.484 25149
1726 1 5 . 1 1 36 36 GLN H H 36 8.338 8.338 8.330 0.008 25149
1727 1 5 . 1 1 37 37 CYS N N 37 115.763 115.763 114.887 0.876 25149
1728 1 5 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.849 -0.565 25149
1729 1 5 . 1 1 37 37 CYS C C 37 175.281 175.281 176.184 -0.903 25149
1730 1 5 . 1 1 37 37 CYS CA C 37 58.395 58.395 56.281 2.115 25149
1731 1 5 . 1 1 37 37 CYS CB C 37 31.143 31.143 31.229 -0.086 25149
1732 1 5 . 1 1 37 37 CYS H H 37 7.622 7.622 7.764 -0.142 25149
1733 1 5 . 1 1 38 38 SER N N 38 114.540 114.540 115.191 -0.651 25149
1734 1 5 . 1 1 38 38 SER HA H 38 4.004 4.004 4.322 -0.318 25149
1735 1 5 . 1 1 38 38 SER C C 38 173.389 173.389 174.062 -0.673 25149
1736 1 5 . 1 1 38 38 SER CA C 38 62.285 62.285 59.948 2.337 25149
1737 1 5 . 1 1 38 38 SER H H 38 7.716 7.716 8.673 -0.957 25149
1738 1 5 . 1 1 39 39 HIS N N 39 121.947 121.947 120.128 1.819 25149
1739 1 5 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.493 -0.049 25149
1740 1 5 . 1 1 39 39 HIS C C 39 172.326 172.326 173.409 -1.083 25149
1741 1 5 . 1 1 39 39 HIS CA C 39 61.320 61.320 56.727 4.593 25149
1742 1 5 . 1 1 39 39 HIS CB C 39 31.523 31.523 30.021 1.502 25149
1743 1 5 . 1 1 39 39 HIS H H 39 7.829 7.829 7.933 -0.104 25149
1744 1 5 . 1 1 40 40 CYS N N 40 121.859 121.859 124.688 -2.829 25149
1745 1 5 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.430 0.179 25149
1746 1 5 . 1 1 40 40 CYS C C 40 171.900 171.900 172.900 -1.000 25149
1747 1 5 . 1 1 40 40 CYS CA C 40 55.791 55.791 56.399 -0.608 25149
1748 1 5 . 1 1 40 40 CYS CB C 40 28.964 28.964 29.333 -0.369 25149
1749 1 5 . 1 1 40 40 CYS H H 40 8.049 8.049 8.621 -0.572 25149
1750 1 5 . 1 1 41 41 PHE N N 41 120.690 120.690 121.125 -0.435 25149
1751 1 5 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.562 0.615 25149
1752 1 5 . 1 1 41 41 PHE C C 41 176.613 176.613 174.542 2.071 25149
1753 1 5 . 1 1 41 41 PHE CA C 41 56.033 56.033 56.227 -0.194 25149
1754 1 5 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.858 1.902 25149
1755 1 5 . 1 1 41 41 PHE H H 41 8.368 8.368 8.535 -0.167 25149
1756 1 5 . 1 1 42 42 HIS N N 42 117.057 117.057 122.046 -4.989 25149
1757 1 5 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.339 0.330 25149
1758 1 5 . 1 1 42 42 HIS C C 42 177.464 177.464 176.226 1.238 25149
1759 1 5 . 1 1 42 42 HIS CA C 42 60.425 60.425 57.437 2.988 25149
1760 1 5 . 1 1 42 42 HIS CB C 42 29.740 29.740 29.204 0.536 25149
1761 1 5 . 1 1 42 42 HIS H H 42 8.384 8.384 8.497 -0.113 25149
1762 1 5 . 1 1 43 43 MET N N 43 128.543 128.543 125.859 2.684 25149
1763 1 5 . 1 1 43 43 MET HA H 43 3.965 3.965 4.028 -0.063 25149
1764 1 5 . 1 1 43 43 MET C C 43 177.845 177.845 177.375 0.470 25149
1765 1 5 . 1 1 43 43 MET CA C 43 59.209 59.209 60.525 -1.316 25149
1766 1 5 . 1 1 43 43 MET CB C 43 33.009 33.009 32.726 0.283 25149
1767 1 5 . 1 1 43 43 MET H H 43 9.439 9.439 8.291 1.148 25149
1768 1 5 . 1 1 44 44 HIS N N 44 116.500 116.500 117.254 -0.754 25149
1769 1 5 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.177 0.079 25149
1770 1 5 . 1 1 44 44 HIS C C 44 178.405 178.405 177.939 0.466 25149
1771 1 5 . 1 1 44 44 HIS CA C 44 58.793 58.793 58.703 0.090 25149
1772 1 5 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.165 3.582 25149
1773 1 5 . 1 1 44 44 HIS H H 44 9.747 9.747 8.168 1.579 25149
1774 1 5 . 1 1 45 45 CYS N N 45 115.950 115.950 117.986 -2.036 25149
1775 1 5 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.162 -0.162 25149
1776 1 5 . 1 1 45 45 CYS C C 45 177.957 177.957 177.309 0.648 25149
1777 1 5 . 1 1 45 45 CYS CA C 45 62.923 62.923 63.610 -0.687 25149
1778 1 5 . 1 1 45 45 CYS CB C 45 29.102 29.102 27.021 2.081 25149
1779 1 5 . 1 1 45 45 CYS H H 45 6.845 6.845 8.092 -1.247 25149
1780 1 5 . 1 1 46 46 ILE N N 46 119.362 119.362 121.528 -2.166 25149
1781 1 5 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.695 -0.030 25149
1782 1 5 . 1 1 46 46 ILE C C 46 176.613 176.613 177.448 -0.835 25149
1783 1 5 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.451 -4.209 25149
1784 1 5 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.686 -0.367 25149
1785 1 5 . 1 1 46 46 ILE H H 46 7.816 7.816 8.058 -0.242 25149
1786 1 5 . 1 1 47 47 LEU N N 47 122.180 122.180 120.556 1.624 25149
1787 1 5 . 1 1 47 47 LEU HA H 47 3.873 3.873 3.906 -0.033 25149
1788 1 5 . 1 1 47 47 LEU C C 47 179.726 179.726 178.663 1.063 25149
1789 1 5 . 1 1 47 47 LEU CA C 47 58.633 58.633 58.881 -0.248 25149
1790 1 5 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.658 -0.535 25149
1791 1 5 . 1 1 47 47 LEU H H 47 8.266 8.266 8.544 -0.278 25149
1792 1 5 . 1 1 48 48 LYS N N 48 118.251 118.251 118.530 -0.279 25149
1793 1 5 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.144 -0.280 25149
1794 1 5 . 1 1 48 48 LYS C C 48 179.423 179.423 178.626 0.797 25149
1795 1 5 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.431 0.556 25149
1796 1 5 . 1 1 48 48 LYS CB C 48 32.765 32.765 31.975 0.790 25149
1797 1 5 . 1 1 48 48 LYS H H 48 7.147 7.147 8.350 -1.203 25149
1798 1 5 . 1 1 49 49 TRP N N 49 120.745 120.745 120.453 0.292 25149
1799 1 5 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.383 -0.303 25149
1800 1 5 . 1 1 49 49 TRP C C 49 178.147 178.147 177.710 0.437 25149
1801 1 5 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.371 0.173 25149
1802 1 5 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.151 0.264 25149
1803 1 5 . 1 1 49 49 TRP H H 49 7.709 7.709 7.529 0.180 25149
1804 1 5 . 1 1 50 50 LEU N N 50 117.236 117.236 117.260 -0.024 25149
1805 1 5 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.730 -0.125 25149
1806 1 5 . 1 1 50 50 LEU C C 50 179.658 179.658 177.092 2.566 25149
1807 1 5 . 1 1 50 50 LEU CA C 50 57.330 57.330 54.813 2.517 25149
1808 1 5 . 1 1 50 50 LEU CB C 50 41.416 41.416 42.332 -0.916 25149
1809 1 5 . 1 1 50 50 LEU H H 50 8.512 8.512 7.866 0.646 25149
1810 1 5 . 1 1 51 51 HIS N N 51 115.650 115.650 116.826 -1.176 25149
1811 1 5 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.551 -0.277 25149
1812 1 5 . 1 1 51 51 HIS C C 51 175.942 175.942 176.550 -0.608 25149
1813 1 5 . 1 1 51 51 HIS CA C 51 57.320 57.320 56.707 0.613 25149
1814 1 5 . 1 1 51 51 HIS CB C 51 29.487 29.487 29.629 -0.142 25149
1815 1 5 . 1 1 51 51 HIS H H 51 7.713 7.713 8.452 -0.739 25149
1816 1 5 . 1 1 52 52 ALA N N 52 119.779 119.779 122.177 -2.398 25149
1817 1 5 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.245 -0.222 25149
1818 1 5 . 1 1 52 52 ALA C C 52 177.834 177.834 177.251 0.583 25149
1819 1 5 . 1 1 52 52 ALA CA C 52 52.865 52.865 53.818 -0.953 25149
1820 1 5 . 1 1 52 52 ALA CB C 52 18.951 18.951 19.379 -0.428 25149
1821 1 5 . 1 1 52 52 ALA H H 52 7.191 7.191 8.052 -0.861 25149
1822 1 5 . 1 1 53 53 GLN N N 53 117.047 117.047 115.042 2.005 25149
1823 1 5 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.594 -0.661 25149
1824 1 5 . 1 1 53 53 GLN C C 53 175.998 175.998 174.988 1.010 25149
1825 1 5 . 1 1 53 53 GLN CA C 53 55.482 55.482 54.759 0.723 25149
1826 1 5 . 1 1 53 53 GLN CB C 53 28.887 28.887 30.111 -1.224 25149
1827 1 5 . 1 1 53 53 GLN H H 53 7.317 7.317 8.000 -0.683 25149
1828 1 5 . 1 1 54 54 GLN N N 54 118.463 118.463 117.634 0.829 25149
1829 1 5 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.436 -0.447 25149
1830 1 5 . 1 1 54 54 GLN C C 54 176.300 176.300 177.168 -0.868 25149
1831 1 5 . 1 1 54 54 GLN CA C 54 57.314 57.314 55.395 1.919 25149
1832 1 5 . 1 1 54 54 GLN CB C 54 28.823 28.823 29.545 -0.722 25149
1833 1 5 . 1 1 54 54 GLN H H 54 7.949 7.949 8.638 -0.689 25149
1834 1 5 . 1 1 55 55 VAL N N 55 116.755 116.755 120.056 -3.301 25149
1835 1 5 . 1 1 55 55 VAL HA H 55 3.884 3.884 3.771 0.113 25149
1836 1 5 . 1 1 55 55 VAL C C 55 175.774 175.774 175.599 0.175 25149
1837 1 5 . 1 1 55 55 VAL CA C 55 63.210 63.210 64.500 -1.290 25149
1838 1 5 . 1 1 55 55 VAL CB C 55 32.870 32.870 31.754 1.116 25149
1839 1 5 . 1 1 55 55 VAL H H 55 7.801 7.801 7.737 0.064 25149
1840 1 5 . 1 1 56 56 GLN N N 56 120.192 120.192 116.530 3.662 25149
1841 1 5 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.539 -0.422 25149
1842 1 5 . 1 1 56 56 GLN C C 56 175.236 175.236 174.991 0.245 25149
1843 1 5 . 1 1 56 56 GLN CA C 56 55.697 55.697 55.093 0.604 25149
1844 1 5 . 1 1 56 56 GLN CB C 56 29.319 29.319 30.345 -1.026 25149
1845 1 5 . 1 1 56 56 GLN H H 56 8.018 8.018 7.932 0.086 25149
1846 1 5 . 1 1 57 57 GLN N N 57 121.276 121.276 122.889 -1.613 25149
1847 1 5 . 1 1 57 57 GLN HA H 57 4.204 4.204 4.152 0.052 25149
1848 1 5 . 1 1 57 57 GLN C C 57 175.819 175.819 175.816 0.003 25149
1849 1 5 . 1 1 57 57 GLN CA C 57 55.617 55.617 55.971 -0.354 25149
1850 1 5 . 1 1 57 57 GLN CB C 57 29.094 29.094 28.633 0.461 25149
1851 1 5 . 1 1 57 57 GLN H H 57 8.471 8.471 8.666 -0.195 25149
1852 1 5 . 1 1 58 58 HIS N N 58 120.001 120.001 118.983 1.018 25149
1853 1 5 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.476 0.698 25149
1854 1 5 . 1 1 58 58 HIS C C 58 173.636 173.636 176.226 -2.590 25149
1855 1 5 . 1 1 58 58 HIS CA C 58 54.353 54.353 57.816 -3.463 25149
1856 1 5 . 1 1 58 58 HIS CB C 58 33.057 33.057 30.217 2.840 25149
1857 1 5 . 1 1 58 58 HIS H H 58 8.366 8.366 8.056 0.310 25149
1858 1 5 . 1 1 59 59 CYS N N 59 121.924 121.924 118.456 3.468 25149
1859 1 5 . 1 1 59 59 CYS HA H 59 4.442 4.442 4.467 -0.025 25149
1860 1 5 . 1 1 59 59 CYS C C 59 176.334 176.334 175.222 1.112 25149
1861 1 5 . 1 1 59 59 CYS CA C 59 56.772 56.772 58.785 -2.013 25149
1862 1 5 . 1 1 59 59 CYS CB C 59 32.642 32.642 28.397 4.245 25149
1863 1 5 . 1 1 59 59 CYS H H 59 9.035 9.035 8.392 0.643 25149
1864 1 5 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.399 -0.586 25149
1865 1 5 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.717 -0.056 25149
1866 1 5 . 1 1 60 60 PRO CB C 60 30.659 30.659 30.775 -0.116 25149
1867 1 5 . 1 1 61 61 MET N N 61 117.676 117.676 116.050 1.626 25149
1868 1 5 . 1 1 61 61 MET HA H 61 4.317 4.317 4.497 -0.180 25149
1869 1 5 . 1 1 61 61 MET C C 61 177.117 177.117 176.188 0.929 25149
1870 1 5 . 1 1 61 61 MET CA C 61 56.408 56.408 56.678 -0.270 25149
1871 1 5 . 1 1 61 61 MET CB C 61 32.551 32.551 32.697 -0.146 25149
1872 1 5 . 1 1 61 61 MET H H 61 9.135 9.135 7.504 1.631 25149
1873 1 5 . 1 1 62 62 CYS N N 62 117.214 117.214 119.026 -1.812 25149
1874 1 5 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.556 0.318 25149
1875 1 5 . 1 1 62 62 CYS C C 62 175.740 175.740 175.241 0.499 25149
1876 1 5 . 1 1 62 62 CYS CA C 62 58.273 58.273 58.149 0.124 25149
1877 1 5 . 1 1 62 62 CYS CB C 62 32.776 32.776 29.317 3.459 25149
1878 1 5 . 1 1 62 62 CYS H H 62 8.011 8.011 7.906 0.105 25149
1879 1 5 . 1 1 63 63 ARG N N 63 116.555 116.555 118.306 -1.751 25149
1880 1 5 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.332 -0.407 25149
1881 1 5 . 1 1 63 63 ARG C C 63 175.326 175.326 175.896 -0.570 25149
1882 1 5 . 1 1 63 63 ARG CA C 63 58.073 58.073 56.776 1.297 25149
1883 1 5 . 1 1 63 63 ARG CB C 63 27.136 27.136 30.488 -3.352 25149
1884 1 5 . 1 1 63 63 ARG H H 63 8.086 8.086 8.463 -0.377 25149
1885 1 5 . 1 1 64 64 GLN N N 64 118.932 118.932 119.937 -1.005 25149
1886 1 5 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.198 0.061 25149
1887 1 5 . 1 1 64 64 GLN C C 64 176.054 176.054 176.031 0.023 25149
1888 1 5 . 1 1 64 64 GLN CA C 64 56.316 56.316 56.454 -0.138 25149
1889 1 5 . 1 1 64 64 GLN CB C 64 30.083 30.083 28.416 1.667 25149
1890 1 5 . 1 1 64 64 GLN H H 64 8.003 8.003 8.030 -0.027 25149
1891 1 5 . 1 1 65 65 GLU N N 65 122.038 122.038 120.201 1.837 25149
1892 1 5 . 1 1 65 65 GLU HA H 65 4.003 4.003 3.900 0.103 25149
1893 1 5 . 1 1 65 65 GLU C C 65 176.781 176.781 176.147 0.634 25149
1894 1 5 . 1 1 65 65 GLU CA C 65 57.682 57.682 56.723 0.959 25149
1895 1 5 . 1 1 65 65 GLU CB C 65 29.900 29.900 29.203 0.696 25149
1896 1 5 . 1 1 65 65 GLU H H 65 8.657 8.657 8.562 0.095 25149
1897 1 5 . 1 1 66 66 TRP N N 66 125.730 125.730 127.810 -2.080 25149
1898 1 5 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.264 0.140 25149
1899 1 5 . 1 1 66 66 TRP C C 66 175.460 175.460 175.016 0.444 25149
1900 1 5 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.767 -0.142 25149
1901 1 5 . 1 1 66 66 TRP CB C 66 29.358 29.358 29.899 -0.541 25149
1902 1 5 . 1 1 66 66 TRP H H 66 8.499 8.499 8.196 0.303 25149
1903 1 5 . 1 1 67 67 LYS N N 67 127.396 127.396 126.992 0.404 25149
1904 1 5 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.096 -0.078 25149
1905 1 5 . 1 1 67 67 LYS C C 67 175.180 175.180 174.613 0.567 25149
1906 1 5 . 1 1 67 67 LYS CA C 67 54.514 54.514 53.895 0.619 25149
1907 1 5 . 1 1 67 67 LYS CB C 67 36.231 36.231 34.594 1.637 25149
1908 1 5 . 1 1 67 67 LYS H H 67 6.930 6.930 8.632 -1.702 25149
1909 1 5 . 1 1 68 68 PHE N N 68 121.511 121.511 126.954 -5.443 25149
1910 1 5 . 1 1 68 68 PHE HA H 68 4.108 4.108 4.014 0.094 25149
1911 1 5 . 1 1 68 68 PHE C C 68 176.613 176.613 175.205 1.408 25149
1912 1 5 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.634 2.327 25149
1913 1 5 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.691 1.571 25149
1914 1 5 . 1 1 68 68 PHE H H 68 8.430 8.430 8.563 -0.133 25149
1915 1 5 . 1 1 69 69 LYS N N 69 124.210 124.210 122.451 1.759 25149
1916 1 5 . 1 1 69 69 LYS HA H 69 3.995 3.995 3.996 -0.001 25149
1917 1 5 . 1 1 69 69 LYS C C 69 175.651 175.651 176.718 -1.067 25149
1918 1 5 . 1 1 69 69 LYS CA C 69 57.320 57.320 57.250 0.070 25149
1919 1 5 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.368 -0.007 25149
1920 1 5 . 1 1 69 69 LYS H H 69 8.738 8.738 7.973 0.765 25149
1921 1 6 . 1 1 2 2 SER HA H 2 4.417 4.417 4.737 -0.320 25149
1922 1 6 . 1 1 2 2 SER CA C 2 58.322 58.322 57.913 0.409 25149
1923 1 6 . 1 1 2 2 SER CB C 2 64.169 64.169 64.889 -0.720 25149
1924 1 6 . 1 1 3 3 VAL N N 3 121.214 121.214 120.470 0.744 25149
1925 1 6 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.335 -0.289 25149
1926 1 6 . 1 1 3 3 VAL C C 3 175.879 175.879 174.940 0.939 25149
1927 1 6 . 1 1 3 3 VAL CA C 3 62.138 62.138 62.200 -0.062 25149
1928 1 6 . 1 1 3 3 VAL CB C 3 32.958 32.958 34.067 -1.109 25149
1929 1 6 . 1 1 3 3 VAL H H 3 8.170 8.170 8.177 -0.007 25149
1930 1 6 . 1 1 4 4 ALA N N 4 127.312 127.312 129.923 -2.611 25149
1931 1 6 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.422 -0.225 25149
1932 1 6 . 1 1 4 4 ALA C C 4 177.497 177.497 176.610 0.887 25149
1933 1 6 . 1 1 4 4 ALA CA C 4 52.439 52.439 52.078 0.361 25149
1934 1 6 . 1 1 4 4 ALA CB C 4 19.424 19.424 19.421 0.003 25149
1935 1 6 . 1 1 4 4 ALA H H 4 8.294 8.294 8.278 0.016 25149
1936 1 6 . 1 1 5 5 ASN N N 5 117.674 117.674 118.543 -0.869 25149
1937 1 6 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.817 -0.252 25149
1938 1 6 . 1 1 5 5 ASN C C 5 175.048 175.048 174.308 0.740 25149
1939 1 6 . 1 1 5 5 ASN CA C 5 53.725 53.725 53.411 0.314 25149
1940 1 6 . 1 1 5 5 ASN CB C 5 39.197 39.197 39.619 -0.422 25149
1941 1 6 . 1 1 5 5 ASN H H 5 8.252 8.252 8.018 0.234 25149
1942 1 6 . 1 1 6 6 ASP N N 6 119.896 119.896 122.683 -2.787 25149
1943 1 6 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.679 -0.159 25149
1944 1 6 . 1 1 6 6 ASP C C 6 176.269 176.269 176.225 0.044 25149
1945 1 6 . 1 1 6 6 ASP CA C 6 54.497 54.497 53.910 0.587 25149
1946 1 6 . 1 1 6 6 ASP CB C 6 41.104 41.104 40.986 0.118 25149
1947 1 6 . 1 1 6 6 ASP H H 6 8.215 8.215 8.644 -0.429 25149
1948 1 6 . 1 1 7 7 GLU N N 7 119.101 119.101 119.233 -0.132 25149
1949 1 6 . 1 1 7 7 GLU HA H 7 4.243 4.243 4.385 -0.142 25149
1950 1 6 . 1 1 7 7 GLU C C 7 175.006 175.006 174.801 0.205 25149
1951 1 6 . 1 1 7 7 GLU CA C 7 56.689 56.689 55.989 0.700 25149
1952 1 6 . 1 1 7 7 GLU CB C 7 30.379 30.379 29.263 1.116 25149
1953 1 6 . 1 1 7 7 GLU H H 7 8.065 8.065 8.084 -0.019 25149
1954 1 6 . 1 1 8 8 ASN N N 8 116.852 116.852 115.757 1.095 25149
1955 1 6 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.351 -0.193 25149
1956 1 6 . 1 1 8 8 ASN C C 8 172.706 172.706 174.570 -1.864 25149
1957 1 6 . 1 1 8 8 ASN CA C 8 51.165 51.165 51.218 -0.053 25149
1958 1 6 . 1 1 8 8 ASN CB C 8 40.702 40.702 39.966 0.736 25149
1959 1 6 . 1 1 8 8 ASN H H 8 7.505 7.505 7.467 0.038 25149
1960 1 6 . 1 1 9 9 CYS N N 9 122.855 122.855 120.751 2.104 25149
1961 1 6 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.644 0.150 25149
1962 1 6 . 1 1 9 9 CYS C C 9 178.370 178.370 176.282 2.088 25149
1963 1 6 . 1 1 9 9 CYS CA C 9 59.552 59.552 60.556 -1.004 25149
1964 1 6 . 1 1 9 9 CYS CB C 9 31.526 31.526 28.446 3.080 25149
1965 1 6 . 1 1 9 9 CYS H H 9 7.614 7.614 7.660 -0.046 25149
1966 1 6 . 1 1 10 10 GLY N N 10 117.295 117.295 107.673 9.622 25149
1967 1 6 . 1 1 10 10 GLY C C 10 174.111 174.111 174.447 -0.336 25149
1968 1 6 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.441 1.526 25149
1969 1 6 . 1 1 10 10 GLY H H 10 9.235 9.235 7.756 1.479 25149
1970 1 6 . 1 1 11 11 ILE N N 11 119.811 119.811 120.207 -0.396 25149
1971 1 6 . 1 1 11 11 ILE HA H 11 3.809 3.809 4.074 -0.265 25149
1972 1 6 . 1 1 11 11 ILE C C 11 176.121 176.121 176.582 -0.461 25149
1973 1 6 . 1 1 11 11 ILE CA C 11 64.041 64.041 64.105 -0.064 25149
1974 1 6 . 1 1 11 11 ILE CB C 11 39.411 39.411 38.737 0.674 25149
1975 1 6 . 1 1 11 11 ILE H H 11 8.285 8.285 7.617 0.668 25149
1976 1 6 . 1 1 12 12 CYS N N 12 116.728 116.728 115.756 0.972 25149
1977 1 6 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.621 -0.045 25149
1978 1 6 . 1 1 12 12 CYS C C 12 175.975 175.975 173.813 2.162 25149
1979 1 6 . 1 1 12 12 CYS CA C 12 59.225 59.225 56.444 2.781 25149
1980 1 6 . 1 1 12 12 CYS CB C 12 32.246 32.246 28.247 3.998 25149
1981 1 6 . 1 1 12 12 CYS H H 12 7.607 7.607 7.808 -0.201 25149
1982 1 6 . 1 1 13 13 ARG N N 13 116.073 116.073 116.700 -0.627 25149
1983 1 6 . 1 1 13 13 ARG HA H 13 3.742 3.742 3.966 -0.224 25149
1984 1 6 . 1 1 13 13 ARG C C 13 174.979 174.979 174.591 0.388 25149
1985 1 6 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.725 0.911 25149
1986 1 6 . 1 1 13 13 ARG CB C 13 26.326 26.326 26.549 -0.223 25149
1987 1 6 . 1 1 13 13 ARG H H 13 7.987 7.987 8.310 -0.323 25149
1988 1 6 . 1 1 14 14 MET N N 14 119.313 119.313 119.447 -0.134 25149
1989 1 6 . 1 1 14 14 MET HA H 14 4.547 4.547 4.514 0.033 25149
1990 1 6 . 1 1 14 14 MET C C 14 176.143 176.143 175.314 0.829 25149
1991 1 6 . 1 1 14 14 MET CA C 14 54.208 54.208 53.994 0.214 25149
1992 1 6 . 1 1 14 14 MET CB C 14 33.951 33.951 34.880 -0.929 25149
1993 1 6 . 1 1 14 14 MET H H 14 8.624 8.624 7.593 1.031 25149
1994 1 6 . 1 1 15 15 ALA N N 15 122.683 122.683 129.723 -7.040 25149
1995 1 6 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.174 0.098 25149
1996 1 6 . 1 1 15 15 ALA C C 15 180.117 180.117 178.408 1.709 25149
1997 1 6 . 1 1 15 15 ALA CA C 15 52.346 52.346 52.423 -0.077 25149
1998 1 6 . 1 1 15 15 ALA CB C 15 19.487 19.487 18.822 0.665 25149
1999 1 6 . 1 1 15 15 ALA H H 15 7.965 7.965 8.423 -0.458 25149
2000 1 6 . 1 1 16 16 PHE N N 16 119.313 119.313 121.189 -1.876 25149
2001 1 6 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.441 -0.400 25149
2002 1 6 . 1 1 16 16 PHE C C 16 176.423 176.423 176.901 -0.478 25149
2003 1 6 . 1 1 16 16 PHE CA C 16 59.130 59.130 60.153 -1.022 25149
2004 1 6 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.410 -0.020 25149
2005 1 6 . 1 1 16 16 PHE H H 16 8.095 8.095 7.618 0.477 25149
2006 1 6 . 1 1 17 17 ASN N N 17 112.313 112.313 116.655 -4.342 25149
2007 1 6 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.895 -0.259 25149
2008 1 6 . 1 1 17 17 ASN C C 17 175.337 175.337 174.904 0.433 25149
2009 1 6 . 1 1 17 17 ASN CA C 17 52.961 52.961 53.285 -0.324 25149
2010 1 6 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.745 -1.571 25149
2011 1 6 . 1 1 17 17 ASN H H 17 7.823 7.823 8.223 -0.400 25149
2012 1 6 . 1 1 18 18 GLY N N 18 107.742 107.742 108.007 -0.265 25149
2013 1 6 . 1 1 18 18 GLY C C 18 173.759 173.759 173.296 0.463 25149
2014 1 6 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.255 0.209 25149
2015 1 6 . 1 1 18 18 GLY H H 18 7.579 7.579 7.919 -0.340 25149
2016 1 6 . 1 1 19 19 CYS N N 19 117.050 117.050 118.068 -1.018 25149
2017 1 6 . 1 1 19 19 CYS HA H 19 4.571 4.571 4.431 0.140 25149
2018 1 6 . 1 1 19 19 CYS C C 19 174.039 174.039 174.514 -0.475 25149
2019 1 6 . 1 1 19 19 CYS CA C 19 58.433 58.433 57.670 0.763 25149
2020 1 6 . 1 1 19 19 CYS CB C 19 30.681 30.681 28.589 2.092 25149
2021 1 6 . 1 1 19 19 CYS H H 19 8.198 8.198 8.228 -0.030 25149
2022 1 6 . 1 1 20 20 CYS N N 20 123.923 123.923 118.957 4.966 25149
2023 1 6 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.557 -0.546 25149
2024 1 6 . 1 1 20 20 CYS C C 20 173.736 173.736 174.296 -0.560 25149
2025 1 6 . 1 1 20 20 CYS CA C 20 57.999 57.999 56.428 1.571 25149
2026 1 6 . 1 1 20 20 CYS CB C 20 28.205 28.205 28.121 0.084 25149
2027 1 6 . 1 1 20 20 CYS H H 20 8.466 8.466 8.414 0.052 25149
2028 1 6 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.356 -0.327 25149
2029 1 6 . 1 1 21 21 PRO CA C 21 65.426 65.426 64.846 0.580 25149
2030 1 6 . 1 1 21 21 PRO CB C 21 32.801 32.801 32.134 0.667 25149
2031 1 6 . 1 1 22 22 ASP N N 22 117.053 117.053 118.495 -1.442 25149
2032 1 6 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.640 -0.135 25149
2033 1 6 . 1 1 22 22 ASP C C 22 176.501 176.501 175.768 0.733 25149
2034 1 6 . 1 1 22 22 ASP CA C 22 55.017 55.017 54.525 0.492 25149
2035 1 6 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.446 2.076 25149
2036 1 6 . 1 1 22 22 ASP H H 22 8.395 8.395 8.600 -0.205 25149
2037 1 6 . 1 1 23 23 CYS N N 23 123.353 123.353 118.030 5.323 25149
2038 1 6 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.492 -0.199 25149
2039 1 6 . 1 1 23 23 CYS C C 23 175.214 175.214 175.314 -0.100 25149
2040 1 6 . 1 1 23 23 CYS CA C 23 61.633 61.633 57.277 4.356 25149
2041 1 6 . 1 1 23 23 CYS CB C 23 31.542 31.542 29.791 1.751 25149
2042 1 6 . 1 1 23 23 CYS H H 23 7.246 7.246 7.422 -0.176 25149
2043 1 6 . 1 1 24 24 LYS N N 24 117.539 117.539 120.615 -3.076 25149
2044 1 6 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.405 -0.175 25149
2045 1 6 . 1 1 24 24 LYS C C 24 177.106 177.106 176.112 0.994 25149
2046 1 6 . 1 1 24 24 LYS CA C 24 56.921 56.921 56.880 0.041 25149
2047 1 6 . 1 1 24 24 LYS CB C 24 34.615 34.615 33.435 1.180 25149
2048 1 6 . 1 1 24 24 LYS H H 24 8.173 8.173 8.273 -0.100 25149
2049 1 6 . 1 1 25 25 VAL N N 25 120.661 120.661 121.534 -0.873 25149
2050 1 6 . 1 1 25 25 VAL HA H 25 4.429 4.429 4.208 0.221 25149
2051 1 6 . 1 1 25 25 VAL C C 25 174.027 174.027 173.772 0.255 25149
2052 1 6 . 1 1 25 25 VAL CA C 25 59.934 59.934 61.309 -1.375 25149
2053 1 6 . 1 1 25 25 VAL CB C 25 33.507 33.507 32.743 0.764 25149
2054 1 6 . 1 1 25 25 VAL H H 25 7.787 7.787 7.601 0.186 25149
2055 1 6 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.552 -0.216 25149
2056 1 6 . 1 1 26 26 PRO CA C 26 63.279 63.279 63.593 -0.314 25149
2057 1 6 . 1 1 26 26 PRO CB C 26 32.077 32.077 32.433 -0.356 25149
2058 1 6 . 1 1 27 27 GLY N N 27 109.926 109.926 109.203 0.723 25149
2059 1 6 . 1 1 27 27 GLY C C 27 175.169 175.169 174.530 0.639 25149
2060 1 6 . 1 1 27 27 GLY CA C 27 45.042 45.042 45.289 -0.247 25149
2061 1 6 . 1 1 27 27 GLY H H 27 8.569 8.569 8.259 0.310 25149
2062 1 6 . 1 1 28 28 ASP N N 28 122.592 122.592 124.183 -1.591 25149
2063 1 6 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.719 -0.488 25149
2064 1 6 . 1 1 28 28 ASP C C 28 176.602 176.602 176.297 0.305 25149
2065 1 6 . 1 1 28 28 ASP CA C 28 56.402 56.402 54.062 2.340 25149
2066 1 6 . 1 1 28 28 ASP CB C 28 40.912 40.912 41.783 -0.871 25149
2067 1 6 . 1 1 28 28 ASP H H 28 8.214 8.214 8.673 -0.459 25149
2068 1 6 . 1 1 29 29 ASP N N 29 117.500 117.500 122.972 -5.472 25149
2069 1 6 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.815 -0.368 25149
2070 1 6 . 1 1 29 29 ASP C C 29 175.505 175.505 175.353 0.152 25149
2071 1 6 . 1 1 29 29 ASP CA C 29 55.266 55.266 53.958 1.308 25149
2072 1 6 . 1 1 29 29 ASP CB C 29 41.225 41.225 39.328 1.897 25149
2073 1 6 . 1 1 29 29 ASP H H 29 8.271 8.271 8.386 -0.115 25149
2074 1 6 . 1 1 30 30 CYS N N 30 124.470 124.470 119.865 4.605 25149
2075 1 6 . 1 1 30 30 CYS HA H 30 4.390 4.390 4.775 -0.385 25149
2076 1 6 . 1 1 30 30 CYS C C 30 171.755 171.755 172.811 -1.056 25149
2077 1 6 . 1 1 30 30 CYS CA C 30 57.676 57.676 55.901 1.775 25149
2078 1 6 . 1 1 30 30 CYS CB C 30 29.154 29.154 28.414 0.740 25149
2079 1 6 . 1 1 30 30 CYS H H 30 7.912 7.912 7.683 0.229 25149
2080 1 6 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.557 0.130 25149
2081 1 6 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.638 0.237 25149
2082 1 6 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.442 1.542 25149
2083 1 6 . 1 1 32 32 LEU N N 32 120.023 120.023 117.954 2.069 25149
2084 1 6 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.592 0.124 25149
2085 1 6 . 1 1 32 32 LEU C C 32 176.300 176.300 175.133 1.167 25149
2086 1 6 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.896 0.025 25149
2087 1 6 . 1 1 32 32 LEU CB C 32 43.336 43.336 43.733 -0.397 25149
2088 1 6 . 1 1 32 32 LEU H H 32 8.580 8.580 8.073 0.507 25149
2089 1 6 . 1 1 33 33 VAL N N 33 116.217 116.217 118.685 -2.468 25149
2090 1 6 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.460 0.203 25149
2091 1 6 . 1 1 33 33 VAL C C 33 171.374 171.374 173.830 -2.456 25149
2092 1 6 . 1 1 33 33 VAL CA C 33 60.449 60.449 59.964 0.485 25149
2093 1 6 . 1 1 33 33 VAL CB C 33 36.448 36.448 35.594 0.854 25149
2094 1 6 . 1 1 33 33 VAL H H 33 8.594 8.594 8.071 0.523 25149
2095 1 6 . 1 1 34 34 TRP N N 34 122.711 122.711 124.902 -2.191 25149
2096 1 6 . 1 1 34 34 TRP HA H 34 5.339 5.339 4.945 0.394 25149
2097 1 6 . 1 1 34 34 TRP C C 34 176.770 176.770 175.399 1.371 25149
2098 1 6 . 1 1 34 34 TRP CA C 34 57.267 57.267 55.670 1.597 25149
2099 1 6 . 1 1 34 34 TRP CB C 34 33.780 33.780 33.526 0.254 25149
2100 1 6 . 1 1 34 34 TRP H H 34 8.756 8.756 8.275 0.481 25149
2101 1 6 . 1 1 35 35 GLY N N 35 107.569 107.569 107.481 0.088 25149
2102 1 6 . 1 1 35 35 GLY C C 35 177.397 177.397 174.702 2.695 25149
2103 1 6 . 1 1 35 35 GLY CA C 35 44.070 44.070 44.077 -0.007 25149
2104 1 6 . 1 1 35 35 GLY H H 35 8.857 8.857 8.646 0.211 25149
2105 1 6 . 1 1 36 36 GLN N N 36 122.723 122.723 118.841 3.882 25149
2106 1 6 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.034 -0.288 25149
2107 1 6 . 1 1 36 36 GLN C C 36 176.445 176.445 175.885 0.560 25149
2108 1 6 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.328 0.101 25149
2109 1 6 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.311 -0.680 25149
2110 1 6 . 1 1 36 36 GLN H H 36 8.338 8.338 8.503 -0.165 25149
2111 1 6 . 1 1 37 37 CYS N N 37 115.763 115.763 114.001 1.762 25149
2112 1 6 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.861 -0.577 25149
2113 1 6 . 1 1 37 37 CYS C C 37 175.281 175.281 175.592 -0.311 25149
2114 1 6 . 1 1 37 37 CYS CA C 37 58.395 58.395 56.088 2.307 25149
2115 1 6 . 1 1 37 37 CYS CB C 37 31.143 31.143 31.193 -0.050 25149
2116 1 6 . 1 1 37 37 CYS H H 37 7.622 7.622 7.715 -0.093 25149
2117 1 6 . 1 1 38 38 SER N N 38 114.540 114.540 115.106 -0.566 25149
2118 1 6 . 1 1 38 38 SER HA H 38 4.004 4.004 4.195 -0.191 25149
2119 1 6 . 1 1 38 38 SER C C 38 173.389 173.389 174.525 -1.136 25149
2120 1 6 . 1 1 38 38 SER CA C 38 62.285 62.285 60.518 1.767 25149
2121 1 6 . 1 1 38 38 SER H H 38 7.716 7.716 8.583 -0.867 25149
2122 1 6 . 1 1 39 39 HIS N N 39 121.947 121.947 121.407 0.540 25149
2123 1 6 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.385 0.059 25149
2124 1 6 . 1 1 39 39 HIS C C 39 172.326 172.326 172.990 -0.664 25149
2125 1 6 . 1 1 39 39 HIS CA C 39 61.320 61.320 56.156 5.164 25149
2126 1 6 . 1 1 39 39 HIS CB C 39 31.523 31.523 30.034 1.489 25149
2127 1 6 . 1 1 39 39 HIS H H 39 7.829 7.829 7.651 0.178 25149
2128 1 6 . 1 1 40 40 CYS N N 40 121.859 121.859 122.955 -1.096 25149
2129 1 6 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.394 0.215 25149
2130 1 6 . 1 1 40 40 CYS C C 40 171.900 171.900 172.253 -0.353 25149
2131 1 6 . 1 1 40 40 CYS CA C 40 55.791 55.791 55.569 0.222 25149
2132 1 6 . 1 1 40 40 CYS CB C 40 28.964 28.964 28.344 0.620 25149
2133 1 6 . 1 1 40 40 CYS H H 40 8.049 8.049 8.484 -0.435 25149
2134 1 6 . 1 1 41 41 PHE N N 41 120.690 120.690 120.747 -0.057 25149
2135 1 6 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.639 0.538 25149
2136 1 6 . 1 1 41 41 PHE C C 41 176.613 176.613 174.917 1.696 25149
2137 1 6 . 1 1 41 41 PHE CA C 41 56.033 56.033 55.766 0.268 25149
2138 1 6 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.623 2.137 25149
2139 1 6 . 1 1 41 41 PHE H H 41 8.368 8.368 8.379 -0.011 25149
2140 1 6 . 1 1 42 42 HIS N N 42 117.057 117.057 122.641 -5.584 25149
2141 1 6 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.401 0.268 25149
2142 1 6 . 1 1 42 42 HIS C C 42 177.464 177.464 175.946 1.518 25149
2143 1 6 . 1 1 42 42 HIS CA C 42 60.425 60.425 57.382 3.043 25149
2144 1 6 . 1 1 42 42 HIS CB C 42 29.740 29.740 30.165 -0.425 25149
2145 1 6 . 1 1 42 42 HIS H H 42 8.384 8.384 8.142 0.242 25149
2146 1 6 . 1 1 43 43 MET N N 43 128.543 128.543 125.927 2.616 25149
2147 1 6 . 1 1 43 43 MET HA H 43 3.965 3.965 4.047 -0.082 25149
2148 1 6 . 1 1 43 43 MET C C 43 177.845 177.845 177.315 0.530 25149
2149 1 6 . 1 1 43 43 MET CA C 43 59.209 59.209 60.475 -1.266 25149
2150 1 6 . 1 1 43 43 MET CB C 43 33.009 33.009 32.711 0.298 25149
2151 1 6 . 1 1 43 43 MET H H 43 9.439 9.439 8.449 0.990 25149
2152 1 6 . 1 1 44 44 HIS N N 44 116.500 116.500 117.868 -1.368 25149
2153 1 6 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.264 -0.008 25149
2154 1 6 . 1 1 44 44 HIS C C 44 178.405 178.405 177.953 0.452 25149
2155 1 6 . 1 1 44 44 HIS CA C 44 58.793 58.793 58.922 -0.129 25149
2156 1 6 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.388 3.359 25149
2157 1 6 . 1 1 44 44 HIS H H 44 9.747 9.747 8.281 1.466 25149
2158 1 6 . 1 1 45 45 CYS N N 45 115.950 115.950 117.684 -1.734 25149
2159 1 6 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.233 -0.233 25149
2160 1 6 . 1 1 45 45 CYS C C 45 177.957 177.957 177.264 0.693 25149
2161 1 6 . 1 1 45 45 CYS CA C 45 62.923 62.923 63.313 -0.390 25149
2162 1 6 . 1 1 45 45 CYS CB C 45 29.102 29.102 26.769 2.333 25149
2163 1 6 . 1 1 45 45 CYS H H 45 6.845 6.845 8.233 -1.388 25149
2164 1 6 . 1 1 46 46 ILE N N 46 119.362 119.362 121.339 -1.977 25149
2165 1 6 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.694 -0.029 25149
2166 1 6 . 1 1 46 46 ILE C C 46 176.613 176.613 177.766 -1.153 25149
2167 1 6 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.568 -4.326 25149
2168 1 6 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.796 -0.477 25149
2169 1 6 . 1 1 46 46 ILE H H 46 7.816 7.816 7.951 -0.135 25149
2170 1 6 . 1 1 47 47 LEU N N 47 122.180 122.180 120.559 1.621 25149
2171 1 6 . 1 1 47 47 LEU HA H 47 3.873 3.873 4.186 -0.313 25149
2172 1 6 . 1 1 47 47 LEU C C 47 179.726 179.726 178.997 0.729 25149
2173 1 6 . 1 1 47 47 LEU CA C 47 58.633 58.633 59.167 -0.534 25149
2174 1 6 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.950 -0.827 25149
2175 1 6 . 1 1 47 47 LEU H H 47 8.266 8.266 8.638 -0.372 25149
2176 1 6 . 1 1 48 48 LYS N N 48 118.251 118.251 118.640 -0.389 25149
2177 1 6 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.224 -0.360 25149
2178 1 6 . 1 1 48 48 LYS C C 48 179.423 179.423 178.660 0.763 25149
2179 1 6 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.536 0.451 25149
2180 1 6 . 1 1 48 48 LYS CB C 48 32.765 32.765 31.913 0.852 25149
2181 1 6 . 1 1 48 48 LYS H H 48 7.147 7.147 8.305 -1.158 25149
2182 1 6 . 1 1 49 49 TRP N N 49 120.745 120.745 120.484 0.261 25149
2183 1 6 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.388 -0.308 25149
2184 1 6 . 1 1 49 49 TRP C C 49 178.147 178.147 177.861 0.286 25149
2185 1 6 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.358 0.188 25149
2186 1 6 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.163 0.252 25149
2187 1 6 . 1 1 49 49 TRP H H 49 7.709 7.709 7.538 0.171 25149
2188 1 6 . 1 1 50 50 LEU N N 50 117.236 117.236 117.803 -0.567 25149
2189 1 6 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.674 -0.069 25149
2190 1 6 . 1 1 50 50 LEU C C 50 179.658 179.658 176.871 2.787 25149
2191 1 6 . 1 1 50 50 LEU CA C 50 57.330 57.330 54.788 2.542 25149
2192 1 6 . 1 1 50 50 LEU CB C 50 41.416 41.416 42.138 -0.722 25149
2193 1 6 . 1 1 50 50 LEU H H 50 8.512 8.512 7.875 0.637 25149
2194 1 6 . 1 1 51 51 HIS N N 51 115.650 115.650 118.158 -2.508 25149
2195 1 6 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.494 -0.220 25149
2196 1 6 . 1 1 51 51 HIS C C 51 175.942 175.942 176.178 -0.236 25149
2197 1 6 . 1 1 51 51 HIS CA C 51 57.320 57.320 57.018 0.302 25149
2198 1 6 . 1 1 51 51 HIS CB C 51 29.487 29.487 30.178 -0.691 25149
2199 1 6 . 1 1 51 51 HIS H H 51 7.713 7.713 8.421 -0.708 25149
2200 1 6 . 1 1 52 52 ALA N N 52 119.779 119.779 122.104 -2.325 25149
2201 1 6 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.172 -0.149 25149
2202 1 6 . 1 1 52 52 ALA C C 52 177.834 177.834 177.618 0.216 25149
2203 1 6 . 1 1 52 52 ALA CA C 52 52.865 52.865 53.568 -0.703 25149
2204 1 6 . 1 1 52 52 ALA CB C 52 18.951 18.951 19.181 -0.230 25149
2205 1 6 . 1 1 52 52 ALA H H 52 7.191 7.191 7.980 -0.789 25149
2206 1 6 . 1 1 53 53 GLN N N 53 117.047 117.047 116.140 0.907 25149
2207 1 6 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.462 -0.529 25149
2208 1 6 . 1 1 53 53 GLN C C 53 175.998 175.998 174.428 1.570 25149
2209 1 6 . 1 1 53 53 GLN CA C 53 55.482 55.482 54.962 0.520 25149
2210 1 6 . 1 1 53 53 GLN CB C 53 28.887 28.887 30.194 -1.307 25149
2211 1 6 . 1 1 53 53 GLN H H 53 7.317 7.317 7.954 -0.637 25149
2212 1 6 . 1 1 54 54 GLN N N 54 118.463 118.463 117.122 1.341 25149
2213 1 6 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.425 -0.436 25149
2214 1 6 . 1 1 54 54 GLN C C 54 176.300 176.300 175.192 1.108 25149
2215 1 6 . 1 1 54 54 GLN CA C 54 57.314 57.314 55.945 1.369 25149
2216 1 6 . 1 1 54 54 GLN CB C 54 28.823 28.823 29.418 -0.595 25149
2217 1 6 . 1 1 54 54 GLN H H 54 7.949 7.949 8.333 -0.384 25149
2218 1 6 . 1 1 55 55 VAL N N 55 116.755 116.755 116.533 0.222 25149
2219 1 6 . 1 1 55 55 VAL HA H 55 3.884 3.884 4.264 -0.380 25149
2220 1 6 . 1 1 55 55 VAL C C 55 175.774 175.774 175.910 -0.136 25149
2221 1 6 . 1 1 55 55 VAL CA C 55 63.210 63.210 62.895 0.315 25149
2222 1 6 . 1 1 55 55 VAL CB C 55 32.870 32.870 31.768 1.102 25149
2223 1 6 . 1 1 55 55 VAL H H 55 7.801 7.801 7.933 -0.132 25149
2224 1 6 . 1 1 56 56 GLN N N 56 120.192 120.192 120.850 -0.658 25149
2225 1 6 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.806 -0.689 25149
2226 1 6 . 1 1 56 56 GLN C C 56 175.236 175.236 175.730 -0.494 25149
2227 1 6 . 1 1 56 56 GLN CA C 56 55.697 55.697 54.986 0.711 25149
2228 1 6 . 1 1 56 56 GLN CB C 56 29.319 29.319 27.942 1.377 25149
2229 1 6 . 1 1 56 56 GLN H H 56 8.018 8.018 8.272 -0.254 25149
2230 1 6 . 1 1 57 57 GLN N N 57 121.276 121.276 120.007 1.269 25149
2231 1 6 . 1 1 57 57 GLN HA H 57 4.204 4.204 4.144 0.060 25149
2232 1 6 . 1 1 57 57 GLN C C 57 175.819 175.819 175.498 0.321 25149
2233 1 6 . 1 1 57 57 GLN CA C 57 55.617 55.617 55.992 -0.375 25149
2234 1 6 . 1 1 57 57 GLN CB C 57 29.094 29.094 29.442 -0.348 25149
2235 1 6 . 1 1 57 57 GLN H H 57 8.471 8.471 8.607 -0.136 25149
2236 1 6 . 1 1 58 58 HIS N N 58 120.001 120.001 120.354 -0.353 25149
2237 1 6 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.395 0.779 25149
2238 1 6 . 1 1 58 58 HIS C C 58 173.636 173.636 175.610 -1.974 25149
2239 1 6 . 1 1 58 58 HIS CA C 58 54.353 54.353 56.889 -2.536 25149
2240 1 6 . 1 1 58 58 HIS CB C 58 33.057 33.057 29.358 3.699 25149
2241 1 6 . 1 1 58 58 HIS H H 58 8.366 8.366 7.806 0.560 25149
2242 1 6 . 1 1 59 59 CYS N N 59 121.924 121.924 123.844 -1.920 25149
2243 1 6 . 1 1 59 59 CYS HA H 59 4.442 4.442 3.986 0.456 25149
2244 1 6 . 1 1 59 59 CYS C C 59 176.334 176.334 174.703 1.631 25149
2245 1 6 . 1 1 59 59 CYS CA C 59 56.772 56.772 59.583 -2.811 25149
2246 1 6 . 1 1 59 59 CYS CB C 59 32.642 32.642 29.498 3.144 25149
2247 1 6 . 1 1 59 59 CYS H H 59 9.035 9.035 8.404 0.631 25149
2248 1 6 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.119 -0.306 25149
2249 1 6 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.761 -0.100 25149
2250 1 6 . 1 1 60 60 PRO CB C 60 30.659 30.659 31.224 -0.565 25149
2251 1 6 . 1 1 61 61 MET N N 61 117.676 117.676 117.412 0.264 25149
2252 1 6 . 1 1 61 61 MET HA H 61 4.317 4.317 4.195 0.122 25149
2253 1 6 . 1 1 61 61 MET C C 61 177.117 177.117 177.459 -0.342 25149
2254 1 6 . 1 1 61 61 MET CA C 61 56.408 56.408 56.320 0.088 25149
2255 1 6 . 1 1 61 61 MET CB C 61 32.551 32.551 31.888 0.663 25149
2256 1 6 . 1 1 61 61 MET H H 61 9.135 9.135 7.430 1.705 25149
2257 1 6 . 1 1 62 62 CYS N N 62 117.214 117.214 117.329 -0.115 25149
2258 1 6 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.467 0.407 25149
2259 1 6 . 1 1 62 62 CYS C C 62 175.740 175.740 175.033 0.707 25149
2260 1 6 . 1 1 62 62 CYS CA C 62 58.273 58.273 58.689 -0.416 25149
2261 1 6 . 1 1 62 62 CYS CB C 62 32.776 32.776 29.472 3.304 25149
2262 1 6 . 1 1 62 62 CYS H H 62 8.011 8.011 7.614 0.397 25149
2263 1 6 . 1 1 63 63 ARG N N 63 116.555 116.555 118.648 -2.093 25149
2264 1 6 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.408 -0.483 25149
2265 1 6 . 1 1 63 63 ARG C C 63 175.326 175.326 175.351 -0.025 25149
2266 1 6 . 1 1 63 63 ARG CA C 63 58.073 58.073 55.893 2.180 25149
2267 1 6 . 1 1 63 63 ARG CB C 63 27.136 27.136 30.187 -3.051 25149
2268 1 6 . 1 1 63 63 ARG H H 63 8.086 8.086 8.344 -0.258 25149
2269 1 6 . 1 1 64 64 GLN N N 64 118.932 118.932 118.736 0.196 25149
2270 1 6 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.487 -0.228 25149
2271 1 6 . 1 1 64 64 GLN C C 64 176.054 176.054 176.093 -0.039 25149
2272 1 6 . 1 1 64 64 GLN CA C 64 56.316 56.316 54.898 1.418 25149
2273 1 6 . 1 1 64 64 GLN CB C 64 30.083 30.083 29.095 0.988 25149
2274 1 6 . 1 1 64 64 GLN H H 64 8.003 8.003 7.700 0.303 25149
2275 1 6 . 1 1 65 65 GLU N N 65 122.038 122.038 123.635 -1.597 25149
2276 1 6 . 1 1 65 65 GLU HA H 65 4.003 4.003 4.084 -0.081 25149
2277 1 6 . 1 1 65 65 GLU C C 65 176.781 176.781 175.750 1.031 25149
2278 1 6 . 1 1 65 65 GLU CA C 65 57.682 57.682 56.368 1.314 25149
2279 1 6 . 1 1 65 65 GLU CB C 65 29.900 29.900 28.948 0.952 25149
2280 1 6 . 1 1 65 65 GLU H H 65 8.657 8.657 8.621 0.036 25149
2281 1 6 . 1 1 66 66 TRP N N 66 125.730 125.730 127.826 -2.096 25149
2282 1 6 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.291 0.113 25149
2283 1 6 . 1 1 66 66 TRP C C 66 175.460 175.460 174.954 0.506 25149
2284 1 6 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.669 -0.044 25149
2285 1 6 . 1 1 66 66 TRP CB C 66 29.358 29.358 30.026 -0.668 25149
2286 1 6 . 1 1 66 66 TRP H H 66 8.499 8.499 8.379 0.120 25149
2287 1 6 . 1 1 67 67 LYS N N 67 127.396 127.396 127.213 0.183 25149
2288 1 6 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.014 0.004 25149
2289 1 6 . 1 1 67 67 LYS C C 67 175.180 175.180 175.099 0.081 25149
2290 1 6 . 1 1 67 67 LYS CA C 67 54.514 54.514 53.524 0.990 25149
2291 1 6 . 1 1 67 67 LYS CB C 67 36.231 36.231 34.370 1.861 25149
2292 1 6 . 1 1 67 67 LYS H H 67 6.930 6.930 8.256 -1.326 25149
2293 1 6 . 1 1 68 68 PHE N N 68 121.511 121.511 126.642 -5.131 25149
2294 1 6 . 1 1 68 68 PHE HA H 68 4.108 4.108 4.000 0.108 25149
2295 1 6 . 1 1 68 68 PHE C C 68 176.613 176.613 175.637 0.976 25149
2296 1 6 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.423 2.538 25149
2297 1 6 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.972 1.290 25149
2298 1 6 . 1 1 68 68 PHE H H 68 8.430 8.430 8.504 -0.074 25149
2299 1 6 . 1 1 69 69 LYS N N 69 124.210 124.210 123.462 0.748 25149
2300 1 6 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.129 -0.134 25149
2301 1 6 . 1 1 69 69 LYS C C 69 175.651 175.651 176.228 -0.577 25149
2302 1 6 . 1 1 69 69 LYS CA C 69 57.320 57.320 57.270 0.050 25149
2303 1 6 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.157 0.204 25149
2304 1 6 . 1 1 69 69 LYS H H 69 8.738 8.738 8.110 0.628 25149
2305 1 7 . 1 1 2 2 SER HA H 2 4.417 4.417 5.213 -0.796 25149
2306 1 7 . 1 1 2 2 SER CA C 2 58.322 58.322 57.625 0.697 25149
2307 1 7 . 1 1 2 2 SER CB C 2 64.169 64.169 65.824 -1.655 25149
2308 1 7 . 1 1 3 3 VAL N N 3 121.214 121.214 120.865 0.349 25149
2309 1 7 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.420 -0.374 25149
2310 1 7 . 1 1 3 3 VAL C C 3 175.879 175.879 174.882 0.997 25149
2311 1 7 . 1 1 3 3 VAL CA C 3 62.138 62.138 61.410 0.729 25149
2312 1 7 . 1 1 3 3 VAL CB C 3 32.958 32.958 33.885 -0.926 25149
2313 1 7 . 1 1 3 3 VAL H H 3 8.170 8.170 8.286 -0.116 25149
2314 1 7 . 1 1 4 4 ALA N N 4 127.312 127.312 127.446 -0.134 25149
2315 1 7 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.666 -0.469 25149
2316 1 7 . 1 1 4 4 ALA C C 4 177.497 177.497 176.446 1.051 25149
2317 1 7 . 1 1 4 4 ALA CA C 4 52.439 52.439 51.651 0.788 25149
2318 1 7 . 1 1 4 4 ALA CB C 4 19.424 19.424 18.893 0.531 25149
2319 1 7 . 1 1 4 4 ALA H H 4 8.294 8.294 8.419 -0.125 25149
2320 1 7 . 1 1 5 5 ASN N N 5 117.674 117.674 122.877 -5.203 25149
2321 1 7 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.792 -0.227 25149
2322 1 7 . 1 1 5 5 ASN C C 5 175.048 175.048 174.414 0.634 25149
2323 1 7 . 1 1 5 5 ASN CA C 5 53.725 53.725 53.281 0.444 25149
2324 1 7 . 1 1 5 5 ASN CB C 5 39.197 39.197 39.334 -0.138 25149
2325 1 7 . 1 1 5 5 ASN H H 5 8.252 8.252 8.629 -0.377 25149
2326 1 7 . 1 1 6 6 ASP N N 6 119.896 119.896 122.478 -2.582 25149
2327 1 7 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.763 -0.243 25149
2328 1 7 . 1 1 6 6 ASP C C 6 176.269 176.269 176.359 -0.090 25149
2329 1 7 . 1 1 6 6 ASP CA C 6 54.497 54.497 53.114 1.383 25149
2330 1 7 . 1 1 6 6 ASP CB C 6 41.104 41.104 41.526 -0.423 25149
2331 1 7 . 1 1 6 6 ASP H H 6 8.215 8.215 8.672 -0.457 25149
2332 1 7 . 1 1 7 7 GLU N N 7 119.101 119.101 116.930 2.171 25149
2333 1 7 . 1 1 7 7 GLU HA H 7 4.243 4.243 4.345 -0.102 25149
2334 1 7 . 1 1 7 7 GLU C C 7 175.006 175.006 174.810 0.196 25149
2335 1 7 . 1 1 7 7 GLU CA C 7 56.689 56.689 56.889 -0.200 25149
2336 1 7 . 1 1 7 7 GLU CB C 7 30.379 30.379 29.077 1.302 25149
2337 1 7 . 1 1 7 7 GLU H H 7 8.065 8.065 8.301 -0.236 25149
2338 1 7 . 1 1 8 8 ASN N N 8 116.852 116.852 115.852 1.000 25149
2339 1 7 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.114 0.044 25149
2340 1 7 . 1 1 8 8 ASN C C 8 172.706 172.706 175.049 -2.343 25149
2341 1 7 . 1 1 8 8 ASN CA C 8 51.165 51.165 51.213 -0.048 25149
2342 1 7 . 1 1 8 8 ASN CB C 8 40.702 40.702 39.938 0.764 25149
2343 1 7 . 1 1 8 8 ASN H H 8 7.505 7.505 7.442 0.063 25149
2344 1 7 . 1 1 9 9 CYS N N 9 122.855 122.855 120.586 2.269 25149
2345 1 7 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.806 -0.012 25149
2346 1 7 . 1 1 9 9 CYS C C 9 178.370 178.370 176.410 1.960 25149
2347 1 7 . 1 1 9 9 CYS CA C 9 59.552 59.552 60.453 -0.901 25149
2348 1 7 . 1 1 9 9 CYS CB C 9 31.526 31.526 28.970 2.556 25149
2349 1 7 . 1 1 9 9 CYS H H 9 7.614 7.614 7.613 0.001 25149
2350 1 7 . 1 1 10 10 GLY N N 10 117.295 117.295 111.495 5.800 25149
2351 1 7 . 1 1 10 10 GLY C C 10 174.111 174.111 174.867 -0.756 25149
2352 1 7 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.782 1.185 25149
2353 1 7 . 1 1 10 10 GLY H H 10 9.235 9.235 7.864 1.371 25149
2354 1 7 . 1 1 11 11 ILE N N 11 119.811 119.811 122.040 -2.229 25149
2355 1 7 . 1 1 11 11 ILE HA H 11 3.809 3.809 4.194 -0.385 25149
2356 1 7 . 1 1 11 11 ILE C C 11 176.121 176.121 176.821 -0.700 25149
2357 1 7 . 1 1 11 11 ILE CA C 11 64.041 64.041 63.183 0.858 25149
2358 1 7 . 1 1 11 11 ILE CB C 11 39.411 39.411 38.894 0.517 25149
2359 1 7 . 1 1 11 11 ILE H H 11 8.285 8.285 7.644 0.641 25149
2360 1 7 . 1 1 12 12 CYS N N 12 116.728 116.728 116.625 0.103 25149
2361 1 7 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.736 -0.160 25149
2362 1 7 . 1 1 12 12 CYS C C 12 175.975 175.975 174.174 1.801 25149
2363 1 7 . 1 1 12 12 CYS CA C 12 59.225 59.225 57.310 1.915 25149
2364 1 7 . 1 1 12 12 CYS CB C 12 32.246 32.246 29.529 2.717 25149
2365 1 7 . 1 1 12 12 CYS H H 12 7.607 7.607 7.879 -0.272 25149
2366 1 7 . 1 1 13 13 ARG N N 13 116.073 116.073 118.102 -2.029 25149
2367 1 7 . 1 1 13 13 ARG HA H 13 3.742 3.742 4.029 -0.287 25149
2368 1 7 . 1 1 13 13 ARG C C 13 174.979 174.979 174.196 0.783 25149
2369 1 7 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.905 0.731 25149
2370 1 7 . 1 1 13 13 ARG CB C 13 26.326 26.326 26.978 -0.652 25149
2371 1 7 . 1 1 13 13 ARG H H 13 7.987 7.987 8.248 -0.261 25149
2372 1 7 . 1 1 14 14 MET N N 14 119.313 119.313 119.083 0.230 25149
2373 1 7 . 1 1 14 14 MET HA H 14 4.547 4.547 4.478 0.069 25149
2374 1 7 . 1 1 14 14 MET C C 14 176.143 176.143 175.431 0.712 25149
2375 1 7 . 1 1 14 14 MET CA C 14 54.208 54.208 54.505 -0.297 25149
2376 1 7 . 1 1 14 14 MET CB C 14 33.951 33.951 34.319 -0.368 25149
2377 1 7 . 1 1 14 14 MET H H 14 8.624 8.624 7.620 1.004 25149
2378 1 7 . 1 1 15 15 ALA N N 15 122.683 122.683 129.544 -6.861 25149
2379 1 7 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.055 0.217 25149
2380 1 7 . 1 1 15 15 ALA C C 15 180.117 180.117 178.298 1.819 25149
2381 1 7 . 1 1 15 15 ALA CA C 15 52.346 52.346 52.002 0.344 25149
2382 1 7 . 1 1 15 15 ALA CB C 15 19.487 19.487 19.407 0.080 25149
2383 1 7 . 1 1 15 15 ALA H H 15 7.965 7.965 8.409 -0.444 25149
2384 1 7 . 1 1 16 16 PHE N N 16 119.313 119.313 120.770 -1.457 25149
2385 1 7 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.203 -0.162 25149
2386 1 7 . 1 1 16 16 PHE C C 16 176.423 176.423 175.799 0.624 25149
2387 1 7 . 1 1 16 16 PHE CA C 16 59.130 59.130 58.014 1.116 25149
2388 1 7 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.521 -0.131 25149
2389 1 7 . 1 1 16 16 PHE H H 16 8.095 8.095 8.265 -0.170 25149
2390 1 7 . 1 1 17 17 ASN N N 17 112.313 112.313 117.407 -5.094 25149
2391 1 7 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.801 -0.165 25149
2392 1 7 . 1 1 17 17 ASN C C 17 175.337 175.337 174.882 0.455 25149
2393 1 7 . 1 1 17 17 ASN CA C 17 52.961 52.961 53.075 -0.114 25149
2394 1 7 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.283 -1.109 25149
2395 1 7 . 1 1 17 17 ASN H H 17 7.823 7.823 8.138 -0.315 25149
2396 1 7 . 1 1 18 18 GLY N N 18 107.742 107.742 107.765 -0.023 25149
2397 1 7 . 1 1 18 18 GLY C C 18 173.759 173.759 172.648 1.111 25149
2398 1 7 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.687 -0.223 25149
2399 1 7 . 1 1 18 18 GLY H H 18 7.579 7.579 7.846 -0.267 25149
2400 1 7 . 1 1 19 19 CYS N N 19 117.050 117.050 117.721 -0.671 25149
2401 1 7 . 1 1 19 19 CYS HA H 19 4.571 4.571 4.765 -0.194 25149
2402 1 7 . 1 1 19 19 CYS C C 19 174.039 174.039 175.426 -1.387 25149
2403 1 7 . 1 1 19 19 CYS CA C 19 58.433 58.433 56.743 1.690 25149
2404 1 7 . 1 1 19 19 CYS CB C 19 30.681 30.681 29.502 1.179 25149
2405 1 7 . 1 1 19 19 CYS H H 19 8.198 8.198 8.106 0.092 25149
2406 1 7 . 1 1 20 20 CYS N N 20 123.923 123.923 122.458 1.465 25149
2407 1 7 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.283 -0.272 25149
2408 1 7 . 1 1 20 20 CYS C C 20 173.736 173.736 174.819 -1.083 25149
2409 1 7 . 1 1 20 20 CYS CA C 20 57.999 57.999 59.104 -1.105 25149
2410 1 7 . 1 1 20 20 CYS CB C 20 28.205 28.205 26.491 1.714 25149
2411 1 7 . 1 1 20 20 CYS H H 20 8.466 8.466 8.706 -0.240 25149
2412 1 7 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.319 -0.290 25149
2413 1 7 . 1 1 21 21 PRO CA C 21 65.426 65.426 64.271 1.155 25149
2414 1 7 . 1 1 21 21 PRO CB C 21 32.801 32.801 31.913 0.888 25149
2415 1 7 . 1 1 22 22 ASP N N 22 117.053 117.053 118.387 -1.334 25149
2416 1 7 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.342 0.163 25149
2417 1 7 . 1 1 22 22 ASP C C 22 176.501 176.501 176.392 0.109 25149
2418 1 7 . 1 1 22 22 ASP CA C 22 55.017 55.017 55.187 -0.170 25149
2419 1 7 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.222 2.300 25149
2420 1 7 . 1 1 22 22 ASP H H 22 8.395 8.395 8.390 0.005 25149
2421 1 7 . 1 1 23 23 CYS N N 23 123.353 123.353 117.913 5.440 25149
2422 1 7 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.184 0.108 25149
2423 1 7 . 1 1 23 23 CYS C C 23 175.214 175.214 175.360 -0.146 25149
2424 1 7 . 1 1 23 23 CYS CA C 23 61.633 61.633 60.344 1.289 25149
2425 1 7 . 1 1 23 23 CYS CB C 23 31.542 31.542 29.045 2.497 25149
2426 1 7 . 1 1 23 23 CYS H H 23 7.246 7.246 7.933 -0.687 25149
2427 1 7 . 1 1 24 24 LYS N N 24 117.539 117.539 124.577 -7.038 25149
2428 1 7 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.096 0.134 25149
2429 1 7 . 1 1 24 24 LYS C C 24 177.106 177.106 175.900 1.206 25149
2430 1 7 . 1 1 24 24 LYS CA C 24 56.921 56.921 56.319 0.602 25149
2431 1 7 . 1 1 24 24 LYS CB C 24 34.615 34.615 31.640 2.975 25149
2432 1 7 . 1 1 24 24 LYS H H 24 8.173 8.173 8.328 -0.155 25149
2433 1 7 . 1 1 25 25 VAL N N 25 120.661 120.661 119.841 0.820 25149
2434 1 7 . 1 1 25 25 VAL HA H 25 4.429 4.429 3.776 0.653 25149
2435 1 7 . 1 1 25 25 VAL C C 25 174.027 174.027 175.423 -1.396 25149
2436 1 7 . 1 1 25 25 VAL CA C 25 59.934 59.934 62.691 -2.757 25149
2437 1 7 . 1 1 25 25 VAL CB C 25 33.507 33.507 30.419 3.088 25149
2438 1 7 . 1 1 25 25 VAL H H 25 7.787 7.787 7.419 0.368 25149
2439 1 7 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.359 -0.023 25149
2440 1 7 . 1 1 26 26 PRO CA C 26 63.279 63.279 63.494 -0.215 25149
2441 1 7 . 1 1 26 26 PRO CB C 26 32.077 32.077 32.377 -0.300 25149
2442 1 7 . 1 1 27 27 GLY N N 27 109.926 109.926 108.396 1.530 25149
2443 1 7 . 1 1 27 27 GLY C C 27 175.169 175.169 172.870 2.299 25149
2444 1 7 . 1 1 27 27 GLY CA C 27 45.042 45.042 45.083 -0.041 25149
2445 1 7 . 1 1 27 27 GLY H H 27 8.569 8.569 7.606 0.963 25149
2446 1 7 . 1 1 28 28 ASP N N 28 122.592 122.592 119.179 3.413 25149
2447 1 7 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.716 -0.485 25149
2448 1 7 . 1 1 28 28 ASP C C 28 176.602 176.602 175.607 0.995 25149
2449 1 7 . 1 1 28 28 ASP CA C 28 56.402 56.402 54.521 1.881 25149
2450 1 7 . 1 1 28 28 ASP CB C 28 40.912 40.912 41.809 -0.897 25149
2451 1 7 . 1 1 28 28 ASP H H 28 8.214 8.214 8.307 -0.093 25149
2452 1 7 . 1 1 29 29 ASP N N 29 117.500 117.500 121.584 -4.084 25149
2453 1 7 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.823 -0.376 25149
2454 1 7 . 1 1 29 29 ASP C C 29 175.505 175.505 175.586 -0.081 25149
2455 1 7 . 1 1 29 29 ASP CA C 29 55.266 55.266 53.690 1.576 25149
2456 1 7 . 1 1 29 29 ASP CB C 29 41.225 41.225 40.326 0.899 25149
2457 1 7 . 1 1 29 29 ASP H H 29 8.271 8.271 8.313 -0.042 25149
2458 1 7 . 1 1 30 30 CYS N N 30 124.470 124.470 122.805 1.665 25149
2459 1 7 . 1 1 30 30 CYS HA H 30 4.390 4.390 4.983 -0.593 25149
2460 1 7 . 1 1 30 30 CYS C C 30 171.755 171.755 173.230 -1.475 25149
2461 1 7 . 1 1 30 30 CYS CA C 30 57.676 57.676 55.619 2.057 25149
2462 1 7 . 1 1 30 30 CYS CB C 30 29.154 29.154 27.684 1.470 25149
2463 1 7 . 1 1 30 30 CYS H H 30 7.912 7.912 8.494 -0.582 25149
2464 1 7 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.559 0.128 25149
2465 1 7 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.836 0.039 25149
2466 1 7 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.356 1.628 25149
2467 1 7 . 1 1 32 32 LEU N N 32 120.023 120.023 115.675 4.348 25149
2468 1 7 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.595 0.121 25149
2469 1 7 . 1 1 32 32 LEU C C 32 176.300 176.300 175.068 1.232 25149
2470 1 7 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.214 0.707 25149
2471 1 7 . 1 1 32 32 LEU CB C 32 43.336 43.336 43.590 -0.254 25149
2472 1 7 . 1 1 32 32 LEU H H 32 8.580 8.580 7.866 0.714 25149
2473 1 7 . 1 1 33 33 VAL N N 33 116.217 116.217 118.531 -2.314 25149
2474 1 7 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.508 0.155 25149
2475 1 7 . 1 1 33 33 VAL C C 33 171.374 171.374 173.893 -2.519 25149
2476 1 7 . 1 1 33 33 VAL CA C 33 60.449 60.449 59.752 0.697 25149
2477 1 7 . 1 1 33 33 VAL CB C 33 36.448 36.448 35.386 1.062 25149
2478 1 7 . 1 1 33 33 VAL H H 33 8.594 8.594 8.073 0.521 25149
2479 1 7 . 1 1 34 34 TRP N N 34 122.711 122.711 125.549 -2.838 25149
2480 1 7 . 1 1 34 34 TRP HA H 34 5.339 5.339 5.105 0.234 25149
2481 1 7 . 1 1 34 34 TRP C C 34 176.770 176.770 175.576 1.194 25149
2482 1 7 . 1 1 34 34 TRP CA C 34 57.267 57.267 56.011 1.256 25149
2483 1 7 . 1 1 34 34 TRP CB C 34 33.780 33.780 33.538 0.242 25149
2484 1 7 . 1 1 34 34 TRP H H 34 8.756 8.756 8.706 0.050 25149
2485 1 7 . 1 1 35 35 GLY N N 35 107.569 107.569 107.008 0.561 25149
2486 1 7 . 1 1 35 35 GLY C C 35 177.397 177.397 173.800 3.597 25149
2487 1 7 . 1 1 35 35 GLY CA C 35 44.070 44.070 44.135 -0.065 25149
2488 1 7 . 1 1 35 35 GLY H H 35 8.857 8.857 8.440 0.417 25149
2489 1 7 . 1 1 36 36 GLN N N 36 122.723 122.723 118.363 4.360 25149
2490 1 7 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.037 -0.291 25149
2491 1 7 . 1 1 36 36 GLN C C 36 176.445 176.445 176.132 0.313 25149
2492 1 7 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.148 0.281 25149
2493 1 7 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.617 -0.986 25149
2494 1 7 . 1 1 36 36 GLN H H 36 8.338 8.338 8.560 -0.222 25149
2495 1 7 . 1 1 37 37 CYS N N 37 115.763 115.763 113.765 1.998 25149
2496 1 7 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.937 -0.653 25149
2497 1 7 . 1 1 37 37 CYS C C 37 175.281 175.281 175.802 -0.521 25149
2498 1 7 . 1 1 37 37 CYS CA C 37 58.395 58.395 55.643 2.752 25149
2499 1 7 . 1 1 37 37 CYS CB C 37 31.143 31.143 31.427 -0.284 25149
2500 1 7 . 1 1 37 37 CYS H H 37 7.622 7.622 7.609 0.013 25149
2501 1 7 . 1 1 38 38 SER N N 38 114.540 114.540 115.068 -0.528 25149
2502 1 7 . 1 1 38 38 SER HA H 38 4.004 4.004 4.161 -0.157 25149
2503 1 7 . 1 1 38 38 SER C C 38 173.389 173.389 174.197 -0.808 25149
2504 1 7 . 1 1 38 38 SER CA C 38 62.285 62.285 59.925 2.360 25149
2505 1 7 . 1 1 38 38 SER H H 38 7.716 7.716 8.512 -0.796 25149
2506 1 7 . 1 1 39 39 HIS N N 39 121.947 121.947 121.524 0.423 25149
2507 1 7 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.422 0.022 25149
2508 1 7 . 1 1 39 39 HIS C C 39 172.326 172.326 173.842 -1.516 25149
2509 1 7 . 1 1 39 39 HIS CA C 39 61.320 61.320 56.855 4.465 25149
2510 1 7 . 1 1 39 39 HIS CB C 39 31.523 31.523 29.620 1.903 25149
2511 1 7 . 1 1 39 39 HIS H H 39 7.829 7.829 7.660 0.169 25149
2512 1 7 . 1 1 40 40 CYS N N 40 121.859 121.859 124.009 -2.150 25149
2513 1 7 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.360 0.249 25149
2514 1 7 . 1 1 40 40 CYS C C 40 171.900 171.900 172.483 -0.583 25149
2515 1 7 . 1 1 40 40 CYS CA C 40 55.791 55.791 56.237 -0.446 25149
2516 1 7 . 1 1 40 40 CYS CB C 40 28.964 28.964 27.986 0.978 25149
2517 1 7 . 1 1 40 40 CYS H H 40 8.049 8.049 8.642 -0.593 25149
2518 1 7 . 1 1 41 41 PHE N N 41 120.690 120.690 121.812 -1.122 25149
2519 1 7 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.607 0.570 25149
2520 1 7 . 1 1 41 41 PHE C C 41 176.613 176.613 174.785 1.828 25149
2521 1 7 . 1 1 41 41 PHE CA C 41 56.033 56.033 56.235 -0.202 25149
2522 1 7 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.574 2.186 25149
2523 1 7 . 1 1 41 41 PHE H H 41 8.368 8.368 8.462 -0.094 25149
2524 1 7 . 1 1 42 42 HIS N N 42 117.057 117.057 122.965 -5.908 25149
2525 1 7 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.335 0.334 25149
2526 1 7 . 1 1 42 42 HIS C C 42 177.464 177.464 176.489 0.975 25149
2527 1 7 . 1 1 42 42 HIS CA C 42 60.425 60.425 57.728 2.697 25149
2528 1 7 . 1 1 42 42 HIS CB C 42 29.740 29.740 29.511 0.229 25149
2529 1 7 . 1 1 42 42 HIS H H 42 8.384 8.384 8.907 -0.523 25149
2530 1 7 . 1 1 43 43 MET N N 43 128.543 128.543 125.947 2.596 25149
2531 1 7 . 1 1 43 43 MET HA H 43 3.965 3.965 4.006 -0.041 25149
2532 1 7 . 1 1 43 43 MET C C 43 177.845 177.845 177.530 0.315 25149
2533 1 7 . 1 1 43 43 MET CA C 43 59.209 59.209 60.606 -1.397 25149
2534 1 7 . 1 1 43 43 MET CB C 43 33.009 33.009 32.737 0.272 25149
2535 1 7 . 1 1 43 43 MET H H 43 9.439 9.439 8.504 0.935 25149
2536 1 7 . 1 1 44 44 HIS N N 44 116.500 116.500 117.195 -0.695 25149
2537 1 7 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.203 0.053 25149
2538 1 7 . 1 1 44 44 HIS C C 44 178.405 178.405 177.739 0.666 25149
2539 1 7 . 1 1 44 44 HIS CA C 44 58.793 58.793 59.102 -0.309 25149
2540 1 7 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.147 3.600 25149
2541 1 7 . 1 1 44 44 HIS H H 44 9.747 9.747 7.916 1.831 25149
2542 1 7 . 1 1 45 45 CYS N N 45 115.950 115.950 117.378 -1.428 25149
2543 1 7 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.153 -0.153 25149
2544 1 7 . 1 1 45 45 CYS C C 45 177.957 177.957 176.818 1.139 25149
2545 1 7 . 1 1 45 45 CYS CA C 45 62.923 62.923 63.402 -0.479 25149
2546 1 7 . 1 1 45 45 CYS CB C 45 29.102 29.102 26.403 2.699 25149
2547 1 7 . 1 1 45 45 CYS H H 45 6.845 6.845 8.302 -1.457 25149
2548 1 7 . 1 1 46 46 ILE N N 46 119.362 119.362 121.648 -2.286 25149
2549 1 7 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.721 -0.056 25149
2550 1 7 . 1 1 46 46 ILE C C 46 176.613 176.613 177.543 -0.930 25149
2551 1 7 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.460 -4.218 25149
2552 1 7 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.692 -0.373 25149
2553 1 7 . 1 1 46 46 ILE H H 46 7.816 7.816 8.052 -0.236 25149
2554 1 7 . 1 1 47 47 LEU N N 47 122.180 122.180 120.401 1.779 25149
2555 1 7 . 1 1 47 47 LEU HA H 47 3.873 3.873 4.190 -0.317 25149
2556 1 7 . 1 1 47 47 LEU C C 47 179.726 179.726 178.975 0.751 25149
2557 1 7 . 1 1 47 47 LEU CA C 47 58.633 58.633 59.081 -0.448 25149
2558 1 7 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.924 -0.801 25149
2559 1 7 . 1 1 47 47 LEU H H 47 8.266 8.266 8.655 -0.389 25149
2560 1 7 . 1 1 48 48 LYS N N 48 118.251 118.251 118.363 -0.112 25149
2561 1 7 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.281 -0.417 25149
2562 1 7 . 1 1 48 48 LYS C C 48 179.423 179.423 178.604 0.819 25149
2563 1 7 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.697 0.290 25149
2564 1 7 . 1 1 48 48 LYS CB C 48 32.765 32.765 32.042 0.723 25149
2565 1 7 . 1 1 48 48 LYS H H 48 7.147 7.147 8.438 -1.291 25149
2566 1 7 . 1 1 49 49 TRP N N 49 120.745 120.745 120.893 -0.148 25149
2567 1 7 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.386 -0.306 25149
2568 1 7 . 1 1 49 49 TRP C C 49 178.147 178.147 177.704 0.443 25149
2569 1 7 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.464 0.081 25149
2570 1 7 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.235 0.180 25149
2571 1 7 . 1 1 49 49 TRP H H 49 7.709 7.709 7.683 0.026 25149
2572 1 7 . 1 1 50 50 LEU N N 50 117.236 117.236 117.133 0.103 25149
2573 1 7 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.619 -0.014 25149
2574 1 7 . 1 1 50 50 LEU C C 50 179.658 179.658 176.753 2.905 25149
2575 1 7 . 1 1 50 50 LEU CA C 50 57.330 57.330 55.055 2.275 25149
2576 1 7 . 1 1 50 50 LEU CB C 50 41.416 41.416 42.101 -0.685 25149
2577 1 7 . 1 1 50 50 LEU H H 50 8.512 8.512 7.864 0.648 25149
2578 1 7 . 1 1 51 51 HIS N N 51 115.650 115.650 117.614 -1.964 25149
2579 1 7 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.479 -0.205 25149
2580 1 7 . 1 1 51 51 HIS C C 51 175.942 175.942 176.180 -0.238 25149
2581 1 7 . 1 1 51 51 HIS CA C 51 57.320 57.320 57.557 -0.237 25149
2582 1 7 . 1 1 51 51 HIS CB C 51 29.487 29.487 30.486 -0.999 25149
2583 1 7 . 1 1 51 51 HIS H H 51 7.713 7.713 8.310 -0.597 25149
2584 1 7 . 1 1 52 52 ALA N N 52 119.779 119.779 122.113 -2.334 25149
2585 1 7 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.184 -0.161 25149
2586 1 7 . 1 1 52 52 ALA C C 52 177.834 177.834 177.484 0.350 25149
2587 1 7 . 1 1 52 52 ALA CA C 52 52.865 52.865 53.696 -0.831 25149
2588 1 7 . 1 1 52 52 ALA CB C 52 18.951 18.951 19.170 -0.219 25149
2589 1 7 . 1 1 52 52 ALA H H 52 7.191 7.191 7.842 -0.651 25149
2590 1 7 . 1 1 53 53 GLN N N 53 117.047 117.047 117.423 -0.376 25149
2591 1 7 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.457 -0.524 25149
2592 1 7 . 1 1 53 53 GLN C C 53 175.998 175.998 175.384 0.614 25149
2593 1 7 . 1 1 53 53 GLN CA C 53 55.482 55.482 55.050 0.432 25149
2594 1 7 . 1 1 53 53 GLN CB C 53 28.887 28.887 30.628 -1.741 25149
2595 1 7 . 1 1 53 53 GLN H H 53 7.317 7.317 8.169 -0.852 25149
2596 1 7 . 1 1 54 54 GLN N N 54 118.463 118.463 119.461 -0.998 25149
2597 1 7 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.243 -0.254 25149
2598 1 7 . 1 1 54 54 GLN C C 54 176.300 176.300 175.913 0.387 25149
2599 1 7 . 1 1 54 54 GLN CA C 54 57.314 57.314 55.752 1.562 25149
2600 1 7 . 1 1 54 54 GLN CB C 54 28.823 28.823 28.714 0.109 25149
2601 1 7 . 1 1 54 54 GLN H H 54 7.949 7.949 8.455 -0.506 25149
2602 1 7 . 1 1 55 55 VAL N N 55 116.755 116.755 116.323 0.432 25149
2603 1 7 . 1 1 55 55 VAL HA H 55 3.884 3.884 3.933 -0.049 25149
2604 1 7 . 1 1 55 55 VAL C C 55 175.774 175.774 175.805 -0.031 25149
2605 1 7 . 1 1 55 55 VAL CA C 55 63.210 63.210 62.176 1.034 25149
2606 1 7 . 1 1 55 55 VAL CB C 55 32.870 32.870 31.805 1.065 25149
2607 1 7 . 1 1 55 55 VAL H H 55 7.801 7.801 7.366 0.435 25149
2608 1 7 . 1 1 56 56 GLN N N 56 120.192 120.192 120.628 -0.436 25149
2609 1 7 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.158 -0.041 25149
2610 1 7 . 1 1 56 56 GLN C C 56 175.236 175.236 176.263 -1.027 25149
2611 1 7 . 1 1 56 56 GLN CA C 56 55.697 55.697 57.056 -1.359 25149
2612 1 7 . 1 1 56 56 GLN CB C 56 29.319 29.319 28.594 0.725 25149
2613 1 7 . 1 1 56 56 GLN H H 56 8.018 8.018 8.354 -0.336 25149
2614 1 7 . 1 1 57 57 GLN N N 57 121.276 121.276 122.215 -0.939 25149
2615 1 7 . 1 1 57 57 GLN HA H 57 4.204 4.204 4.079 0.125 25149
2616 1 7 . 1 1 57 57 GLN C C 57 175.819 175.819 175.573 0.246 25149
2617 1 7 . 1 1 57 57 GLN CA C 57 55.617 55.617 56.307 -0.690 25149
2618 1 7 . 1 1 57 57 GLN CB C 57 29.094 29.094 28.351 0.743 25149
2619 1 7 . 1 1 57 57 GLN H H 57 8.471 8.471 8.651 -0.180 25149
2620 1 7 . 1 1 58 58 HIS N N 58 120.001 120.001 118.863 1.138 25149
2621 1 7 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.446 0.728 25149
2622 1 7 . 1 1 58 58 HIS C C 58 173.636 173.636 176.234 -2.598 25149
2623 1 7 . 1 1 58 58 HIS CA C 58 54.353 54.353 57.847 -3.494 25149
2624 1 7 . 1 1 58 58 HIS CB C 58 33.057 33.057 30.168 2.889 25149
2625 1 7 . 1 1 58 58 HIS H H 58 8.366 8.366 8.119 0.247 25149
2626 1 7 . 1 1 59 59 CYS N N 59 121.924 121.924 118.613 3.311 25149
2627 1 7 . 1 1 59 59 CYS HA H 59 4.442 4.442 4.435 0.007 25149
2628 1 7 . 1 1 59 59 CYS C C 59 176.334 176.334 175.199 1.135 25149
2629 1 7 . 1 1 59 59 CYS CA C 59 56.772 56.772 59.173 -2.401 25149
2630 1 7 . 1 1 59 59 CYS CB C 59 32.642 32.642 28.499 4.143 25149
2631 1 7 . 1 1 59 59 CYS H H 59 9.035 9.035 8.296 0.739 25149
2632 1 7 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.456 -0.643 25149
2633 1 7 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.723 -0.062 25149
2634 1 7 . 1 1 60 60 PRO CB C 60 30.659 30.659 30.977 -0.318 25149
2635 1 7 . 1 1 61 61 MET N N 61 117.676 117.676 114.884 2.792 25149
2636 1 7 . 1 1 61 61 MET HA H 61 4.317 4.317 4.575 -0.258 25149
2637 1 7 . 1 1 61 61 MET C C 61 177.117 177.117 175.864 1.253 25149
2638 1 7 . 1 1 61 61 MET CA C 61 56.408 56.408 55.621 0.787 25149
2639 1 7 . 1 1 61 61 MET CB C 61 32.551 32.551 32.505 0.046 25149
2640 1 7 . 1 1 61 61 MET H H 61 9.135 9.135 7.282 1.853 25149
2641 1 7 . 1 1 62 62 CYS N N 62 117.214 117.214 118.230 -1.016 25149
2642 1 7 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.380 0.494 25149
2643 1 7 . 1 1 62 62 CYS C C 62 175.740 175.740 175.504 0.236 25149
2644 1 7 . 1 1 62 62 CYS CA C 62 58.273 58.273 58.812 -0.539 25149
2645 1 7 . 1 1 62 62 CYS CB C 62 32.776 32.776 29.853 2.923 25149
2646 1 7 . 1 1 62 62 CYS H H 62 8.011 8.011 7.936 0.075 25149
2647 1 7 . 1 1 63 63 ARG N N 63 116.555 116.555 118.976 -2.421 25149
2648 1 7 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.375 -0.450 25149
2649 1 7 . 1 1 63 63 ARG C C 63 175.326 175.326 176.185 -0.859 25149
2650 1 7 . 1 1 63 63 ARG CA C 63 58.073 58.073 56.725 1.348 25149
2651 1 7 . 1 1 63 63 ARG CB C 63 27.136 27.136 30.347 -3.211 25149
2652 1 7 . 1 1 63 63 ARG H H 63 8.086 8.086 8.470 -0.384 25149
2653 1 7 . 1 1 64 64 GLN N N 64 118.932 118.932 119.703 -0.771 25149
2654 1 7 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.257 0.002 25149
2655 1 7 . 1 1 64 64 GLN C C 64 176.054 176.054 175.892 0.162 25149
2656 1 7 . 1 1 64 64 GLN CA C 64 56.316 56.316 55.784 0.532 25149
2657 1 7 . 1 1 64 64 GLN CB C 64 30.083 30.083 28.495 1.588 25149
2658 1 7 . 1 1 64 64 GLN H H 64 8.003 8.003 7.884 0.119 25149
2659 1 7 . 1 1 65 65 GLU N N 65 122.038 122.038 122.136 -0.098 25149
2660 1 7 . 1 1 65 65 GLU HA H 65 4.003 4.003 3.823 0.180 25149
2661 1 7 . 1 1 65 65 GLU C C 65 176.781 176.781 176.478 0.303 25149
2662 1 7 . 1 1 65 65 GLU CA C 65 57.682 57.682 56.839 0.843 25149
2663 1 7 . 1 1 65 65 GLU CB C 65 29.900 29.900 29.636 0.264 25149
2664 1 7 . 1 1 65 65 GLU H H 65 8.657 8.657 8.607 0.050 25149
2665 1 7 . 1 1 66 66 TRP N N 66 125.730 125.730 128.220 -2.490 25149
2666 1 7 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.270 0.134 25149
2667 1 7 . 1 1 66 66 TRP C C 66 175.460 175.460 175.086 0.374 25149
2668 1 7 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.506 0.119 25149
2669 1 7 . 1 1 66 66 TRP CB C 66 29.358 29.358 29.897 -0.539 25149
2670 1 7 . 1 1 66 66 TRP H H 66 8.499 8.499 8.081 0.418 25149
2671 1 7 . 1 1 67 67 LYS N N 67 127.396 127.396 126.942 0.454 25149
2672 1 7 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.123 -0.105 25149
2673 1 7 . 1 1 67 67 LYS C C 67 175.180 175.180 174.901 0.279 25149
2674 1 7 . 1 1 67 67 LYS CA C 67 54.514 54.514 53.838 0.676 25149
2675 1 7 . 1 1 67 67 LYS CB C 67 36.231 36.231 34.392 1.839 25149
2676 1 7 . 1 1 67 67 LYS H H 67 6.930 6.930 8.645 -1.715 25149
2677 1 7 . 1 1 68 68 PHE N N 68 121.511 121.511 127.113 -5.602 25149
2678 1 7 . 1 1 68 68 PHE HA H 68 4.108 4.108 3.952 0.156 25149
2679 1 7 . 1 1 68 68 PHE C C 68 176.613 176.613 175.499 1.114 25149
2680 1 7 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.834 2.127 25149
2681 1 7 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.382 1.880 25149
2682 1 7 . 1 1 68 68 PHE H H 68 8.430 8.430 8.524 -0.094 25149
2683 1 7 . 1 1 69 69 LYS N N 69 124.210 124.210 122.121 2.089 25149
2684 1 7 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.018 -0.023 25149
2685 1 7 . 1 1 69 69 LYS C C 69 175.651 175.651 176.140 -0.489 25149
2686 1 7 . 1 1 69 69 LYS CA C 69 57.320 57.320 57.280 0.040 25149
2687 1 7 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.541 -0.180 25149
2688 1 7 . 1 1 69 69 LYS H H 69 8.738 8.738 7.983 0.755 25149
2689 1 8 . 1 1 2 2 SER HA H 2 4.417 4.417 4.509 -0.092 25149
2690 1 8 . 1 1 2 2 SER CA C 2 58.322 58.322 58.770 -0.448 25149
2691 1 8 . 1 1 2 2 SER CB C 2 64.169 64.169 63.502 0.666 25149
2692 1 8 . 1 1 3 3 VAL N N 3 121.214 121.214 121.960 -0.746 25149
2693 1 8 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.184 -0.138 25149
2694 1 8 . 1 1 3 3 VAL C C 3 175.879 175.879 174.905 0.974 25149
2695 1 8 . 1 1 3 3 VAL CA C 3 62.138 62.138 61.505 0.633 25149
2696 1 8 . 1 1 3 3 VAL CB C 3 32.958 32.958 32.837 0.121 25149
2697 1 8 . 1 1 3 3 VAL H H 3 8.170 8.170 7.760 0.410 25149
2698 1 8 . 1 1 4 4 ALA N N 4 127.312 127.312 129.773 -2.461 25149
2699 1 8 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.630 -0.433 25149
2700 1 8 . 1 1 4 4 ALA C C 4 177.497 177.497 176.324 1.173 25149
2701 1 8 . 1 1 4 4 ALA CA C 4 52.439 52.439 51.343 1.096 25149
2702 1 8 . 1 1 4 4 ALA CB C 4 19.424 19.424 20.549 -1.125 25149
2703 1 8 . 1 1 4 4 ALA H H 4 8.294 8.294 8.295 -0.001 25149
2704 1 8 . 1 1 5 5 ASN N N 5 117.674 117.674 119.473 -1.799 25149
2705 1 8 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.781 -0.216 25149
2706 1 8 . 1 1 5 5 ASN C C 5 175.048 175.048 174.058 0.990 25149
2707 1 8 . 1 1 5 5 ASN CA C 5 53.725 53.725 53.197 0.528 25149
2708 1 8 . 1 1 5 5 ASN CB C 5 39.197 39.197 39.786 -0.589 25149
2709 1 8 . 1 1 5 5 ASN H H 5 8.252 8.252 8.541 -0.289 25149
2710 1 8 . 1 1 6 6 ASP N N 6 119.896 119.896 121.507 -1.611 25149
2711 1 8 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.720 -0.200 25149
2712 1 8 . 1 1 6 6 ASP C C 6 176.269 176.269 175.987 0.282 25149
2713 1 8 . 1 1 6 6 ASP CA C 6 54.497 54.497 53.690 0.808 25149
2714 1 8 . 1 1 6 6 ASP CB C 6 41.104 41.104 41.868 -0.764 25149
2715 1 8 . 1 1 6 6 ASP H H 6 8.215 8.215 8.768 -0.553 25149
2716 1 8 . 1 1 7 7 GLU N N 7 119.101 119.101 118.957 0.144 25149
2717 1 8 . 1 1 7 7 GLU HA H 7 4.243 4.243 4.368 -0.125 25149
2718 1 8 . 1 1 7 7 GLU C C 7 175.006 175.006 174.779 0.227 25149
2719 1 8 . 1 1 7 7 GLU CA C 7 56.689 56.689 56.197 0.492 25149
2720 1 8 . 1 1 7 7 GLU CB C 7 30.379 30.379 28.918 1.461 25149
2721 1 8 . 1 1 7 7 GLU H H 7 8.065 8.065 8.239 -0.174 25149
2722 1 8 . 1 1 8 8 ASN N N 8 116.852 116.852 115.043 1.809 25149
2723 1 8 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.653 -0.495 25149
2724 1 8 . 1 1 8 8 ASN C C 8 172.706 172.706 174.420 -1.714 25149
2725 1 8 . 1 1 8 8 ASN CA C 8 51.165 51.165 50.927 0.238 25149
2726 1 8 . 1 1 8 8 ASN CB C 8 40.702 40.702 40.908 -0.206 25149
2727 1 8 . 1 1 8 8 ASN H H 8 7.505 7.505 7.408 0.097 25149
2728 1 8 . 1 1 9 9 CYS N N 9 122.855 122.855 119.324 3.531 25149
2729 1 8 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.725 0.069 25149
2730 1 8 . 1 1 9 9 CYS C C 9 178.370 178.370 176.377 1.993 25149
2731 1 8 . 1 1 9 9 CYS CA C 9 59.552 59.552 59.486 0.066 25149
2732 1 8 . 1 1 9 9 CYS CB C 9 31.526 31.526 28.623 2.903 25149
2733 1 8 . 1 1 9 9 CYS H H 9 7.614 7.614 7.847 -0.233 25149
2734 1 8 . 1 1 10 10 GLY N N 10 117.295 117.295 109.024 8.271 25149
2735 1 8 . 1 1 10 10 GLY C C 10 174.111 174.111 174.400 -0.289 25149
2736 1 8 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.484 1.483 25149
2737 1 8 . 1 1 10 10 GLY H H 10 9.235 9.235 7.527 1.708 25149
2738 1 8 . 1 1 11 11 ILE N N 11 119.811 119.811 118.835 0.976 25149
2739 1 8 . 1 1 11 11 ILE HA H 11 3.809 3.809 4.441 -0.632 25149
2740 1 8 . 1 1 11 11 ILE C C 11 176.121 176.121 176.376 -0.255 25149
2741 1 8 . 1 1 11 11 ILE CA C 11 64.041 64.041 62.806 1.235 25149
2742 1 8 . 1 1 11 11 ILE CB C 11 39.411 39.411 39.196 0.215 25149
2743 1 8 . 1 1 11 11 ILE H H 11 8.285 8.285 7.375 0.910 25149
2744 1 8 . 1 1 12 12 CYS N N 12 116.728 116.728 117.529 -0.801 25149
2745 1 8 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.722 -0.146 25149
2746 1 8 . 1 1 12 12 CYS C C 12 175.975 175.975 173.977 1.998 25149
2747 1 8 . 1 1 12 12 CYS CA C 12 59.225 59.225 58.440 0.785 25149
2748 1 8 . 1 1 12 12 CYS CB C 12 32.246 32.246 29.045 3.201 25149
2749 1 8 . 1 1 12 12 CYS H H 12 7.607 7.607 7.747 -0.140 25149
2750 1 8 . 1 1 13 13 ARG N N 13 116.073 116.073 118.120 -2.047 25149
2751 1 8 . 1 1 13 13 ARG HA H 13 3.742 3.742 4.009 -0.267 25149
2752 1 8 . 1 1 13 13 ARG C C 13 174.979 174.979 174.186 0.793 25149
2753 1 8 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.981 0.655 25149
2754 1 8 . 1 1 13 13 ARG CB C 13 26.326 26.326 27.579 -1.253 25149
2755 1 8 . 1 1 13 13 ARG H H 13 7.987 7.987 7.967 0.020 25149
2756 1 8 . 1 1 14 14 MET N N 14 119.313 119.313 118.829 0.484 25149
2757 1 8 . 1 1 14 14 MET HA H 14 4.547 4.547 4.562 -0.015 25149
2758 1 8 . 1 1 14 14 MET C C 14 176.143 176.143 174.481 1.662 25149
2759 1 8 . 1 1 14 14 MET CA C 14 54.208 54.208 53.678 0.529 25149
2760 1 8 . 1 1 14 14 MET CB C 14 33.951 33.951 36.187 -2.236 25149
2761 1 8 . 1 1 14 14 MET H H 14 8.624 8.624 7.652 0.972 25149
2762 1 8 . 1 1 15 15 ALA N N 15 122.683 122.683 120.585 2.098 25149
2763 1 8 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.469 -0.197 25149
2764 1 8 . 1 1 15 15 ALA C C 15 180.117 180.117 178.312 1.805 25149
2765 1 8 . 1 1 15 15 ALA CA C 15 52.346 52.346 50.157 2.189 25149
2766 1 8 . 1 1 15 15 ALA CB C 15 19.487 19.487 19.997 -0.510 25149
2767 1 8 . 1 1 15 15 ALA H H 15 7.965 7.965 8.360 -0.395 25149
2768 1 8 . 1 1 16 16 PHE N N 16 119.313 119.313 123.255 -3.942 25149
2769 1 8 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.179 -0.138 25149
2770 1 8 . 1 1 16 16 PHE C C 16 176.423 176.423 176.437 -0.014 25149
2771 1 8 . 1 1 16 16 PHE CA C 16 59.130 59.130 60.050 -0.920 25149
2772 1 8 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.688 -0.298 25149
2773 1 8 . 1 1 16 16 PHE H H 16 8.095 8.095 7.847 0.248 25149
2774 1 8 . 1 1 17 17 ASN N N 17 112.313 112.313 116.519 -4.206 25149
2775 1 8 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.874 -0.238 25149
2776 1 8 . 1 1 17 17 ASN C C 17 175.337 175.337 175.004 0.333 25149
2777 1 8 . 1 1 17 17 ASN CA C 17 52.961 52.961 53.504 -0.543 25149
2778 1 8 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.899 -1.725 25149
2779 1 8 . 1 1 17 17 ASN H H 17 7.823 7.823 8.188 -0.365 25149
2780 1 8 . 1 1 18 18 GLY N N 18 107.742 107.742 108.858 -1.116 25149
2781 1 8 . 1 1 18 18 GLY C C 18 173.759 173.759 172.360 1.399 25149
2782 1 8 . 1 1 18 18 GLY CA C 18 44.464 44.464 45.088 -0.624 25149
2783 1 8 . 1 1 18 18 GLY H H 18 7.579 7.579 8.437 -0.858 25149
2784 1 8 . 1 1 19 19 CYS N N 19 117.050 117.050 116.801 0.249 25149
2785 1 8 . 1 1 19 19 CYS HA H 19 4.571 4.571 5.061 -0.490 25149
2786 1 8 . 1 1 19 19 CYS C C 19 174.039 174.039 172.661 1.378 25149
2787 1 8 . 1 1 19 19 CYS CA C 19 58.433 58.433 55.793 2.640 25149
2788 1 8 . 1 1 19 19 CYS CB C 19 30.681 30.681 30.271 0.410 25149
2789 1 8 . 1 1 19 19 CYS H H 19 8.198 8.198 8.099 0.099 25149
2790 1 8 . 1 1 20 20 CYS N N 20 123.923 123.923 118.616 5.307 25149
2791 1 8 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.594 -0.583 25149
2792 1 8 . 1 1 20 20 CYS C C 20 173.736 173.736 174.121 -0.385 25149
2793 1 8 . 1 1 20 20 CYS CA C 20 57.999 57.999 55.420 2.579 25149
2794 1 8 . 1 1 20 20 CYS CB C 20 28.205 28.205 28.085 0.120 25149
2795 1 8 . 1 1 20 20 CYS H H 20 8.466 8.466 8.237 0.229 25149
2796 1 8 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.313 -0.284 25149
2797 1 8 . 1 1 21 21 PRO CA C 21 65.426 65.426 64.753 0.673 25149
2798 1 8 . 1 1 21 21 PRO CB C 21 32.801 32.801 32.244 0.557 25149
2799 1 8 . 1 1 22 22 ASP N N 22 117.053 117.053 118.385 -1.332 25149
2800 1 8 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.615 -0.110 25149
2801 1 8 . 1 1 22 22 ASP C C 22 176.501 176.501 176.350 0.151 25149
2802 1 8 . 1 1 22 22 ASP CA C 22 55.017 55.017 54.774 0.243 25149
2803 1 8 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.406 2.116 25149
2804 1 8 . 1 1 22 22 ASP H H 22 8.395 8.395 8.423 -0.028 25149
2805 1 8 . 1 1 23 23 CYS N N 23 123.353 123.353 119.112 4.241 25149
2806 1 8 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.201 0.092 25149
2807 1 8 . 1 1 23 23 CYS C C 23 175.214 175.214 174.763 0.451 25149
2808 1 8 . 1 1 23 23 CYS CA C 23 61.633 61.633 60.091 1.542 25149
2809 1 8 . 1 1 23 23 CYS CB C 23 31.542 31.542 28.820 2.722 25149
2810 1 8 . 1 1 23 23 CYS H H 23 7.246 7.246 7.811 -0.565 25149
2811 1 8 . 1 1 24 24 LYS N N 24 117.539 117.539 128.101 -10.562 25149
2812 1 8 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.365 -0.135 25149
2813 1 8 . 1 1 24 24 LYS C C 24 177.106 177.106 175.968 1.138 25149
2814 1 8 . 1 1 24 24 LYS CA C 24 56.921 56.921 56.563 0.358 25149
2815 1 8 . 1 1 24 24 LYS CB C 24 34.615 34.615 32.647 1.968 25149
2816 1 8 . 1 1 24 24 LYS H H 24 8.173 8.173 8.414 -0.241 25149
2817 1 8 . 1 1 25 25 VAL N N 25 120.661 120.661 122.758 -2.097 25149
2818 1 8 . 1 1 25 25 VAL HA H 25 4.429 4.429 3.893 0.536 25149
2819 1 8 . 1 1 25 25 VAL C C 25 174.027 174.027 175.271 -1.244 25149
2820 1 8 . 1 1 25 25 VAL CA C 25 59.934 59.934 61.999 -2.065 25149
2821 1 8 . 1 1 25 25 VAL CB C 25 33.507 33.507 32.330 1.177 25149
2822 1 8 . 1 1 25 25 VAL H H 25 7.787 7.787 7.764 0.023 25149
2823 1 8 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.419 -0.083 25149
2824 1 8 . 1 1 26 26 PRO CA C 26 63.279 63.279 63.589 -0.310 25149
2825 1 8 . 1 1 26 26 PRO CB C 26 32.077 32.077 32.251 -0.174 25149
2826 1 8 . 1 1 27 27 GLY N N 27 109.926 109.926 109.343 0.583 25149
2827 1 8 . 1 1 27 27 GLY C C 27 175.169 175.169 175.920 -0.751 25149
2828 1 8 . 1 1 27 27 GLY CA C 27 45.042 45.042 45.195 -0.153 25149
2829 1 8 . 1 1 27 27 GLY H H 27 8.569 8.569 8.111 0.458 25149
2830 1 8 . 1 1 28 28 ASP N N 28 122.592 122.592 123.752 -1.160 25149
2831 1 8 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.293 -0.062 25149
2832 1 8 . 1 1 28 28 ASP C C 28 176.602 176.602 176.611 -0.009 25149
2833 1 8 . 1 1 28 28 ASP CA C 28 56.402 56.402 56.145 0.257 25149
2834 1 8 . 1 1 28 28 ASP CB C 28 40.912 40.912 40.440 0.472 25149
2835 1 8 . 1 1 28 28 ASP H H 28 8.214 8.214 8.261 -0.047 25149
2836 1 8 . 1 1 29 29 ASP N N 29 117.500 117.500 119.359 -1.859 25149
2837 1 8 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.366 0.081 25149
2838 1 8 . 1 1 29 29 ASP C C 29 175.505 175.505 177.181 -1.676 25149
2839 1 8 . 1 1 29 29 ASP CA C 29 55.266 55.266 55.387 -0.121 25149
2840 1 8 . 1 1 29 29 ASP CB C 29 41.225 41.225 40.330 0.895 25149
2841 1 8 . 1 1 29 29 ASP H H 29 8.271 8.271 8.295 -0.024 25149
2842 1 8 . 1 1 30 30 CYS N N 30 124.470 124.470 119.710 4.760 25149
2843 1 8 . 1 1 30 30 CYS HA H 30 4.390 4.390 4.309 0.080 25149
2844 1 8 . 1 1 30 30 CYS C C 30 171.755 171.755 173.977 -2.222 25149
2845 1 8 . 1 1 30 30 CYS CA C 30 57.676 57.676 58.091 -0.415 25149
2846 1 8 . 1 1 30 30 CYS CB C 30 29.154 29.154 25.758 3.396 25149
2847 1 8 . 1 1 30 30 CYS H H 30 7.912 7.912 8.269 -0.357 25149
2848 1 8 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.490 0.197 25149
2849 1 8 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.844 0.031 25149
2850 1 8 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.439 1.545 25149
2851 1 8 . 1 1 32 32 LEU N N 32 120.023 120.023 116.905 3.118 25149
2852 1 8 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.588 0.128 25149
2853 1 8 . 1 1 32 32 LEU C C 32 176.300 176.300 175.708 0.592 25149
2854 1 8 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.697 0.224 25149
2855 1 8 . 1 1 32 32 LEU CB C 32 43.336 43.336 43.339 -0.003 25149
2856 1 8 . 1 1 32 32 LEU H H 32 8.580 8.580 7.890 0.690 25149
2857 1 8 . 1 1 33 33 VAL N N 33 116.217 116.217 117.367 -1.150 25149
2858 1 8 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.449 0.214 25149
2859 1 8 . 1 1 33 33 VAL C C 33 171.374 171.374 174.610 -3.236 25149
2860 1 8 . 1 1 33 33 VAL CA C 33 60.449 60.449 61.117 -0.668 25149
2861 1 8 . 1 1 33 33 VAL CB C 33 36.448 36.448 34.058 2.390 25149
2862 1 8 . 1 1 33 33 VAL H H 33 8.594 8.594 8.411 0.183 25149
2863 1 8 . 1 1 34 34 TRP N N 34 122.711 122.711 124.948 -2.237 25149
2864 1 8 . 1 1 34 34 TRP HA H 34 5.339 5.339 5.133 0.206 25149
2865 1 8 . 1 1 34 34 TRP C C 34 176.770 176.770 175.909 0.861 25149
2866 1 8 . 1 1 34 34 TRP CA C 34 57.267 57.267 55.726 1.541 25149
2867 1 8 . 1 1 34 34 TRP CB C 34 33.780 33.780 33.401 0.379 25149
2868 1 8 . 1 1 34 34 TRP H H 34 8.756 8.756 8.416 0.340 25149
2869 1 8 . 1 1 35 35 GLY N N 35 107.569 107.569 107.313 0.256 25149
2870 1 8 . 1 1 35 35 GLY C C 35 177.397 177.397 173.796 3.601 25149
2871 1 8 . 1 1 35 35 GLY CA C 35 44.070 44.070 44.056 0.014 25149
2872 1 8 . 1 1 35 35 GLY H H 35 8.857 8.857 8.625 0.232 25149
2873 1 8 . 1 1 36 36 GLN N N 36 122.723 122.723 119.101 3.622 25149
2874 1 8 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.053 -0.307 25149
2875 1 8 . 1 1 36 36 GLN C C 36 176.445 176.445 176.059 0.386 25149
2876 1 8 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.119 0.310 25149
2877 1 8 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.380 -0.749 25149
2878 1 8 . 1 1 36 36 GLN H H 36 8.338 8.338 8.577 -0.239 25149
2879 1 8 . 1 1 37 37 CYS N N 37 115.763 115.763 114.316 1.447 25149
2880 1 8 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.884 -0.600 25149
2881 1 8 . 1 1 37 37 CYS C C 37 175.281 175.281 175.699 -0.418 25149
2882 1 8 . 1 1 37 37 CYS CA C 37 58.395 58.395 55.772 2.623 25149
2883 1 8 . 1 1 37 37 CYS CB C 37 31.143 31.143 31.115 0.028 25149
2884 1 8 . 1 1 37 37 CYS H H 37 7.622 7.622 7.681 -0.059 25149
2885 1 8 . 1 1 38 38 SER N N 38 114.540 114.540 116.144 -1.604 25149
2886 1 8 . 1 1 38 38 SER HA H 38 4.004 4.004 4.183 -0.179 25149
2887 1 8 . 1 1 38 38 SER C C 38 173.389 173.389 174.301 -0.912 25149
2888 1 8 . 1 1 38 38 SER CA C 38 62.285 62.285 60.817 1.468 25149
2889 1 8 . 1 1 38 38 SER H H 38 7.716 7.716 8.457 -0.741 25149
2890 1 8 . 1 1 39 39 HIS N N 39 121.947 121.947 121.230 0.717 25149
2891 1 8 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.373 0.071 25149
2892 1 8 . 1 1 39 39 HIS C C 39 172.326 172.326 173.336 -1.010 25149
2893 1 8 . 1 1 39 39 HIS CA C 39 61.320 61.320 57.036 4.284 25149
2894 1 8 . 1 1 39 39 HIS CB C 39 31.523 31.523 29.721 1.802 25149
2895 1 8 . 1 1 39 39 HIS H H 39 7.829 7.829 8.327 -0.498 25149
2896 1 8 . 1 1 40 40 CYS N N 40 121.859 121.859 124.107 -2.248 25149
2897 1 8 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.729 -0.120 25149
2898 1 8 . 1 1 40 40 CYS C C 40 171.900 171.900 172.744 -0.844 25149
2899 1 8 . 1 1 40 40 CYS CA C 40 55.791 55.791 55.642 0.148 25149
2900 1 8 . 1 1 40 40 CYS CB C 40 28.964 28.964 28.102 0.862 25149
2901 1 8 . 1 1 40 40 CYS H H 40 8.049 8.049 8.695 -0.646 25149
2902 1 8 . 1 1 41 41 PHE N N 41 120.690 120.690 121.677 -0.987 25149
2903 1 8 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.585 0.592 25149
2904 1 8 . 1 1 41 41 PHE C C 41 176.613 176.613 174.783 1.830 25149
2905 1 8 . 1 1 41 41 PHE CA C 41 56.033 56.033 55.608 0.425 25149
2906 1 8 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.598 2.162 25149
2907 1 8 . 1 1 41 41 PHE H H 41 8.368 8.368 8.609 -0.241 25149
2908 1 8 . 1 1 42 42 HIS N N 42 117.057 117.057 121.169 -4.112 25149
2909 1 8 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.474 0.195 25149
2910 1 8 . 1 1 42 42 HIS C C 42 177.464 177.464 175.435 2.029 25149
2911 1 8 . 1 1 42 42 HIS CA C 42 60.425 60.425 57.128 3.297 25149
2912 1 8 . 1 1 42 42 HIS CB C 42 29.740 29.740 29.804 -0.064 25149
2913 1 8 . 1 1 42 42 HIS H H 42 8.384 8.384 7.826 0.558 25149
2914 1 8 . 1 1 43 43 MET N N 43 128.543 128.543 126.011 2.532 25149
2915 1 8 . 1 1 43 43 MET HA H 43 3.965 3.965 4.022 -0.057 25149
2916 1 8 . 1 1 43 43 MET C C 43 177.845 177.845 177.411 0.434 25149
2917 1 8 . 1 1 43 43 MET CA C 43 59.209 59.209 60.314 -1.105 25149
2918 1 8 . 1 1 43 43 MET CB C 43 33.009 33.009 32.678 0.331 25149
2919 1 8 . 1 1 43 43 MET H H 43 9.439 9.439 8.425 1.014 25149
2920 1 8 . 1 1 44 44 HIS N N 44 116.500 116.500 118.003 -1.503 25149
2921 1 8 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.192 0.064 25149
2922 1 8 . 1 1 44 44 HIS C C 44 178.405 178.405 177.880 0.525 25149
2923 1 8 . 1 1 44 44 HIS CA C 44 58.793 58.793 59.176 -0.383 25149
2924 1 8 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.149 3.598 25149
2925 1 8 . 1 1 44 44 HIS H H 44 9.747 9.747 8.078 1.669 25149
2926 1 8 . 1 1 45 45 CYS N N 45 115.950 115.950 116.794 -0.844 25149
2927 1 8 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.204 -0.204 25149
2928 1 8 . 1 1 45 45 CYS C C 45 177.957 177.957 176.928 1.029 25149
2929 1 8 . 1 1 45 45 CYS CA C 45 62.923 62.923 63.315 -0.392 25149
2930 1 8 . 1 1 45 45 CYS CB C 45 29.102 29.102 26.691 2.411 25149
2931 1 8 . 1 1 45 45 CYS H H 45 6.845 6.845 8.183 -1.338 25149
2932 1 8 . 1 1 46 46 ILE N N 46 119.362 119.362 121.074 -1.712 25149
2933 1 8 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.650 0.016 25149
2934 1 8 . 1 1 46 46 ILE C C 46 176.613 176.613 177.733 -1.120 25149
2935 1 8 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.609 -4.367 25149
2936 1 8 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.811 -0.492 25149
2937 1 8 . 1 1 46 46 ILE H H 46 7.816 7.816 7.880 -0.064 25149
2938 1 8 . 1 1 47 47 LEU N N 47 122.180 122.180 120.291 1.889 25149
2939 1 8 . 1 1 47 47 LEU HA H 47 3.873 3.873 4.206 -0.333 25149
2940 1 8 . 1 1 47 47 LEU C C 47 179.726 179.726 178.981 0.745 25149
2941 1 8 . 1 1 47 47 LEU CA C 47 58.633 58.633 59.099 -0.466 25149
2942 1 8 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.965 -0.842 25149
2943 1 8 . 1 1 47 47 LEU H H 47 8.266 8.266 8.643 -0.377 25149
2944 1 8 . 1 1 48 48 LYS N N 48 118.251 118.251 117.899 0.352 25149
2945 1 8 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.235 -0.371 25149
2946 1 8 . 1 1 48 48 LYS C C 48 179.423 179.423 178.699 0.724 25149
2947 1 8 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.656 0.331 25149
2948 1 8 . 1 1 48 48 LYS CB C 48 32.765 32.765 32.031 0.734 25149
2949 1 8 . 1 1 48 48 LYS H H 48 7.147 7.147 8.334 -1.187 25149
2950 1 8 . 1 1 49 49 TRP N N 49 120.745 120.745 121.067 -0.322 25149
2951 1 8 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.311 -0.231 25149
2952 1 8 . 1 1 49 49 TRP C C 49 178.147 178.147 176.774 1.373 25149
2953 1 8 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.602 -0.057 25149
2954 1 8 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.252 0.163 25149
2955 1 8 . 1 1 49 49 TRP H H 49 7.709 7.709 7.950 -0.241 25149
2956 1 8 . 1 1 50 50 LEU N N 50 117.236 117.236 115.550 1.686 25149
2957 1 8 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.717 -0.112 25149
2958 1 8 . 1 1 50 50 LEU C C 50 179.658 179.658 177.365 2.293 25149
2959 1 8 . 1 1 50 50 LEU CA C 50 57.330 57.330 54.781 2.549 25149
2960 1 8 . 1 1 50 50 LEU CB C 50 41.416 41.416 42.539 -1.123 25149
2961 1 8 . 1 1 50 50 LEU H H 50 8.512 8.512 7.703 0.809 25149
2962 1 8 . 1 1 51 51 HIS N N 51 115.650 115.650 118.176 -2.526 25149
2963 1 8 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.567 -0.293 25149
2964 1 8 . 1 1 51 51 HIS C C 51 175.942 175.942 174.857 1.085 25149
2965 1 8 . 1 1 51 51 HIS CA C 51 57.320 57.320 56.824 0.496 25149
2966 1 8 . 1 1 51 51 HIS CB C 51 29.487 29.487 30.661 -1.174 25149
2967 1 8 . 1 1 51 51 HIS H H 51 7.713 7.713 8.447 -0.734 25149
2968 1 8 . 1 1 52 52 ALA N N 52 119.779 119.779 121.627 -1.848 25149
2969 1 8 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.446 -0.423 25149
2970 1 8 . 1 1 52 52 ALA C C 52 177.834 177.834 176.461 1.373 25149
2971 1 8 . 1 1 52 52 ALA CA C 52 52.865 52.865 52.644 0.221 25149
2972 1 8 . 1 1 52 52 ALA CB C 52 18.951 18.951 20.068 -1.117 25149
2973 1 8 . 1 1 52 52 ALA H H 52 7.191 7.191 7.776 -0.585 25149
2974 1 8 . 1 1 53 53 GLN N N 53 117.047 117.047 119.197 -2.150 25149
2975 1 8 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.200 -0.267 25149
2976 1 8 . 1 1 53 53 GLN C C 53 175.998 175.998 176.724 -0.726 25149
2977 1 8 . 1 1 53 53 GLN CA C 53 55.482 55.482 55.558 -0.076 25149
2978 1 8 . 1 1 53 53 GLN CB C 53 28.887 28.887 28.033 0.854 25149
2979 1 8 . 1 1 53 53 GLN H H 53 7.317 7.317 7.902 -0.585 25149
2980 1 8 . 1 1 54 54 GLN N N 54 118.463 118.463 121.844 -3.381 25149
2981 1 8 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.270 -0.281 25149
2982 1 8 . 1 1 54 54 GLN C C 54 176.300 176.300 176.217 0.083 25149
2983 1 8 . 1 1 54 54 GLN CA C 54 57.314 57.314 55.743 1.571 25149
2984 1 8 . 1 1 54 54 GLN CB C 54 28.823 28.823 28.436 0.388 25149
2985 1 8 . 1 1 54 54 GLN H H 54 7.949 7.949 8.676 -0.727 25149
2986 1 8 . 1 1 55 55 VAL N N 55 116.755 116.755 120.246 -3.491 25149
2987 1 8 . 1 1 55 55 VAL HA H 55 3.884 3.884 3.953 -0.069 25149
2988 1 8 . 1 1 55 55 VAL C C 55 175.774 175.774 176.126 -0.352 25149
2989 1 8 . 1 1 55 55 VAL CA C 55 63.210 63.210 61.305 1.905 25149
2990 1 8 . 1 1 55 55 VAL CB C 55 32.870 32.870 31.828 1.042 25149
2991 1 8 . 1 1 55 55 VAL H H 55 7.801 7.801 7.489 0.312 25149
2992 1 8 . 1 1 56 56 GLN N N 56 120.192 120.192 120.273 -0.081 25149
2993 1 8 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.206 -0.089 25149
2994 1 8 . 1 1 56 56 GLN C C 56 175.236 175.236 177.013 -1.777 25149
2995 1 8 . 1 1 56 56 GLN CA C 56 55.697 55.697 56.560 -0.863 25149
2996 1 8 . 1 1 56 56 GLN CB C 56 29.319 29.319 27.785 1.534 25149
2997 1 8 . 1 1 56 56 GLN H H 56 8.018 8.018 8.389 -0.371 25149
2998 1 8 . 1 1 57 57 GLN N N 57 121.276 121.276 120.715 0.561 25149
2999 1 8 . 1 1 57 57 GLN HA H 57 4.204 4.204 3.698 0.506 25149
3000 1 8 . 1 1 57 57 GLN C C 57 175.819 175.819 175.912 -0.093 25149
3001 1 8 . 1 1 57 57 GLN CA C 57 55.617 55.617 57.118 -1.501 25149
3002 1 8 . 1 1 57 57 GLN CB C 57 29.094 29.094 28.297 0.797 25149
3003 1 8 . 1 1 57 57 GLN H H 57 8.471 8.471 8.640 -0.169 25149
3004 1 8 . 1 1 58 58 HIS N N 58 120.001 120.001 118.477 1.524 25149
3005 1 8 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.393 0.781 25149
3006 1 8 . 1 1 58 58 HIS C C 58 173.636 173.636 175.987 -2.351 25149
3007 1 8 . 1 1 58 58 HIS CA C 58 54.353 54.353 57.081 -2.728 25149
3008 1 8 . 1 1 58 58 HIS CB C 58 33.057 33.057 29.467 3.590 25149
3009 1 8 . 1 1 58 58 HIS H H 58 8.366 8.366 7.969 0.397 25149
3010 1 8 . 1 1 59 59 CYS N N 59 121.924 121.924 122.179 -0.255 25149
3011 1 8 . 1 1 59 59 CYS HA H 59 4.442 4.442 3.849 0.593 25149
3012 1 8 . 1 1 59 59 CYS C C 59 176.334 176.334 174.335 1.999 25149
3013 1 8 . 1 1 59 59 CYS CA C 59 56.772 56.772 60.159 -3.387 25149
3014 1 8 . 1 1 59 59 CYS CB C 59 32.642 32.642 29.052 3.590 25149
3015 1 8 . 1 1 59 59 CYS H H 59 9.035 9.035 8.172 0.863 25149
3016 1 8 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.226 -0.413 25149
3017 1 8 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.356 0.305 25149
3018 1 8 . 1 1 60 60 PRO CB C 60 30.659 30.659 31.140 -0.481 25149
3019 1 8 . 1 1 61 61 MET N N 61 117.676 117.676 113.573 4.103 25149
3020 1 8 . 1 1 61 61 MET HA H 61 4.317 4.317 4.450 -0.133 25149
3021 1 8 . 1 1 61 61 MET C C 61 177.117 177.117 176.176 0.941 25149
3022 1 8 . 1 1 61 61 MET CA C 61 56.408 56.408 56.435 -0.027 25149
3023 1 8 . 1 1 61 61 MET CB C 61 32.551 32.551 34.640 -2.089 25149
3024 1 8 . 1 1 61 61 MET H H 61 9.135 9.135 7.139 1.996 25149
3025 1 8 . 1 1 62 62 CYS N N 62 117.214 117.214 119.267 -2.053 25149
3026 1 8 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.486 0.388 25149
3027 1 8 . 1 1 62 62 CYS C C 62 175.740 175.740 175.236 0.504 25149
3028 1 8 . 1 1 62 62 CYS CA C 62 58.273 58.273 58.328 -0.055 25149
3029 1 8 . 1 1 62 62 CYS CB C 62 32.776 32.776 28.441 4.335 25149
3030 1 8 . 1 1 62 62 CYS H H 62 8.011 8.011 7.507 0.504 25149
3031 1 8 . 1 1 63 63 ARG N N 63 116.555 116.555 118.561 -2.006 25149
3032 1 8 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.405 -0.480 25149
3033 1 8 . 1 1 63 63 ARG C C 63 175.326 175.326 175.350 -0.024 25149
3034 1 8 . 1 1 63 63 ARG CA C 63 58.073 58.073 55.758 2.315 25149
3035 1 8 . 1 1 63 63 ARG CB C 63 27.136 27.136 30.405 -3.269 25149
3036 1 8 . 1 1 63 63 ARG H H 63 8.086 8.086 8.376 -0.290 25149
3037 1 8 . 1 1 64 64 GLN N N 64 118.932 118.932 117.863 1.069 25149
3038 1 8 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.659 -0.400 25149
3039 1 8 . 1 1 64 64 GLN C C 64 176.054 176.054 175.671 0.383 25149
3040 1 8 . 1 1 64 64 GLN CA C 64 56.316 56.316 54.530 1.786 25149
3041 1 8 . 1 1 64 64 GLN CB C 64 30.083 30.083 30.365 -0.282 25149
3042 1 8 . 1 1 64 64 GLN H H 64 8.003 8.003 7.869 0.134 25149
3043 1 8 . 1 1 65 65 GLU N N 65 122.038 122.038 122.579 -0.541 25149
3044 1 8 . 1 1 65 65 GLU HA H 65 4.003 4.003 4.064 -0.061 25149
3045 1 8 . 1 1 65 65 GLU C C 65 176.781 176.781 176.117 0.664 25149
3046 1 8 . 1 1 65 65 GLU CA C 65 57.682 57.682 56.419 1.263 25149
3047 1 8 . 1 1 65 65 GLU CB C 65 29.900 29.900 29.947 -0.047 25149
3048 1 8 . 1 1 65 65 GLU H H 65 8.657 8.657 8.692 -0.035 25149
3049 1 8 . 1 1 66 66 TRP N N 66 125.730 125.730 128.229 -2.499 25149
3050 1 8 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.401 0.003 25149
3051 1 8 . 1 1 66 66 TRP C C 66 175.460 175.460 175.020 0.440 25149
3052 1 8 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.519 0.106 25149
3053 1 8 . 1 1 66 66 TRP CB C 66 29.358 29.358 30.105 -0.747 25149
3054 1 8 . 1 1 66 66 TRP H H 66 8.499 8.499 8.350 0.149 25149
3055 1 8 . 1 1 67 67 LYS N N 67 127.396 127.396 127.508 -0.112 25149
3056 1 8 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.010 0.008 25149
3057 1 8 . 1 1 67 67 LYS C C 67 175.180 175.180 175.140 0.040 25149
3058 1 8 . 1 1 67 67 LYS CA C 67 54.514 54.514 54.029 0.485 25149
3059 1 8 . 1 1 67 67 LYS CB C 67 36.231 36.231 34.011 2.220 25149
3060 1 8 . 1 1 67 67 LYS H H 67 6.930 6.930 8.196 -1.266 25149
3061 1 8 . 1 1 68 68 PHE N N 68 121.511 121.511 127.084 -5.573 25149
3062 1 8 . 1 1 68 68 PHE HA H 68 4.108 4.108 3.917 0.191 25149
3063 1 8 . 1 1 68 68 PHE C C 68 176.613 176.613 175.320 1.293 25149
3064 1 8 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.840 2.121 25149
3065 1 8 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.688 1.574 25149
3066 1 8 . 1 1 68 68 PHE H H 68 8.430 8.430 8.568 -0.138 25149
3067 1 8 . 1 1 69 69 LYS N N 69 124.210 124.210 122.218 1.992 25149
3068 1 8 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.144 -0.149 25149
3069 1 8 . 1 1 69 69 LYS C C 69 175.651 175.651 176.266 -0.615 25149
3070 1 8 . 1 1 69 69 LYS CA C 69 57.320 57.320 56.639 0.681 25149
3071 1 8 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.916 -0.555 25149
3072 1 8 . 1 1 69 69 LYS H H 69 8.738 8.738 8.047 0.691 25149
3073 1 9 . 1 1 2 2 SER HA H 2 4.417 4.417 4.616 -0.199 25149
3074 1 9 . 1 1 2 2 SER CA C 2 58.322 58.322 58.127 0.195 25149
3075 1 9 . 1 1 2 2 SER CB C 2 64.169 64.169 64.018 0.151 25149
3076 1 9 . 1 1 3 3 VAL N N 3 121.214 121.214 120.169 1.045 25149
3077 1 9 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.335 -0.289 25149
3078 1 9 . 1 1 3 3 VAL C C 3 175.879 175.879 174.871 1.008 25149
3079 1 9 . 1 1 3 3 VAL CA C 3 62.138 62.138 61.678 0.460 25149
3080 1 9 . 1 1 3 3 VAL CB C 3 32.958 32.958 34.540 -1.582 25149
3081 1 9 . 1 1 3 3 VAL H H 3 8.170 8.170 7.882 0.288 25149
3082 1 9 . 1 1 4 4 ALA N N 4 127.312 127.312 128.258 -0.946 25149
3083 1 9 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.596 -0.399 25149
3084 1 9 . 1 1 4 4 ALA C C 4 177.497 177.497 176.911 0.586 25149
3085 1 9 . 1 1 4 4 ALA CA C 4 52.439 52.439 51.752 0.687 25149
3086 1 9 . 1 1 4 4 ALA CB C 4 19.424 19.424 20.111 -0.687 25149
3087 1 9 . 1 1 4 4 ALA H H 4 8.294 8.294 8.233 0.061 25149
3088 1 9 . 1 1 5 5 ASN N N 5 117.674 117.674 120.065 -2.391 25149
3089 1 9 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.723 -0.158 25149
3090 1 9 . 1 1 5 5 ASN C C 5 175.048 175.048 174.548 0.500 25149
3091 1 9 . 1 1 5 5 ASN CA C 5 53.725 53.725 53.389 0.336 25149
3092 1 9 . 1 1 5 5 ASN CB C 5 39.197 39.197 38.619 0.578 25149
3093 1 9 . 1 1 5 5 ASN H H 5 8.252 8.252 8.749 -0.497 25149
3094 1 9 . 1 1 6 6 ASP N N 6 119.896 119.896 119.468 0.428 25149
3095 1 9 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.653 -0.133 25149
3096 1 9 . 1 1 6 6 ASP C C 6 176.269 176.269 174.736 1.533 25149
3097 1 9 . 1 1 6 6 ASP CA C 6 54.497 54.497 53.421 1.076 25149
3098 1 9 . 1 1 6 6 ASP CB C 6 41.104 41.104 40.507 0.597 25149
3099 1 9 . 1 1 6 6 ASP H H 6 8.215 8.215 7.907 0.308 25149
3100 1 9 . 1 1 7 7 GLU N N 7 119.101 119.101 117.050 2.051 25149
3101 1 9 . 1 1 7 7 GLU HA H 7 4.243 4.243 3.692 0.550 25149
3102 1 9 . 1 1 7 7 GLU C C 7 175.006 175.006 174.022 0.984 25149
3103 1 9 . 1 1 7 7 GLU CA C 7 56.689 56.689 56.945 -0.256 25149
3104 1 9 . 1 1 7 7 GLU CB C 7 30.379 30.379 27.413 2.966 25149
3105 1 9 . 1 1 7 7 GLU H H 7 8.065 8.065 8.442 -0.377 25149
3106 1 9 . 1 1 8 8 ASN N N 8 116.852 116.852 114.573 2.279 25149
3107 1 9 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.399 -0.241 25149
3108 1 9 . 1 1 8 8 ASN C C 8 172.706 172.706 175.400 -2.694 25149
3109 1 9 . 1 1 8 8 ASN CA C 8 51.165 51.165 50.773 0.392 25149
3110 1 9 . 1 1 8 8 ASN CB C 8 40.702 40.702 39.024 1.678 25149
3111 1 9 . 1 1 8 8 ASN H H 8 7.505 7.505 7.866 -0.361 25149
3112 1 9 . 1 1 9 9 CYS N N 9 122.855 122.855 121.207 1.648 25149
3113 1 9 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.856 -0.062 25149
3114 1 9 . 1 1 9 9 CYS C C 9 178.370 178.370 176.660 1.710 25149
3115 1 9 . 1 1 9 9 CYS CA C 9 59.552 59.552 61.241 -1.689 25149
3116 1 9 . 1 1 9 9 CYS CB C 9 31.526 31.526 28.852 2.674 25149
3117 1 9 . 1 1 9 9 CYS H H 9 7.614 7.614 7.844 -0.230 25149
3118 1 9 . 1 1 10 10 GLY N N 10 117.295 117.295 109.944 7.351 25149
3119 1 9 . 1 1 10 10 GLY C C 10 174.111 174.111 174.451 -0.340 25149
3120 1 9 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.539 1.427 25149
3121 1 9 . 1 1 10 10 GLY H H 10 9.235 9.235 7.788 1.447 25149
3122 1 9 . 1 1 11 11 ILE N N 11 119.811 119.811 120.605 -0.794 25149
3123 1 9 . 1 1 11 11 ILE HA H 11 3.809 3.809 4.048 -0.239 25149
3124 1 9 . 1 1 11 11 ILE C C 11 176.121 176.121 176.258 -0.137 25149
3125 1 9 . 1 1 11 11 ILE CA C 11 64.041 64.041 64.240 -0.199 25149
3126 1 9 . 1 1 11 11 ILE CB C 11 39.411 39.411 38.813 0.598 25149
3127 1 9 . 1 1 11 11 ILE H H 11 8.285 8.285 7.303 0.982 25149
3128 1 9 . 1 1 12 12 CYS N N 12 116.728 116.728 116.042 0.686 25149
3129 1 9 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.603 -0.027 25149
3130 1 9 . 1 1 12 12 CYS C C 12 175.975 175.975 173.852 2.123 25149
3131 1 9 . 1 1 12 12 CYS CA C 12 59.225 59.225 57.342 1.883 25149
3132 1 9 . 1 1 12 12 CYS CB C 12 32.246 32.246 29.831 2.415 25149
3133 1 9 . 1 1 12 12 CYS H H 12 7.607 7.607 7.659 -0.052 25149
3134 1 9 . 1 1 13 13 ARG N N 13 116.073 116.073 117.978 -1.905 25149
3135 1 9 . 1 1 13 13 ARG HA H 13 3.742 3.742 4.052 -0.310 25149
3136 1 9 . 1 1 13 13 ARG C C 13 174.979 174.979 174.722 0.257 25149
3137 1 9 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.862 0.774 25149
3138 1 9 . 1 1 13 13 ARG CB C 13 26.326 26.326 26.907 -0.581 25149
3139 1 9 . 1 1 13 13 ARG H H 13 7.987 7.987 8.235 -0.248 25149
3140 1 9 . 1 1 14 14 MET N N 14 119.313 119.313 118.668 0.645 25149
3141 1 9 . 1 1 14 14 MET HA H 14 4.547 4.547 4.631 -0.084 25149
3142 1 9 . 1 1 14 14 MET C C 14 176.143 176.143 175.484 0.659 25149
3143 1 9 . 1 1 14 14 MET CA C 14 54.208 54.208 53.738 0.470 25149
3144 1 9 . 1 1 14 14 MET CB C 14 33.951 33.951 34.593 -0.641 25149
3145 1 9 . 1 1 14 14 MET H H 14 8.624 8.624 7.601 1.023 25149
3146 1 9 . 1 1 15 15 ALA N N 15 122.683 122.683 129.642 -6.959 25149
3147 1 9 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.204 0.068 25149
3148 1 9 . 1 1 15 15 ALA C C 15 180.117 180.117 178.552 1.565 25149
3149 1 9 . 1 1 15 15 ALA CA C 15 52.346 52.346 52.252 0.094 25149
3150 1 9 . 1 1 15 15 ALA CB C 15 19.487 19.487 19.262 0.225 25149
3151 1 9 . 1 1 15 15 ALA H H 15 7.965 7.965 8.487 -0.522 25149
3152 1 9 . 1 1 16 16 PHE N N 16 119.313 119.313 121.084 -1.771 25149
3153 1 9 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.248 -0.207 25149
3154 1 9 . 1 1 16 16 PHE C C 16 176.423 176.423 176.851 -0.428 25149
3155 1 9 . 1 1 16 16 PHE CA C 16 59.130 59.130 58.486 0.644 25149
3156 1 9 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.152 0.238 25149
3157 1 9 . 1 1 16 16 PHE H H 16 8.095 8.095 8.340 -0.245 25149
3158 1 9 . 1 1 17 17 ASN N N 17 112.313 112.313 116.420 -4.107 25149
3159 1 9 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.758 -0.122 25149
3160 1 9 . 1 1 17 17 ASN C C 17 175.337 175.337 175.212 0.125 25149
3161 1 9 . 1 1 17 17 ASN CA C 17 52.961 52.961 53.327 -0.366 25149
3162 1 9 . 1 1 17 17 ASN CB C 17 37.174 37.174 39.016 -1.842 25149
3163 1 9 . 1 1 17 17 ASN H H 17 7.823 7.823 8.068 -0.245 25149
3164 1 9 . 1 1 18 18 GLY N N 18 107.742 107.742 107.787 -0.045 25149
3165 1 9 . 1 1 18 18 GLY C C 18 173.759 173.759 172.916 0.843 25149
3166 1 9 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.225 0.239 25149
3167 1 9 . 1 1 18 18 GLY H H 18 7.579 7.579 8.318 -0.739 25149
3168 1 9 . 1 1 19 19 CYS N N 19 117.050 117.050 117.733 -0.683 25149
3169 1 9 . 1 1 19 19 CYS HA H 19 4.571 4.571 4.736 -0.165 25149
3170 1 9 . 1 1 19 19 CYS C C 19 174.039 174.039 175.414 -1.375 25149
3171 1 9 . 1 1 19 19 CYS CA C 19 58.433 58.433 56.784 1.649 25149
3172 1 9 . 1 1 19 19 CYS CB C 19 30.681 30.681 29.533 1.148 25149
3173 1 9 . 1 1 19 19 CYS H H 19 8.198 8.198 8.122 0.076 25149
3174 1 9 . 1 1 20 20 CYS N N 20 123.923 123.923 119.707 4.216 25149
3175 1 9 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.343 -0.332 25149
3176 1 9 . 1 1 20 20 CYS C C 20 173.736 173.736 174.028 -0.292 25149
3177 1 9 . 1 1 20 20 CYS CA C 20 57.999 57.999 58.131 -0.132 25149
3178 1 9 . 1 1 20 20 CYS CB C 20 28.205 28.205 27.654 0.551 25149
3179 1 9 . 1 1 20 20 CYS H H 20 8.466 8.466 8.654 -0.188 25149
3180 1 9 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.245 -0.216 25149
3181 1 9 . 1 1 21 21 PRO CA C 21 65.426 65.426 65.251 0.175 25149
3182 1 9 . 1 1 21 21 PRO CB C 21 32.801 32.801 31.777 1.024 25149
3183 1 9 . 1 1 22 22 ASP N N 22 117.053 117.053 117.773 -0.720 25149
3184 1 9 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.438 0.067 25149
3185 1 9 . 1 1 22 22 ASP C C 22 176.501 176.501 175.275 1.226 25149
3186 1 9 . 1 1 22 22 ASP CA C 22 55.017 55.017 54.556 0.461 25149
3187 1 9 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.362 2.160 25149
3188 1 9 . 1 1 22 22 ASP H H 22 8.395 8.395 8.476 -0.081 25149
3189 1 9 . 1 1 23 23 CYS N N 23 123.353 123.353 119.507 3.846 25149
3190 1 9 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.535 -0.242 25149
3191 1 9 . 1 1 23 23 CYS C C 23 175.214 175.214 174.006 1.208 25149
3192 1 9 . 1 1 23 23 CYS CA C 23 61.633 61.633 58.684 2.949 25149
3193 1 9 . 1 1 23 23 CYS CB C 23 31.542 31.542 28.913 2.629 25149
3194 1 9 . 1 1 23 23 CYS H H 23 7.246 7.246 7.562 -0.316 25149
3195 1 9 . 1 1 24 24 LYS N N 24 117.539 117.539 128.006 -10.467 25149
3196 1 9 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.437 -0.207 25149
3197 1 9 . 1 1 24 24 LYS C C 24 177.106 177.106 175.147 1.959 25149
3198 1 9 . 1 1 24 24 LYS CA C 24 56.921 56.921 55.921 1.000 25149
3199 1 9 . 1 1 24 24 LYS CB C 24 34.615 34.615 32.556 2.059 25149
3200 1 9 . 1 1 24 24 LYS H H 24 8.173 8.173 8.459 -0.286 25149
3201 1 9 . 1 1 25 25 VAL N N 25 120.661 120.661 126.519 -5.858 25149
3202 1 9 . 1 1 25 25 VAL HA H 25 4.429 4.429 4.599 -0.170 25149
3203 1 9 . 1 1 25 25 VAL C C 25 174.027 174.027 174.152 -0.125 25149
3204 1 9 . 1 1 25 25 VAL CA C 25 59.934 59.934 58.802 1.132 25149
3205 1 9 . 1 1 25 25 VAL CB C 25 33.507 33.507 34.126 -0.619 25149
3206 1 9 . 1 1 25 25 VAL H H 25 7.787 7.787 8.476 -0.689 25149
3207 1 9 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.568 -0.232 25149
3208 1 9 . 1 1 26 26 PRO CA C 26 63.279 63.279 63.063 0.216 25149
3209 1 9 . 1 1 26 26 PRO CB C 26 32.077 32.077 30.025 2.052 25149
3210 1 9 . 1 1 27 27 GLY N N 27 109.926 109.926 110.630 -0.704 25149
3211 1 9 . 1 1 27 27 GLY C C 27 175.169 175.169 172.564 2.605 25149
3212 1 9 . 1 1 27 27 GLY CA C 27 45.042 45.042 45.632 -0.590 25149
3213 1 9 . 1 1 27 27 GLY H H 27 8.569 8.569 7.980 0.589 25149
3214 1 9 . 1 1 28 28 ASP N N 28 122.592 122.592 117.990 4.602 25149
3215 1 9 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.728 -0.497 25149
3216 1 9 . 1 1 28 28 ASP C C 28 176.602 176.602 175.790 0.812 25149
3217 1 9 . 1 1 28 28 ASP CA C 28 56.402 56.402 53.990 2.412 25149
3218 1 9 . 1 1 28 28 ASP CB C 28 40.912 40.912 41.301 -0.389 25149
3219 1 9 . 1 1 28 28 ASP H H 28 8.214 8.214 8.307 -0.093 25149
3220 1 9 . 1 1 29 29 ASP N N 29 117.500 117.500 120.431 -2.931 25149
3221 1 9 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.685 -0.238 25149
3222 1 9 . 1 1 29 29 ASP C C 29 175.505 175.505 175.632 -0.127 25149
3223 1 9 . 1 1 29 29 ASP CA C 29 55.266 55.266 53.103 2.163 25149
3224 1 9 . 1 1 29 29 ASP CB C 29 41.225 41.225 38.596 2.629 25149
3225 1 9 . 1 1 29 29 ASP H H 29 8.271 8.271 8.544 -0.273 25149
3226 1 9 . 1 1 30 30 CYS N N 30 124.470 124.470 120.333 4.137 25149
3227 1 9 . 1 1 30 30 CYS HA H 30 4.390 4.390 4.888 -0.498 25149
3228 1 9 . 1 1 30 30 CYS C C 30 171.755 171.755 172.924 -1.169 25149
3229 1 9 . 1 1 30 30 CYS CA C 30 57.676 57.676 57.255 0.421 25149
3230 1 9 . 1 1 30 30 CYS CB C 30 29.154 29.154 28.883 0.271 25149
3231 1 9 . 1 1 30 30 CYS H H 30 7.912 7.912 7.867 0.045 25149
3232 1 9 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.572 0.115 25149
3233 1 9 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.712 0.163 25149
3234 1 9 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.347 1.637 25149
3235 1 9 . 1 1 32 32 LEU N N 32 120.023 120.023 117.138 2.885 25149
3236 1 9 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.495 0.221 25149
3237 1 9 . 1 1 32 32 LEU C C 32 176.300 176.300 175.309 0.991 25149
3238 1 9 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.678 0.243 25149
3239 1 9 . 1 1 32 32 LEU CB C 32 43.336 43.336 42.945 0.391 25149
3240 1 9 . 1 1 32 32 LEU H H 32 8.580 8.580 7.971 0.609 25149
3241 1 9 . 1 1 33 33 VAL N N 33 116.217 116.217 117.835 -1.618 25149
3242 1 9 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.466 0.197 25149
3243 1 9 . 1 1 33 33 VAL C C 33 171.374 171.374 173.940 -2.566 25149
3244 1 9 . 1 1 33 33 VAL CA C 33 60.449 60.449 60.175 0.274 25149
3245 1 9 . 1 1 33 33 VAL CB C 33 36.448 36.448 35.751 0.697 25149
3246 1 9 . 1 1 33 33 VAL H H 33 8.594 8.594 8.169 0.425 25149
3247 1 9 . 1 1 34 34 TRP N N 34 122.711 122.711 125.105 -2.394 25149
3248 1 9 . 1 1 34 34 TRP HA H 34 5.339 5.339 4.878 0.461 25149
3249 1 9 . 1 1 34 34 TRP C C 34 176.770 176.770 175.450 1.320 25149
3250 1 9 . 1 1 34 34 TRP CA C 34 57.267 57.267 55.730 1.538 25149
3251 1 9 . 1 1 34 34 TRP CB C 34 33.780 33.780 33.442 0.338 25149
3252 1 9 . 1 1 34 34 TRP H H 34 8.756 8.756 8.313 0.443 25149
3253 1 9 . 1 1 35 35 GLY N N 35 107.569 107.569 107.587 -0.018 25149
3254 1 9 . 1 1 35 35 GLY C C 35 177.397 177.397 173.859 3.538 25149
3255 1 9 . 1 1 35 35 GLY CA C 35 44.070 44.070 44.126 -0.056 25149
3256 1 9 . 1 1 35 35 GLY H H 35 8.857 8.857 8.411 0.446 25149
3257 1 9 . 1 1 36 36 GLN N N 36 122.723 122.723 119.321 3.402 25149
3258 1 9 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.069 -0.323 25149
3259 1 9 . 1 1 36 36 GLN C C 36 176.445 176.445 175.783 0.662 25149
3260 1 9 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.283 0.146 25149
3261 1 9 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.466 -0.835 25149
3262 1 9 . 1 1 36 36 GLN H H 36 8.338 8.338 8.526 -0.188 25149
3263 1 9 . 1 1 37 37 CYS N N 37 115.763 115.763 114.797 0.966 25149
3264 1 9 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.825 -0.541 25149
3265 1 9 . 1 1 37 37 CYS C C 37 175.281 175.281 175.480 -0.199 25149
3266 1 9 . 1 1 37 37 CYS CA C 37 58.395 58.395 56.043 2.352 25149
3267 1 9 . 1 1 37 37 CYS CB C 37 31.143 31.143 30.481 0.662 25149
3268 1 9 . 1 1 37 37 CYS H H 37 7.622 7.622 7.843 -0.221 25149
3269 1 9 . 1 1 38 38 SER N N 38 114.540 114.540 114.566 -0.026 25149
3270 1 9 . 1 1 38 38 SER HA H 38 4.004 4.004 4.333 -0.329 25149
3271 1 9 . 1 1 38 38 SER C C 38 173.389 173.389 173.937 -0.548 25149
3272 1 9 . 1 1 38 38 SER CA C 38 62.285 62.285 59.879 2.406 25149
3273 1 9 . 1 1 38 38 SER H H 38 7.716 7.716 8.460 -0.744 25149
3274 1 9 . 1 1 39 39 HIS N N 39 121.947 121.947 119.556 2.391 25149
3275 1 9 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.444 -0.000 25149
3276 1 9 . 1 1 39 39 HIS C C 39 172.326 172.326 173.141 -0.815 25149
3277 1 9 . 1 1 39 39 HIS CA C 39 61.320 61.320 56.798 4.522 25149
3278 1 9 . 1 1 39 39 HIS CB C 39 31.523 31.523 29.660 1.863 25149
3279 1 9 . 1 1 39 39 HIS H H 39 7.829 7.829 8.227 -0.398 25149
3280 1 9 . 1 1 40 40 CYS N N 40 121.859 121.859 124.719 -2.860 25149
3281 1 9 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.289 0.320 25149
3282 1 9 . 1 1 40 40 CYS C C 40 171.900 171.900 172.497 -0.597 25149
3283 1 9 . 1 1 40 40 CYS CA C 40 55.791 55.791 57.195 -1.404 25149
3284 1 9 . 1 1 40 40 CYS CB C 40 28.964 28.964 29.343 -0.379 25149
3285 1 9 . 1 1 40 40 CYS H H 40 8.049 8.049 8.485 -0.436 25149
3286 1 9 . 1 1 41 41 PHE N N 41 120.690 120.690 120.170 0.520 25149
3287 1 9 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.363 0.814 25149
3288 1 9 . 1 1 41 41 PHE C C 41 176.613 176.613 174.206 2.407 25149
3289 1 9 . 1 1 41 41 PHE CA C 41 56.033 56.033 55.755 0.278 25149
3290 1 9 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.764 1.996 25149
3291 1 9 . 1 1 41 41 PHE H H 41 8.368 8.368 8.391 -0.023 25149
3292 1 9 . 1 1 42 42 HIS N N 42 117.057 117.057 121.359 -4.302 25149
3293 1 9 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.339 0.330 25149
3294 1 9 . 1 1 42 42 HIS C C 42 177.464 177.464 176.336 1.128 25149
3295 1 9 . 1 1 42 42 HIS CA C 42 60.425 60.425 57.099 3.326 25149
3296 1 9 . 1 1 42 42 HIS CB C 42 29.740 29.740 29.337 0.403 25149
3297 1 9 . 1 1 42 42 HIS H H 42 8.384 8.384 8.447 -0.063 25149
3298 1 9 . 1 1 43 43 MET N N 43 128.543 128.543 126.157 2.386 25149
3299 1 9 . 1 1 43 43 MET HA H 43 3.965 3.965 3.981 -0.016 25149
3300 1 9 . 1 1 43 43 MET C C 43 177.845 177.845 177.203 0.642 25149
3301 1 9 . 1 1 43 43 MET CA C 43 59.209 59.209 60.557 -1.348 25149
3302 1 9 . 1 1 43 43 MET CB C 43 33.009 33.009 32.622 0.387 25149
3303 1 9 . 1 1 43 43 MET H H 43 9.439 9.439 8.443 0.996 25149
3304 1 9 . 1 1 44 44 HIS N N 44 116.500 116.500 116.563 -0.063 25149
3305 1 9 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.216 0.040 25149
3306 1 9 . 1 1 44 44 HIS C C 44 178.405 178.405 177.821 0.584 25149
3307 1 9 . 1 1 44 44 HIS CA C 44 58.793 58.793 59.145 -0.352 25149
3308 1 9 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.090 3.658 25149
3309 1 9 . 1 1 44 44 HIS H H 44 9.747 9.747 8.041 1.706 25149
3310 1 9 . 1 1 45 45 CYS N N 45 115.950 115.950 117.816 -1.866 25149
3311 1 9 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.121 -0.121 25149
3312 1 9 . 1 1 45 45 CYS C C 45 177.957 177.957 177.156 0.801 25149
3313 1 9 . 1 1 45 45 CYS CA C 45 62.923 62.923 63.766 -0.843 25149
3314 1 9 . 1 1 45 45 CYS CB C 45 29.102 29.102 27.221 1.881 25149
3315 1 9 . 1 1 45 45 CYS H H 45 6.845 6.845 8.133 -1.288 25149
3316 1 9 . 1 1 46 46 ILE N N 46 119.362 119.362 121.268 -1.906 25149
3317 1 9 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.697 -0.032 25149
3318 1 9 . 1 1 46 46 ILE C C 46 176.613 176.613 177.652 -1.039 25149
3319 1 9 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.564 -4.322 25149
3320 1 9 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.836 -0.517 25149
3321 1 9 . 1 1 46 46 ILE H H 46 7.816 7.816 8.043 -0.227 25149
3322 1 9 . 1 1 47 47 LEU N N 47 122.180 122.180 120.460 1.720 25149
3323 1 9 . 1 1 47 47 LEU HA H 47 3.873 3.873 3.787 0.086 25149
3324 1 9 . 1 1 47 47 LEU C C 47 179.726 179.726 178.613 1.113 25149
3325 1 9 . 1 1 47 47 LEU CA C 47 58.633 58.633 58.814 -0.181 25149
3326 1 9 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.631 -0.508 25149
3327 1 9 . 1 1 47 47 LEU H H 47 8.266 8.266 8.470 -0.204 25149
3328 1 9 . 1 1 48 48 LYS N N 48 118.251 118.251 118.346 -0.095 25149
3329 1 9 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.121 -0.257 25149
3330 1 9 . 1 1 48 48 LYS C C 48 179.423 179.423 178.611 0.812 25149
3331 1 9 . 1 1 48 48 LYS CA C 48 59.987 59.987 60.002 -0.015 25149
3332 1 9 . 1 1 48 48 LYS CB C 48 32.765 32.765 32.094 0.671 25149
3333 1 9 . 1 1 48 48 LYS H H 48 7.147 7.147 8.233 -1.086 25149
3334 1 9 . 1 1 49 49 TRP N N 49 120.745 120.745 120.546 0.199 25149
3335 1 9 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.391 -0.311 25149
3336 1 9 . 1 1 49 49 TRP C C 49 178.147 178.147 177.829 0.318 25149
3337 1 9 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.276 0.269 25149
3338 1 9 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.184 0.231 25149
3339 1 9 . 1 1 49 49 TRP H H 49 7.709 7.709 7.531 0.178 25149
3340 1 9 . 1 1 50 50 LEU N N 50 117.236 117.236 116.414 0.822 25149
3341 1 9 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.706 -0.101 25149
3342 1 9 . 1 1 50 50 LEU C C 50 179.658 179.658 176.953 2.705 25149
3343 1 9 . 1 1 50 50 LEU CA C 50 57.330 57.330 55.138 2.192 25149
3344 1 9 . 1 1 50 50 LEU CB C 50 41.416 41.416 42.166 -0.750 25149
3345 1 9 . 1 1 50 50 LEU H H 50 8.512 8.512 7.818 0.694 25149
3346 1 9 . 1 1 51 51 HIS N N 51 115.650 115.650 117.243 -1.593 25149
3347 1 9 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.529 -0.255 25149
3348 1 9 . 1 1 51 51 HIS C C 51 175.942 175.942 175.885 0.057 25149
3349 1 9 . 1 1 51 51 HIS CA C 51 57.320 57.320 56.470 0.850 25149
3350 1 9 . 1 1 51 51 HIS CB C 51 29.487 29.487 30.250 -0.763 25149
3351 1 9 . 1 1 51 51 HIS H H 51 7.713 7.713 8.345 -0.632 25149
3352 1 9 . 1 1 52 52 ALA N N 52 119.779 119.779 121.320 -1.541 25149
3353 1 9 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.543 -0.520 25149
3354 1 9 . 1 1 52 52 ALA C C 52 177.834 177.834 177.499 0.335 25149
3355 1 9 . 1 1 52 52 ALA CA C 52 52.865 52.865 52.565 0.301 25149
3356 1 9 . 1 1 52 52 ALA CB C 52 18.951 18.951 19.905 -0.954 25149
3357 1 9 . 1 1 52 52 ALA H H 52 7.191 7.191 7.968 -0.777 25149
3358 1 9 . 1 1 53 53 GLN N N 53 117.047 117.047 118.243 -1.196 25149
3359 1 9 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.068 -0.135 25149
3360 1 9 . 1 1 53 53 GLN C C 53 175.998 175.998 175.983 0.015 25149
3361 1 9 . 1 1 53 53 GLN CA C 53 55.482 55.482 56.723 -1.241 25149
3362 1 9 . 1 1 53 53 GLN CB C 53 28.887 28.887 28.788 0.099 25149
3363 1 9 . 1 1 53 53 GLN H H 53 7.317 7.317 7.899 -0.582 25149
3364 1 9 . 1 1 54 54 GLN N N 54 118.463 118.463 117.972 0.491 25149
3365 1 9 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.259 -0.270 25149
3366 1 9 . 1 1 54 54 GLN C C 54 176.300 176.300 176.777 -0.477 25149
3367 1 9 . 1 1 54 54 GLN CA C 54 57.314 57.314 55.913 1.401 25149
3368 1 9 . 1 1 54 54 GLN CB C 54 28.823 28.823 29.030 -0.207 25149
3369 1 9 . 1 1 54 54 GLN H H 54 7.949 7.949 8.448 -0.499 25149
3370 1 9 . 1 1 55 55 VAL N N 55 116.755 116.755 118.307 -1.552 25149
3371 1 9 . 1 1 55 55 VAL HA H 55 3.884 3.884 3.920 -0.036 25149
3372 1 9 . 1 1 55 55 VAL C C 55 175.774 175.774 175.718 0.056 25149
3373 1 9 . 1 1 55 55 VAL CA C 55 63.210 63.210 61.850 1.360 25149
3374 1 9 . 1 1 55 55 VAL CB C 55 32.870 32.870 32.155 0.715 25149
3375 1 9 . 1 1 55 55 VAL H H 55 7.801 7.801 7.475 0.326 25149
3376 1 9 . 1 1 56 56 GLN N N 56 120.192 120.192 118.403 1.789 25149
3377 1 9 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.276 -0.159 25149
3378 1 9 . 1 1 56 56 GLN C C 56 175.236 175.236 176.334 -1.098 25149
3379 1 9 . 1 1 56 56 GLN CA C 56 55.697 55.697 55.947 -0.250 25149
3380 1 9 . 1 1 56 56 GLN CB C 56 29.319 29.319 29.328 -0.009 25149
3381 1 9 . 1 1 56 56 GLN H H 56 8.018 8.018 8.355 -0.337 25149
3382 1 9 . 1 1 57 57 GLN N N 57 121.276 121.276 117.583 3.693 25149
3383 1 9 . 1 1 57 57 GLN HA H 57 4.204 4.204 4.009 0.195 25149
3384 1 9 . 1 1 57 57 GLN C C 57 175.819 175.819 175.908 -0.089 25149
3385 1 9 . 1 1 57 57 GLN CA C 57 55.617 55.617 56.667 -1.050 25149
3386 1 9 . 1 1 57 57 GLN CB C 57 29.094 29.094 28.668 0.426 25149
3387 1 9 . 1 1 57 57 GLN H H 57 8.471 8.471 8.640 -0.169 25149
3388 1 9 . 1 1 58 58 HIS N N 58 120.001 120.001 118.517 1.484 25149
3389 1 9 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.316 0.858 25149
3390 1 9 . 1 1 58 58 HIS C C 58 173.636 173.636 176.152 -2.516 25149
3391 1 9 . 1 1 58 58 HIS CA C 58 54.353 54.353 57.342 -2.989 25149
3392 1 9 . 1 1 58 58 HIS CB C 58 33.057 33.057 29.509 3.548 25149
3393 1 9 . 1 1 58 58 HIS H H 58 8.366 8.366 7.764 0.602 25149
3394 1 9 . 1 1 59 59 CYS N N 59 121.924 121.924 122.536 -0.612 25149
3395 1 9 . 1 1 59 59 CYS HA H 59 4.442 4.442 4.094 0.348 25149
3396 1 9 . 1 1 59 59 CYS C C 59 176.334 176.334 174.862 1.472 25149
3397 1 9 . 1 1 59 59 CYS CA C 59 56.772 56.772 61.839 -5.067 25149
3398 1 9 . 1 1 59 59 CYS CB C 59 32.642 32.642 28.277 4.365 25149
3399 1 9 . 1 1 59 59 CYS H H 59 9.035 9.035 8.339 0.696 25149
3400 1 9 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.368 -0.555 25149
3401 1 9 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.914 -0.253 25149
3402 1 9 . 1 1 60 60 PRO CB C 60 30.659 30.659 31.154 -0.495 25149
3403 1 9 . 1 1 61 61 MET N N 61 117.676 117.676 115.956 1.720 25149
3404 1 9 . 1 1 61 61 MET HA H 61 4.317 4.317 4.451 -0.134 25149
3405 1 9 . 1 1 61 61 MET C C 61 177.117 177.117 176.341 0.776 25149
3406 1 9 . 1 1 61 61 MET CA C 61 56.408 56.408 56.650 -0.242 25149
3407 1 9 . 1 1 61 61 MET CB C 61 32.551 32.551 33.408 -0.857 25149
3408 1 9 . 1 1 61 61 MET H H 61 9.135 9.135 7.534 1.601 25149
3409 1 9 . 1 1 62 62 CYS N N 62 117.214 117.214 118.639 -1.425 25149
3410 1 9 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.399 0.475 25149
3411 1 9 . 1 1 62 62 CYS C C 62 175.740 175.740 175.312 0.428 25149
3412 1 9 . 1 1 62 62 CYS CA C 62 58.273 58.273 58.827 -0.554 25149
3413 1 9 . 1 1 62 62 CYS CB C 62 32.776 32.776 27.954 4.822 25149
3414 1 9 . 1 1 62 62 CYS H H 62 8.011 8.011 8.100 -0.089 25149
3415 1 9 . 1 1 63 63 ARG N N 63 116.555 116.555 119.018 -2.463 25149
3416 1 9 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.314 -0.389 25149
3417 1 9 . 1 1 63 63 ARG C C 63 175.326 175.326 175.833 -0.507 25149
3418 1 9 . 1 1 63 63 ARG CA C 63 58.073 58.073 56.118 1.955 25149
3419 1 9 . 1 1 63 63 ARG CB C 63 27.136 27.136 30.574 -3.438 25149
3420 1 9 . 1 1 63 63 ARG H H 63 8.086 8.086 8.297 -0.211 25149
3421 1 9 . 1 1 64 64 GLN N N 64 118.932 118.932 117.768 1.164 25149
3422 1 9 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.491 -0.232 25149
3423 1 9 . 1 1 64 64 GLN C C 64 176.054 176.054 176.276 -0.222 25149
3424 1 9 . 1 1 64 64 GLN CA C 64 56.316 56.316 54.726 1.590 25149
3425 1 9 . 1 1 64 64 GLN CB C 64 30.083 30.083 28.971 1.112 25149
3426 1 9 . 1 1 64 64 GLN H H 64 8.003 8.003 7.970 0.033 25149
3427 1 9 . 1 1 65 65 GLU N N 65 122.038 122.038 121.707 0.331 25149
3428 1 9 . 1 1 65 65 GLU HA H 65 4.003 4.003 4.249 -0.246 25149
3429 1 9 . 1 1 65 65 GLU C C 65 176.781 176.781 176.644 0.137 25149
3430 1 9 . 1 1 65 65 GLU CA C 65 57.682 57.682 56.470 1.212 25149
3431 1 9 . 1 1 65 65 GLU CB C 65 29.900 29.900 29.303 0.597 25149
3432 1 9 . 1 1 65 65 GLU H H 65 8.657 8.657 8.746 -0.089 25149
3433 1 9 . 1 1 66 66 TRP N N 66 125.730 125.730 127.207 -1.477 25149
3434 1 9 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.270 0.134 25149
3435 1 9 . 1 1 66 66 TRP C C 66 175.460 175.460 175.147 0.313 25149
3436 1 9 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.617 0.008 25149
3437 1 9 . 1 1 66 66 TRP CB C 66 29.358 29.358 30.095 -0.737 25149
3438 1 9 . 1 1 66 66 TRP H H 66 8.499 8.499 8.272 0.227 25149
3439 1 9 . 1 1 67 67 LYS N N 67 127.396 127.396 127.062 0.334 25149
3440 1 9 . 1 1 67 67 LYS HA H 67 4.018 4.018 3.972 0.046 25149
3441 1 9 . 1 1 67 67 LYS C C 67 175.180 175.180 175.102 0.078 25149
3442 1 9 . 1 1 67 67 LYS CA C 67 54.514 54.514 53.419 1.095 25149
3443 1 9 . 1 1 67 67 LYS CB C 67 36.231 36.231 35.355 0.876 25149
3444 1 9 . 1 1 67 67 LYS H H 67 6.930 6.930 8.432 -1.502 25149
3445 1 9 . 1 1 68 68 PHE N N 68 121.511 121.511 124.376 -2.865 25149
3446 1 9 . 1 1 68 68 PHE HA H 68 4.108 4.108 4.036 0.072 25149
3447 1 9 . 1 1 68 68 PHE C C 68 176.613 176.613 175.335 1.278 25149
3448 1 9 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.271 2.690 25149
3449 1 9 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.289 1.973 25149
3450 1 9 . 1 1 68 68 PHE H H 68 8.430 8.430 8.397 0.033 25149
3451 1 9 . 1 1 69 69 LYS N N 69 124.210 124.210 122.327 1.883 25149
3452 1 9 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.167 -0.172 25149
3453 1 9 . 1 1 69 69 LYS C C 69 175.651 175.651 176.072 -0.421 25149
3454 1 9 . 1 1 69 69 LYS CA C 69 57.320 57.320 56.639 0.681 25149
3455 1 9 . 1 1 69 69 LYS CB C 69 33.361 33.361 34.062 -0.701 25149
3456 1 9 . 1 1 69 69 LYS H H 69 8.738 8.738 8.120 0.618 25149
3457 1 10 . 1 1 2 2 SER HA H 2 4.417 4.417 4.555 -0.138 25149
3458 1 10 . 1 1 2 2 SER CA C 2 58.322 58.322 58.456 -0.134 25149
3459 1 10 . 1 1 2 2 SER CB C 2 64.169 64.169 63.402 0.767 25149
3460 1 10 . 1 1 3 3 VAL N N 3 121.214 121.214 125.604 -4.390 25149
3461 1 10 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.244 -0.198 25149
3462 1 10 . 1 1 3 3 VAL C C 3 175.879 175.879 176.321 -0.442 25149
3463 1 10 . 1 1 3 3 VAL CA C 3 62.138 62.138 62.602 -0.464 25149
3464 1 10 . 1 1 3 3 VAL CB C 3 32.958 32.958 32.192 0.766 25149
3465 1 10 . 1 1 3 3 VAL H H 3 8.170 8.170 8.691 -0.521 25149
3466 1 10 . 1 1 4 4 ALA N N 4 127.312 127.312 122.447 4.865 25149
3467 1 10 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.480 -0.283 25149
3468 1 10 . 1 1 4 4 ALA C C 4 177.497 177.497 176.592 0.905 25149
3469 1 10 . 1 1 4 4 ALA CA C 4 52.439 52.439 52.227 0.212 25149
3470 1 10 . 1 1 4 4 ALA CB C 4 19.424 19.424 19.350 0.074 25149
3471 1 10 . 1 1 4 4 ALA H H 4 8.294 8.294 8.002 0.292 25149
3472 1 10 . 1 1 5 5 ASN N N 5 117.674 117.674 118.555 -0.881 25149
3473 1 10 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.793 -0.228 25149
3474 1 10 . 1 1 5 5 ASN C C 5 175.048 175.048 174.469 0.579 25149
3475 1 10 . 1 1 5 5 ASN CA C 5 53.725 53.725 53.021 0.704 25149
3476 1 10 . 1 1 5 5 ASN CB C 5 39.197 39.197 39.310 -0.113 25149
3477 1 10 . 1 1 5 5 ASN H H 5 8.252 8.252 8.046 0.206 25149
3478 1 10 . 1 1 6 6 ASP N N 6 119.896 119.896 122.439 -2.543 25149
3479 1 10 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.657 -0.137 25149
3480 1 10 . 1 1 6 6 ASP C C 6 176.269 176.269 176.176 0.093 25149
3481 1 10 . 1 1 6 6 ASP CA C 6 54.497 54.497 53.908 0.589 25149
3482 1 10 . 1 1 6 6 ASP CB C 6 41.104 41.104 41.101 0.003 25149
3483 1 10 . 1 1 6 6 ASP H H 6 8.215 8.215 8.673 -0.458 25149
3484 1 10 . 1 1 7 7 GLU N N 7 119.101 119.101 116.107 2.994 25149
3485 1 10 . 1 1 7 7 GLU HA H 7 4.243 4.243 4.280 -0.037 25149
3486 1 10 . 1 1 7 7 GLU C C 7 175.006 175.006 175.013 -0.007 25149
3487 1 10 . 1 1 7 7 GLU CA C 7 56.689 56.689 56.512 0.177 25149
3488 1 10 . 1 1 7 7 GLU CB C 7 30.379 30.379 29.131 1.248 25149
3489 1 10 . 1 1 7 7 GLU H H 7 8.065 8.065 8.092 -0.027 25149
3490 1 10 . 1 1 8 8 ASN N N 8 116.852 116.852 116.987 -0.135 25149
3491 1 10 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.301 -0.143 25149
3492 1 10 . 1 1 8 8 ASN C C 8 172.706 172.706 174.932 -2.226 25149
3493 1 10 . 1 1 8 8 ASN CA C 8 51.165 51.165 51.943 -0.778 25149
3494 1 10 . 1 1 8 8 ASN CB C 8 40.702 40.702 39.550 1.152 25149
3495 1 10 . 1 1 8 8 ASN H H 8 7.505 7.505 7.393 0.112 25149
3496 1 10 . 1 1 9 9 CYS N N 9 122.855 122.855 121.490 1.365 25149
3497 1 10 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.717 0.077 25149
3498 1 10 . 1 1 9 9 CYS C C 9 178.370 178.370 176.471 1.899 25149
3499 1 10 . 1 1 9 9 CYS CA C 9 59.552 59.552 60.877 -1.325 25149
3500 1 10 . 1 1 9 9 CYS CB C 9 31.526 31.526 28.961 2.565 25149
3501 1 10 . 1 1 9 9 CYS H H 9 7.614 7.614 7.434 0.180 25149
3502 1 10 . 1 1 10 10 GLY N N 10 117.295 117.295 111.616 5.679 25149
3503 1 10 . 1 1 10 10 GLY C C 10 174.111 174.111 174.786 -0.675 25149
3504 1 10 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.732 1.235 25149
3505 1 10 . 1 1 10 10 GLY H H 10 9.235 9.235 7.878 1.357 25149
3506 1 10 . 1 1 11 11 ILE N N 11 119.811 119.811 122.287 -2.476 25149
3507 1 10 . 1 1 11 11 ILE HA H 11 3.809 3.809 4.034 -0.225 25149
3508 1 10 . 1 1 11 11 ILE C C 11 176.121 176.121 176.700 -0.579 25149
3509 1 10 . 1 1 11 11 ILE CA C 11 64.041 64.041 63.807 0.234 25149
3510 1 10 . 1 1 11 11 ILE CB C 11 39.411 39.411 38.782 0.629 25149
3511 1 10 . 1 1 11 11 ILE H H 11 8.285 8.285 7.702 0.583 25149
3512 1 10 . 1 1 12 12 CYS N N 12 116.728 116.728 117.076 -0.348 25149
3513 1 10 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.738 -0.162 25149
3514 1 10 . 1 1 12 12 CYS C C 12 175.975 175.975 173.898 2.077 25149
3515 1 10 . 1 1 12 12 CYS CA C 12 59.225 59.225 56.580 2.645 25149
3516 1 10 . 1 1 12 12 CYS CB C 12 32.246 32.246 29.367 2.879 25149
3517 1 10 . 1 1 12 12 CYS H H 12 7.607 7.607 7.459 0.148 25149
3518 1 10 . 1 1 13 13 ARG N N 13 116.073 116.073 116.075 -0.002 25149
3519 1 10 . 1 1 13 13 ARG HA H 13 3.742 3.742 4.046 -0.304 25149
3520 1 10 . 1 1 13 13 ARG C C 13 174.979 174.979 174.800 0.179 25149
3521 1 10 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.490 1.146 25149
3522 1 10 . 1 1 13 13 ARG CB C 13 26.326 26.326 26.786 -0.460 25149
3523 1 10 . 1 1 13 13 ARG H H 13 7.987 7.987 8.223 -0.236 25149
3524 1 10 . 1 1 14 14 MET N N 14 119.313 119.313 119.089 0.224 25149
3525 1 10 . 1 1 14 14 MET HA H 14 4.547 4.547 4.505 0.042 25149
3526 1 10 . 1 1 14 14 MET C C 14 176.143 176.143 175.577 0.566 25149
3527 1 10 . 1 1 14 14 MET CA C 14 54.208 54.208 53.928 0.280 25149
3528 1 10 . 1 1 14 14 MET CB C 14 33.951 33.951 34.506 -0.555 25149
3529 1 10 . 1 1 14 14 MET H H 14 8.624 8.624 7.590 1.034 25149
3530 1 10 . 1 1 15 15 ALA N N 15 122.683 122.683 129.791 -7.108 25149
3531 1 10 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.050 0.222 25149
3532 1 10 . 1 1 15 15 ALA C C 15 180.117 180.117 178.258 1.859 25149
3533 1 10 . 1 1 15 15 ALA CA C 15 52.346 52.346 52.203 0.143 25149
3534 1 10 . 1 1 15 15 ALA CB C 15 19.487 19.487 19.073 0.414 25149
3535 1 10 . 1 1 15 15 ALA H H 15 7.965 7.965 8.434 -0.469 25149
3536 1 10 . 1 1 16 16 PHE N N 16 119.313 119.313 120.600 -1.287 25149
3537 1 10 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.059 -0.018 25149
3538 1 10 . 1 1 16 16 PHE C C 16 176.423 176.423 176.495 -0.072 25149
3539 1 10 . 1 1 16 16 PHE CA C 16 59.130 59.130 59.395 -0.265 25149
3540 1 10 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.448 -0.058 25149
3541 1 10 . 1 1 16 16 PHE H H 16 8.095 8.095 8.107 -0.012 25149
3542 1 10 . 1 1 17 17 ASN N N 17 112.313 112.313 116.439 -4.126 25149
3543 1 10 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.849 -0.213 25149
3544 1 10 . 1 1 17 17 ASN C C 17 175.337 175.337 175.026 0.311 25149
3545 1 10 . 1 1 17 17 ASN CA C 17 52.961 52.961 53.418 -0.457 25149
3546 1 10 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.574 -1.400 25149
3547 1 10 . 1 1 17 17 ASN H H 17 7.823 7.823 8.107 -0.284 25149
3548 1 10 . 1 1 18 18 GLY N N 18 107.742 107.742 108.678 -0.936 25149
3549 1 10 . 1 1 18 18 GLY C C 18 173.759 173.759 172.522 1.237 25149
3550 1 10 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.716 -0.252 25149
3551 1 10 . 1 1 18 18 GLY H H 18 7.579 7.579 8.434 -0.855 25149
3552 1 10 . 1 1 19 19 CYS N N 19 117.050 117.050 117.722 -0.672 25149
3553 1 10 . 1 1 19 19 CYS HA H 19 4.571 4.571 4.839 -0.268 25149
3554 1 10 . 1 1 19 19 CYS C C 19 174.039 174.039 175.062 -1.023 25149
3555 1 10 . 1 1 19 19 CYS CA C 19 58.433 58.433 55.883 2.550 25149
3556 1 10 . 1 1 19 19 CYS CB C 19 30.681 30.681 29.270 1.411 25149
3557 1 10 . 1 1 19 19 CYS H H 19 8.198 8.198 8.329 -0.131 25149
3558 1 10 . 1 1 20 20 CYS N N 20 123.923 123.923 123.354 0.569 25149
3559 1 10 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.225 -0.214 25149
3560 1 10 . 1 1 20 20 CYS C C 20 173.736 173.736 175.178 -1.442 25149
3561 1 10 . 1 1 20 20 CYS CA C 20 57.999 57.999 59.238 -1.239 25149
3562 1 10 . 1 1 20 20 CYS CB C 20 28.205 28.205 26.825 1.380 25149
3563 1 10 . 1 1 20 20 CYS H H 20 8.466 8.466 8.253 0.213 25149
3564 1 10 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.235 -0.206 25149
3565 1 10 . 1 1 21 21 PRO CA C 21 65.426 65.426 65.118 0.308 25149
3566 1 10 . 1 1 21 21 PRO CB C 21 32.801 32.801 32.295 0.506 25149
3567 1 10 . 1 1 22 22 ASP N N 22 117.053 117.053 117.463 -0.410 25149
3568 1 10 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.485 0.020 25149
3569 1 10 . 1 1 22 22 ASP C C 22 176.501 176.501 175.941 0.560 25149
3570 1 10 . 1 1 22 22 ASP CA C 22 55.017 55.017 54.738 0.279 25149
3571 1 10 . 1 1 22 22 ASP CB C 22 42.522 42.522 39.904 2.618 25149
3572 1 10 . 1 1 22 22 ASP H H 22 8.395 8.395 8.427 -0.032 25149
3573 1 10 . 1 1 23 23 CYS N N 23 123.353 123.353 118.922 4.431 25149
3574 1 10 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.406 -0.113 25149
3575 1 10 . 1 1 23 23 CYS C C 23 175.214 175.214 175.210 0.004 25149
3576 1 10 . 1 1 23 23 CYS CA C 23 61.633 61.633 58.867 2.766 25149
3577 1 10 . 1 1 23 23 CYS CB C 23 31.542 31.542 28.332 3.210 25149
3578 1 10 . 1 1 23 23 CYS H H 23 7.246 7.246 7.565 -0.319 25149
3579 1 10 . 1 1 24 24 LYS N N 24 117.539 117.539 127.182 -9.643 25149
3580 1 10 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.039 0.191 25149
3581 1 10 . 1 1 24 24 LYS C C 24 177.106 177.106 176.407 0.699 25149
3582 1 10 . 1 1 24 24 LYS CA C 24 56.921 56.921 56.806 0.115 25149
3583 1 10 . 1 1 24 24 LYS CB C 24 34.615 34.615 32.559 2.057 25149
3584 1 10 . 1 1 24 24 LYS H H 24 8.173 8.173 8.554 -0.381 25149
3585 1 10 . 1 1 25 25 VAL N N 25 120.661 120.661 119.591 1.070 25149
3586 1 10 . 1 1 25 25 VAL HA H 25 4.429 4.429 3.875 0.554 25149
3587 1 10 . 1 1 25 25 VAL C C 25 174.027 174.027 174.514 -0.487 25149
3588 1 10 . 1 1 25 25 VAL CA C 25 59.934 59.934 62.501 -2.567 25149
3589 1 10 . 1 1 25 25 VAL CB C 25 33.507 33.507 31.802 1.705 25149
3590 1 10 . 1 1 25 25 VAL H H 25 7.787 7.787 7.653 0.134 25149
3591 1 10 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.384 -0.048 25149
3592 1 10 . 1 1 26 26 PRO CA C 26 63.279 63.279 63.386 -0.107 25149
3593 1 10 . 1 1 26 26 PRO CB C 26 32.077 32.077 32.328 -0.251 25149
3594 1 10 . 1 1 27 27 GLY N N 27 109.926 109.926 107.267 2.659 25149
3595 1 10 . 1 1 27 27 GLY C C 27 175.169 175.169 173.368 1.801 25149
3596 1 10 . 1 1 27 27 GLY CA C 27 45.042 45.042 45.194 -0.152 25149
3597 1 10 . 1 1 27 27 GLY H H 27 8.569 8.569 7.732 0.837 25149
3598 1 10 . 1 1 28 28 ASP N N 28 122.592 122.592 119.780 2.812 25149
3599 1 10 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.764 -0.533 25149
3600 1 10 . 1 1 28 28 ASP C C 28 176.602 176.602 175.436 1.166 25149
3601 1 10 . 1 1 28 28 ASP CA C 28 56.402 56.402 54.313 2.089 25149
3602 1 10 . 1 1 28 28 ASP CB C 28 40.912 40.912 42.148 -1.236 25149
3603 1 10 . 1 1 28 28 ASP H H 28 8.214 8.214 8.281 -0.067 25149
3604 1 10 . 1 1 29 29 ASP N N 29 117.500 117.500 122.366 -4.866 25149
3605 1 10 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.661 -0.214 25149
3606 1 10 . 1 1 29 29 ASP C C 29 175.505 175.505 176.070 -0.565 25149
3607 1 10 . 1 1 29 29 ASP CA C 29 55.266 55.266 54.631 0.635 25149
3608 1 10 . 1 1 29 29 ASP CB C 29 41.225 41.225 39.920 1.305 25149
3609 1 10 . 1 1 29 29 ASP H H 29 8.271 8.271 8.395 -0.124 25149
3610 1 10 . 1 1 30 30 CYS N N 30 124.470 124.470 122.652 1.818 25149
3611 1 10 . 1 1 30 30 CYS HA H 30 4.390 4.390 5.077 -0.687 25149
3612 1 10 . 1 1 30 30 CYS C C 30 171.755 171.755 172.717 -0.962 25149
3613 1 10 . 1 1 30 30 CYS CA C 30 57.676 57.676 55.823 1.853 25149
3614 1 10 . 1 1 30 30 CYS CB C 30 29.154 29.154 27.914 1.240 25149
3615 1 10 . 1 1 30 30 CYS H H 30 7.912 7.912 8.308 -0.396 25149
3616 1 10 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.617 0.070 25149
3617 1 10 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.650 0.225 25149
3618 1 10 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.287 1.697 25149
3619 1 10 . 1 1 32 32 LEU N N 32 120.023 120.023 116.643 3.380 25149
3620 1 10 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.536 0.180 25149
3621 1 10 . 1 1 32 32 LEU C C 32 176.300 176.300 175.291 1.009 25149
3622 1 10 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.666 0.255 25149
3623 1 10 . 1 1 32 32 LEU CB C 32 43.336 43.336 44.290 -0.954 25149
3624 1 10 . 1 1 32 32 LEU H H 32 8.580 8.580 8.017 0.563 25149
3625 1 10 . 1 1 33 33 VAL N N 33 116.217 116.217 117.260 -1.043 25149
3626 1 10 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.648 0.015 25149
3627 1 10 . 1 1 33 33 VAL C C 33 171.374 171.374 174.370 -2.996 25149
3628 1 10 . 1 1 33 33 VAL CA C 33 60.449 60.449 60.717 -0.268 25149
3629 1 10 . 1 1 33 33 VAL CB C 33 36.448 36.448 34.769 1.679 25149
3630 1 10 . 1 1 33 33 VAL H H 33 8.594 8.594 8.024 0.570 25149
3631 1 10 . 1 1 34 34 TRP N N 34 122.711 122.711 122.716 -0.005 25149
3632 1 10 . 1 1 34 34 TRP HA H 34 5.339 5.339 5.179 0.160 25149
3633 1 10 . 1 1 34 34 TRP C C 34 176.770 176.770 175.779 0.991 25149
3634 1 10 . 1 1 34 34 TRP CA C 34 57.267 57.267 55.631 1.636 25149
3635 1 10 . 1 1 34 34 TRP CB C 34 33.780 33.780 33.684 0.096 25149
3636 1 10 . 1 1 34 34 TRP H H 34 8.756 8.756 8.751 0.005 25149
3637 1 10 . 1 1 35 35 GLY N N 35 107.569 107.569 106.898 0.671 25149
3638 1 10 . 1 1 35 35 GLY C C 35 177.397 177.397 173.800 3.597 25149
3639 1 10 . 1 1 35 35 GLY CA C 35 44.070 44.070 44.096 -0.026 25149
3640 1 10 . 1 1 35 35 GLY H H 35 8.857 8.857 8.487 0.370 25149
3641 1 10 . 1 1 36 36 GLN N N 36 122.723 122.723 117.668 5.055 25149
3642 1 10 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.085 -0.339 25149
3643 1 10 . 1 1 36 36 GLN C C 36 176.445 176.445 176.390 0.055 25149
3644 1 10 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.067 0.362 25149
3645 1 10 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.392 -0.761 25149
3646 1 10 . 1 1 36 36 GLN H H 36 8.338 8.338 8.583 -0.245 25149
3647 1 10 . 1 1 37 37 CYS N N 37 115.763 115.763 113.617 2.146 25149
3648 1 10 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.915 -0.631 25149
3649 1 10 . 1 1 37 37 CYS C C 37 175.281 175.281 175.721 -0.440 25149
3650 1 10 . 1 1 37 37 CYS CA C 37 58.395 58.395 56.190 2.205 25149
3651 1 10 . 1 1 37 37 CYS CB C 37 31.143 31.143 31.342 -0.199 25149
3652 1 10 . 1 1 37 37 CYS H H 37 7.622 7.622 7.811 -0.189 25149
3653 1 10 . 1 1 38 38 SER N N 38 114.540 114.540 114.900 -0.360 25149
3654 1 10 . 1 1 38 38 SER HA H 38 4.004 4.004 4.266 -0.262 25149
3655 1 10 . 1 1 38 38 SER C C 38 173.389 173.389 174.436 -1.047 25149
3656 1 10 . 1 1 38 38 SER CA C 38 62.285 62.285 61.066 1.219 25149
3657 1 10 . 1 1 38 38 SER H H 38 7.716 7.716 8.627 -0.911 25149
3658 1 10 . 1 1 39 39 HIS N N 39 121.947 121.947 121.734 0.213 25149
3659 1 10 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.339 0.105 25149
3660 1 10 . 1 1 39 39 HIS C C 39 172.326 172.326 173.629 -1.303 25149
3661 1 10 . 1 1 39 39 HIS CA C 39 61.320 61.320 57.139 4.181 25149
3662 1 10 . 1 1 39 39 HIS CB C 39 31.523 31.523 29.536 1.987 25149
3663 1 10 . 1 1 39 39 HIS H H 39 7.829 7.829 7.487 0.342 25149
3664 1 10 . 1 1 40 40 CYS N N 40 121.859 121.859 124.020 -2.161 25149
3665 1 10 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.593 0.016 25149
3666 1 10 . 1 1 40 40 CYS C C 40 171.900 171.900 172.451 -0.551 25149
3667 1 10 . 1 1 40 40 CYS CA C 40 55.791 55.791 55.091 0.700 25149
3668 1 10 . 1 1 40 40 CYS CB C 40 28.964 28.964 27.471 1.493 25149
3669 1 10 . 1 1 40 40 CYS H H 40 8.049 8.049 8.572 -0.523 25149
3670 1 10 . 1 1 41 41 PHE N N 41 120.690 120.690 120.672 0.018 25149
3671 1 10 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.684 0.493 25149
3672 1 10 . 1 1 41 41 PHE C C 41 176.613 176.613 174.885 1.728 25149
3673 1 10 . 1 1 41 41 PHE CA C 41 56.033 56.033 55.988 0.045 25149
3674 1 10 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.549 2.211 25149
3675 1 10 . 1 1 41 41 PHE H H 41 8.368 8.368 8.435 -0.067 25149
3676 1 10 . 1 1 42 42 HIS N N 42 117.057 117.057 122.845 -5.788 25149
3677 1 10 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.372 0.297 25149
3678 1 10 . 1 1 42 42 HIS C C 42 177.464 177.464 176.204 1.260 25149
3679 1 10 . 1 1 42 42 HIS CA C 42 60.425 60.425 58.251 2.174 25149
3680 1 10 . 1 1 42 42 HIS CB C 42 29.740 29.740 29.743 -0.003 25149
3681 1 10 . 1 1 42 42 HIS H H 42 8.384 8.384 8.992 -0.608 25149
3682 1 10 . 1 1 43 43 MET N N 43 128.543 128.543 125.941 2.602 25149
3683 1 10 . 1 1 43 43 MET HA H 43 3.965 3.965 4.004 -0.039 25149
3684 1 10 . 1 1 43 43 MET C C 43 177.845 177.845 177.413 0.432 25149
3685 1 10 . 1 1 43 43 MET CA C 43 59.209 59.209 60.536 -1.327 25149
3686 1 10 . 1 1 43 43 MET CB C 43 33.009 33.009 32.654 0.355 25149
3687 1 10 . 1 1 43 43 MET H H 43 9.439 9.439 7.894 1.545 25149
3688 1 10 . 1 1 44 44 HIS N N 44 116.500 116.500 117.220 -0.720 25149
3689 1 10 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.208 0.048 25149
3690 1 10 . 1 1 44 44 HIS C C 44 178.405 178.405 177.819 0.586 25149
3691 1 10 . 1 1 44 44 HIS CA C 44 58.793 58.793 59.264 -0.471 25149
3692 1 10 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.090 3.657 25149
3693 1 10 . 1 1 44 44 HIS H H 44 9.747 9.747 7.881 1.866 25149
3694 1 10 . 1 1 45 45 CYS N N 45 115.950 115.950 117.727 -1.777 25149
3695 1 10 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.107 -0.107 25149
3696 1 10 . 1 1 45 45 CYS C C 45 177.957 177.957 176.918 1.039 25149
3697 1 10 . 1 1 45 45 CYS CA C 45 62.923 62.923 64.072 -1.149 25149
3698 1 10 . 1 1 45 45 CYS CB C 45 29.102 29.102 26.823 2.279 25149
3699 1 10 . 1 1 45 45 CYS H H 45 6.845 6.845 8.354 -1.509 25149
3700 1 10 . 1 1 46 46 ILE N N 46 119.362 119.362 121.327 -1.965 25149
3701 1 10 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.731 -0.066 25149
3702 1 10 . 1 1 46 46 ILE C C 46 176.613 176.613 177.840 -1.227 25149
3703 1 10 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.498 -4.256 25149
3704 1 10 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.823 -0.504 25149
3705 1 10 . 1 1 46 46 ILE H H 46 7.816 7.816 8.016 -0.200 25149
3706 1 10 . 1 1 47 47 LEU N N 47 122.180 122.180 120.507 1.673 25149
3707 1 10 . 1 1 47 47 LEU HA H 47 3.873 3.873 4.149 -0.276 25149
3708 1 10 . 1 1 47 47 LEU C C 47 179.726 179.726 179.013 0.713 25149
3709 1 10 . 1 1 47 47 LEU CA C 47 58.633 58.633 59.085 -0.452 25149
3710 1 10 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.960 -0.837 25149
3711 1 10 . 1 1 47 47 LEU H H 47 8.266 8.266 8.667 -0.401 25149
3712 1 10 . 1 1 48 48 LYS N N 48 118.251 118.251 118.738 -0.487 25149
3713 1 10 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.225 -0.361 25149
3714 1 10 . 1 1 48 48 LYS C C 48 179.423 179.423 178.768 0.655 25149
3715 1 10 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.952 0.035 25149
3716 1 10 . 1 1 48 48 LYS CB C 48 32.765 32.765 32.118 0.647 25149
3717 1 10 . 1 1 48 48 LYS H H 48 7.147 7.147 8.458 -1.311 25149
3718 1 10 . 1 1 49 49 TRP N N 49 120.745 120.745 121.445 -0.700 25149
3719 1 10 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.338 -0.258 25149
3720 1 10 . 1 1 49 49 TRP C C 49 178.147 178.147 178.251 -0.104 25149
3721 1 10 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.797 -0.253 25149
3722 1 10 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.393 0.022 25149
3723 1 10 . 1 1 49 49 TRP H H 49 7.709 7.709 8.156 -0.447 25149
3724 1 10 . 1 1 50 50 LEU N N 50 117.236 117.236 117.238 -0.002 25149
3725 1 10 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.583 0.022 25149
3726 1 10 . 1 1 50 50 LEU C C 50 179.658 179.658 176.749 2.909 25149
3727 1 10 . 1 1 50 50 LEU CA C 50 57.330 57.330 55.193 2.137 25149
3728 1 10 . 1 1 50 50 LEU CB C 50 41.416 41.416 41.947 -0.531 25149
3729 1 10 . 1 1 50 50 LEU H H 50 8.512 8.512 7.885 0.627 25149
3730 1 10 . 1 1 51 51 HIS N N 51 115.650 115.650 117.742 -2.092 25149
3731 1 10 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.522 -0.248 25149
3732 1 10 . 1 1 51 51 HIS C C 51 175.942 175.942 175.677 0.265 25149
3733 1 10 . 1 1 51 51 HIS CA C 51 57.320 57.320 57.227 0.093 25149
3734 1 10 . 1 1 51 51 HIS CB C 51 29.487 29.487 30.395 -0.908 25149
3735 1 10 . 1 1 51 51 HIS H H 51 7.713 7.713 8.324 -0.611 25149
3736 1 10 . 1 1 52 52 ALA N N 52 119.779 119.779 121.284 -1.505 25149
3737 1 10 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.350 -0.327 25149
3738 1 10 . 1 1 52 52 ALA C C 52 177.834 177.834 177.392 0.442 25149
3739 1 10 . 1 1 52 52 ALA CA C 52 52.865 52.865 52.318 0.548 25149
3740 1 10 . 1 1 52 52 ALA CB C 52 18.951 18.951 20.267 -1.315 25149
3741 1 10 . 1 1 52 52 ALA H H 52 7.191 7.191 7.815 -0.624 25149
3742 1 10 . 1 1 53 53 GLN N N 53 117.047 117.047 118.426 -1.379 25149
3743 1 10 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.167 -0.234 25149
3744 1 10 . 1 1 53 53 GLN C C 53 175.998 175.998 175.079 0.919 25149
3745 1 10 . 1 1 53 53 GLN CA C 53 55.482 55.482 56.354 -0.872 25149
3746 1 10 . 1 1 53 53 GLN CB C 53 28.887 28.887 29.152 -0.265 25149
3747 1 10 . 1 1 53 53 GLN H H 53 7.317 7.317 7.605 -0.288 25149
3748 1 10 . 1 1 54 54 GLN N N 54 118.463 118.463 119.191 -0.728 25149
3749 1 10 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.421 -0.432 25149
3750 1 10 . 1 1 54 54 GLN C C 54 176.300 176.300 176.143 0.157 25149
3751 1 10 . 1 1 54 54 GLN CA C 54 57.314 57.314 55.953 1.361 25149
3752 1 10 . 1 1 54 54 GLN CB C 54 28.823 28.823 29.125 -0.302 25149
3753 1 10 . 1 1 54 54 GLN H H 54 7.949 7.949 8.635 -0.686 25149
3754 1 10 . 1 1 55 55 VAL N N 55 116.755 116.755 116.657 0.098 25149
3755 1 10 . 1 1 55 55 VAL HA H 55 3.884 3.884 4.034 -0.150 25149
3756 1 10 . 1 1 55 55 VAL C C 55 175.774 175.774 175.496 0.278 25149
3757 1 10 . 1 1 55 55 VAL CA C 55 63.210 63.210 62.502 0.708 25149
3758 1 10 . 1 1 55 55 VAL CB C 55 32.870 32.870 32.353 0.516 25149
3759 1 10 . 1 1 55 55 VAL H H 55 7.801 7.801 7.749 0.052 25149
3760 1 10 . 1 1 56 56 GLN N N 56 120.192 120.192 118.805 1.387 25149
3761 1 10 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.575 -0.458 25149
3762 1 10 . 1 1 56 56 GLN C C 56 175.236 175.236 174.676 0.560 25149
3763 1 10 . 1 1 56 56 GLN CA C 56 55.697 55.697 55.232 0.465 25149
3764 1 10 . 1 1 56 56 GLN CB C 56 29.319 29.319 31.420 -2.101 25149
3765 1 10 . 1 1 56 56 GLN H H 56 8.018 8.018 7.787 0.231 25149
3766 1 10 . 1 1 57 57 GLN N N 57 121.276 121.276 119.472 1.804 25149
3767 1 10 . 1 1 57 57 GLN HA H 57 4.204 4.204 4.138 0.066 25149
3768 1 10 . 1 1 57 57 GLN C C 57 175.819 175.819 175.433 0.386 25149
3769 1 10 . 1 1 57 57 GLN CA C 57 55.617 55.617 55.532 0.084 25149
3770 1 10 . 1 1 57 57 GLN CB C 57 29.094 29.094 29.104 -0.010 25149
3771 1 10 . 1 1 57 57 GLN H H 57 8.471 8.471 8.589 -0.118 25149
3772 1 10 . 1 1 58 58 HIS N N 58 120.001 120.001 119.347 0.654 25149
3773 1 10 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.546 0.628 25149
3774 1 10 . 1 1 58 58 HIS C C 58 173.636 173.636 176.322 -2.686 25149
3775 1 10 . 1 1 58 58 HIS CA C 58 54.353 54.353 57.162 -2.809 25149
3776 1 10 . 1 1 58 58 HIS CB C 58 33.057 33.057 29.368 3.689 25149
3777 1 10 . 1 1 58 58 HIS H H 58 8.366 8.366 7.977 0.389 25149
3778 1 10 . 1 1 59 59 CYS N N 59 121.924 121.924 121.816 0.108 25149
3779 1 10 . 1 1 59 59 CYS HA H 59 4.442 4.442 4.003 0.439 25149
3780 1 10 . 1 1 59 59 CYS C C 59 176.334 176.334 174.866 1.468 25149
3781 1 10 . 1 1 59 59 CYS CA C 59 56.772 56.772 61.097 -4.325 25149
3782 1 10 . 1 1 59 59 CYS CB C 59 32.642 32.642 28.309 4.332 25149
3783 1 10 . 1 1 59 59 CYS H H 59 9.035 9.035 8.883 0.152 25149
3784 1 10 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.301 -0.488 25149
3785 1 10 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.573 0.088 25149
3786 1 10 . 1 1 60 60 PRO CB C 60 30.659 30.659 30.997 -0.338 25149
3787 1 10 . 1 1 61 61 MET N N 61 117.676 117.676 114.311 3.365 25149
3788 1 10 . 1 1 61 61 MET HA H 61 4.317 4.317 4.388 -0.071 25149
3789 1 10 . 1 1 61 61 MET C C 61 177.117 177.117 177.312 -0.195 25149
3790 1 10 . 1 1 61 61 MET CA C 61 56.408 56.408 56.298 0.110 25149
3791 1 10 . 1 1 61 61 MET CB C 61 32.551 32.551 33.199 -0.648 25149
3792 1 10 . 1 1 61 61 MET H H 61 9.135 9.135 7.569 1.566 25149
3793 1 10 . 1 1 62 62 CYS N N 62 117.214 117.214 119.688 -2.474 25149
3794 1 10 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.304 0.570 25149
3795 1 10 . 1 1 62 62 CYS C C 62 175.740 175.740 175.638 0.102 25149
3796 1 10 . 1 1 62 62 CYS CA C 62 58.273 58.273 59.613 -1.340 25149
3797 1 10 . 1 1 62 62 CYS CB C 62 32.776 32.776 26.664 6.112 25149
3798 1 10 . 1 1 62 62 CYS H H 62 8.011 8.011 7.997 0.014 25149
3799 1 10 . 1 1 63 63 ARG N N 63 116.555 116.555 116.862 -0.307 25149
3800 1 10 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.180 -0.255 25149
3801 1 10 . 1 1 63 63 ARG C C 63 175.326 175.326 174.938 0.388 25149
3802 1 10 . 1 1 63 63 ARG CA C 63 58.073 58.073 57.624 0.449 25149
3803 1 10 . 1 1 63 63 ARG CB C 63 27.136 27.136 28.466 -1.330 25149
3804 1 10 . 1 1 63 63 ARG H H 63 8.086 8.086 7.615 0.471 25149
3805 1 10 . 1 1 64 64 GLN N N 64 118.932 118.932 117.313 1.619 25149
3806 1 10 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.663 -0.404 25149
3807 1 10 . 1 1 64 64 GLN C C 64 176.054 176.054 175.989 0.065 25149
3808 1 10 . 1 1 64 64 GLN CA C 64 56.316 56.316 54.766 1.550 25149
3809 1 10 . 1 1 64 64 GLN CB C 64 30.083 30.083 30.342 -0.259 25149
3810 1 10 . 1 1 64 64 GLN H H 64 8.003 8.003 8.003 -0.000 25149
3811 1 10 . 1 1 65 65 GLU N N 65 122.038 122.038 121.842 0.196 25149
3812 1 10 . 1 1 65 65 GLU HA H 65 4.003 4.003 4.188 -0.185 25149
3813 1 10 . 1 1 65 65 GLU C C 65 176.781 176.781 176.383 0.398 25149
3814 1 10 . 1 1 65 65 GLU CA C 65 57.682 57.682 56.542 1.140 25149
3815 1 10 . 1 1 65 65 GLU CB C 65 29.900 29.900 28.581 1.319 25149
3816 1 10 . 1 1 65 65 GLU H H 65 8.657 8.657 8.801 -0.144 25149
3817 1 10 . 1 1 66 66 TRP N N 66 125.730 125.730 127.800 -2.070 25149
3818 1 10 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.255 0.149 25149
3819 1 10 . 1 1 66 66 TRP C C 66 175.460 175.460 175.101 0.359 25149
3820 1 10 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.632 -0.007 25149
3821 1 10 . 1 1 66 66 TRP CB C 66 29.358 29.358 29.994 -0.636 25149
3822 1 10 . 1 1 66 66 TRP H H 66 8.499 8.499 7.955 0.544 25149
3823 1 10 . 1 1 67 67 LYS N N 67 127.396 127.396 127.437 -0.041 25149
3824 1 10 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.073 -0.055 25149
3825 1 10 . 1 1 67 67 LYS C C 67 175.180 175.180 175.227 -0.047 25149
3826 1 10 . 1 1 67 67 LYS CA C 67 54.514 54.514 53.489 1.025 25149
3827 1 10 . 1 1 67 67 LYS CB C 67 36.231 36.231 34.672 1.560 25149
3828 1 10 . 1 1 67 67 LYS H H 67 6.930 6.930 8.542 -1.612 25149
3829 1 10 . 1 1 68 68 PHE N N 68 121.511 121.511 125.167 -3.656 25149
3830 1 10 . 1 1 68 68 PHE HA H 68 4.108 4.108 3.910 0.198 25149
3831 1 10 . 1 1 68 68 PHE C C 68 176.613 176.613 175.102 1.511 25149
3832 1 10 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.795 2.166 25149
3833 1 10 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.595 1.667 25149
3834 1 10 . 1 1 68 68 PHE H H 68 8.430 8.430 8.537 -0.107 25149
3835 1 10 . 1 1 69 69 LYS N N 69 124.210 124.210 122.185 2.025 25149
3836 1 10 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.098 -0.103 25149
3837 1 10 . 1 1 69 69 LYS C C 69 175.651 175.651 176.375 -0.724 25149
3838 1 10 . 1 1 69 69 LYS CA C 69 57.320 57.320 57.078 0.242 25149
3839 1 10 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.595 -0.234 25149
3840 1 10 . 1 1 69 69 LYS H H 69 8.738 8.738 8.061 0.677 25149
3841 1 11 . 1 1 2 2 SER HA H 2 4.417 4.417 4.583 -0.166 25149
3842 1 11 . 1 1 2 2 SER CA C 2 58.322 58.322 58.275 0.047 25149
3843 1 11 . 1 1 2 2 SER CB C 2 64.169 64.169 63.156 1.013 25149
3844 1 11 . 1 1 3 3 VAL N N 3 121.214 121.214 126.735 -5.521 25149
3845 1 11 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.293 -0.247 25149
3846 1 11 . 1 1 3 3 VAL C C 3 175.879 175.879 176.160 -0.281 25149
3847 1 11 . 1 1 3 3 VAL CA C 3 62.138 62.138 62.036 0.102 25149
3848 1 11 . 1 1 3 3 VAL CB C 3 32.958 32.958 33.334 -0.376 25149
3849 1 11 . 1 1 3 3 VAL H H 3 8.170 8.170 8.419 -0.249 25149
3850 1 11 . 1 1 4 4 ALA N N 4 127.312 127.312 124.909 2.403 25149
3851 1 11 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.358 -0.161 25149
3852 1 11 . 1 1 4 4 ALA C C 4 177.497 177.497 176.556 0.941 25149
3853 1 11 . 1 1 4 4 ALA CA C 4 52.439 52.439 51.606 0.833 25149
3854 1 11 . 1 1 4 4 ALA CB C 4 19.424 19.424 18.875 0.549 25149
3855 1 11 . 1 1 4 4 ALA H H 4 8.294 8.294 8.117 0.177 25149
3856 1 11 . 1 1 5 5 ASN N N 5 117.674 117.674 117.428 0.246 25149
3857 1 11 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.567 -0.002 25149
3858 1 11 . 1 1 5 5 ASN C C 5 175.048 175.048 174.521 0.527 25149
3859 1 11 . 1 1 5 5 ASN CA C 5 53.725 53.725 54.289 -0.564 25149
3860 1 11 . 1 1 5 5 ASN CB C 5 39.197 39.197 38.834 0.363 25149
3861 1 11 . 1 1 5 5 ASN H H 5 8.252 8.252 7.865 0.387 25149
3862 1 11 . 1 1 6 6 ASP N N 6 119.896 119.896 124.291 -4.395 25149
3863 1 11 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.793 -0.273 25149
3864 1 11 . 1 1 6 6 ASP C C 6 176.269 176.269 175.398 0.871 25149
3865 1 11 . 1 1 6 6 ASP CA C 6 54.497 54.497 54.434 0.064 25149
3866 1 11 . 1 1 6 6 ASP CB C 6 41.104 41.104 41.498 -0.394 25149
3867 1 11 . 1 1 6 6 ASP H H 6 8.215 8.215 8.716 -0.501 25149
3868 1 11 . 1 1 7 7 GLU N N 7 119.101 119.101 118.465 0.636 25149
3869 1 11 . 1 1 7 7 GLU HA H 7 4.243 4.243 4.528 -0.285 25149
3870 1 11 . 1 1 7 7 GLU C C 7 175.006 175.006 174.751 0.255 25149
3871 1 11 . 1 1 7 7 GLU CA C 7 56.689 56.689 56.033 0.656 25149
3872 1 11 . 1 1 7 7 GLU CB C 7 30.379 30.379 29.782 0.597 25149
3873 1 11 . 1 1 7 7 GLU H H 7 8.065 8.065 8.214 -0.149 25149
3874 1 11 . 1 1 8 8 ASN N N 8 116.852 116.852 115.896 0.956 25149
3875 1 11 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.337 -0.179 25149
3876 1 11 . 1 1 8 8 ASN C C 8 172.706 172.706 175.318 -2.612 25149
3877 1 11 . 1 1 8 8 ASN CA C 8 51.165 51.165 51.369 -0.204 25149
3878 1 11 . 1 1 8 8 ASN CB C 8 40.702 40.702 38.842 1.861 25149
3879 1 11 . 1 1 8 8 ASN H H 8 7.505 7.505 7.710 -0.205 25149
3880 1 11 . 1 1 9 9 CYS N N 9 122.855 122.855 121.619 1.236 25149
3881 1 11 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.495 0.299 25149
3882 1 11 . 1 1 9 9 CYS C C 9 178.370 178.370 176.171 2.199 25149
3883 1 11 . 1 1 9 9 CYS CA C 9 59.552 59.552 61.249 -1.697 25149
3884 1 11 . 1 1 9 9 CYS CB C 9 31.526 31.526 28.786 2.740 25149
3885 1 11 . 1 1 9 9 CYS H H 9 7.614 7.614 7.941 -0.327 25149
3886 1 11 . 1 1 10 10 GLY N N 10 117.295 117.295 107.844 9.451 25149
3887 1 11 . 1 1 10 10 GLY C C 10 174.111 174.111 174.940 -0.829 25149
3888 1 11 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.620 1.347 25149
3889 1 11 . 1 1 10 10 GLY H H 10 9.235 9.235 7.847 1.388 25149
3890 1 11 . 1 1 11 11 ILE N N 11 119.811 119.811 118.074 1.737 25149
3891 1 11 . 1 1 11 11 ILE HA H 11 3.809 3.809 4.262 -0.453 25149
3892 1 11 . 1 1 11 11 ILE C C 11 176.121 176.121 176.001 0.120 25149
3893 1 11 . 1 1 11 11 ILE CA C 11 64.041 64.041 63.589 0.452 25149
3894 1 11 . 1 1 11 11 ILE CB C 11 39.411 39.411 39.131 0.280 25149
3895 1 11 . 1 1 11 11 ILE H H 11 8.285 8.285 7.271 1.014 25149
3896 1 11 . 1 1 12 12 CYS N N 12 116.728 116.728 117.841 -1.113 25149
3897 1 11 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.672 -0.096 25149
3898 1 11 . 1 1 12 12 CYS C C 12 175.975 175.975 173.971 2.004 25149
3899 1 11 . 1 1 12 12 CYS CA C 12 59.225 59.225 58.299 0.926 25149
3900 1 11 . 1 1 12 12 CYS CB C 12 32.246 32.246 30.289 1.957 25149
3901 1 11 . 1 1 12 12 CYS H H 12 7.607 7.607 7.865 -0.258 25149
3902 1 11 . 1 1 13 13 ARG N N 13 116.073 116.073 116.546 -0.473 25149
3903 1 11 . 1 1 13 13 ARG HA H 13 3.742 3.742 4.080 -0.338 25149
3904 1 11 . 1 1 13 13 ARG C C 13 174.979 174.979 174.857 0.122 25149
3905 1 11 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.639 0.998 25149
3906 1 11 . 1 1 13 13 ARG CB C 13 26.326 26.326 27.247 -0.921 25149
3907 1 11 . 1 1 13 13 ARG H H 13 7.987 7.987 8.023 -0.036 25149
3908 1 11 . 1 1 14 14 MET N N 14 119.313 119.313 117.261 2.052 25149
3909 1 11 . 1 1 14 14 MET HA H 14 4.547 4.547 4.534 0.013 25149
3910 1 11 . 1 1 14 14 MET C C 14 176.143 176.143 175.116 1.027 25149
3911 1 11 . 1 1 14 14 MET CA C 14 54.208 54.208 54.113 0.095 25149
3912 1 11 . 1 1 14 14 MET CB C 14 33.951 33.951 35.361 -1.410 25149
3913 1 11 . 1 1 14 14 MET H H 14 8.624 8.624 7.530 1.094 25149
3914 1 11 . 1 1 15 15 ALA N N 15 122.683 122.683 128.277 -5.594 25149
3915 1 11 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.112 0.160 25149
3916 1 11 . 1 1 15 15 ALA C C 15 180.117 180.117 178.639 1.478 25149
3917 1 11 . 1 1 15 15 ALA CA C 15 52.346 52.346 52.292 0.054 25149
3918 1 11 . 1 1 15 15 ALA CB C 15 19.487 19.487 19.152 0.335 25149
3919 1 11 . 1 1 15 15 ALA H H 15 7.965 7.965 8.387 -0.422 25149
3920 1 11 . 1 1 16 16 PHE N N 16 119.313 119.313 121.617 -2.304 25149
3921 1 11 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.370 -0.329 25149
3922 1 11 . 1 1 16 16 PHE C C 16 176.423 176.423 176.993 -0.570 25149
3923 1 11 . 1 1 16 16 PHE CA C 16 59.130 59.130 59.891 -0.761 25149
3924 1 11 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.489 -0.099 25149
3925 1 11 . 1 1 16 16 PHE H H 16 8.095 8.095 8.405 -0.310 25149
3926 1 11 . 1 1 17 17 ASN N N 17 112.313 112.313 116.352 -4.039 25149
3927 1 11 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.693 -0.057 25149
3928 1 11 . 1 1 17 17 ASN C C 17 175.337 175.337 175.846 -0.509 25149
3929 1 11 . 1 1 17 17 ASN CA C 17 52.961 52.961 54.770 -1.809 25149
3930 1 11 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.707 -1.533 25149
3931 1 11 . 1 1 17 17 ASN H H 17 7.823 7.823 8.345 -0.522 25149
3932 1 11 . 1 1 18 18 GLY N N 18 107.742 107.742 105.721 2.021 25149
3933 1 11 . 1 1 18 18 GLY C C 18 173.759 173.759 172.610 1.149 25149
3934 1 11 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.145 0.319 25149
3935 1 11 . 1 1 18 18 GLY H H 18 7.579 7.579 7.862 -0.283 25149
3936 1 11 . 1 1 19 19 CYS N N 19 117.050 117.050 118.119 -1.069 25149
3937 1 11 . 1 1 19 19 CYS HA H 19 4.571 4.571 4.739 -0.168 25149
3938 1 11 . 1 1 19 19 CYS C C 19 174.039 174.039 174.687 -0.648 25149
3939 1 11 . 1 1 19 19 CYS CA C 19 58.433 58.433 55.944 2.489 25149
3940 1 11 . 1 1 19 19 CYS CB C 19 30.681 30.681 30.608 0.073 25149
3941 1 11 . 1 1 19 19 CYS H H 19 8.198 8.198 8.305 -0.107 25149
3942 1 11 . 1 1 20 20 CYS N N 20 123.923 123.923 119.624 4.299 25149
3943 1 11 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.077 -0.066 25149
3944 1 11 . 1 1 20 20 CYS C C 20 173.736 173.736 174.502 -0.766 25149
3945 1 11 . 1 1 20 20 CYS CA C 20 57.999 57.999 58.897 -0.898 25149
3946 1 11 . 1 1 20 20 CYS CB C 20 28.205 28.205 26.213 1.992 25149
3947 1 11 . 1 1 20 20 CYS H H 20 8.466 8.466 8.637 -0.171 25149
3948 1 11 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.349 -0.320 25149
3949 1 11 . 1 1 21 21 PRO CA C 21 65.426 65.426 64.124 1.302 25149
3950 1 11 . 1 1 21 21 PRO CB C 21 32.801 32.801 32.140 0.661 25149
3951 1 11 . 1 1 22 22 ASP N N 22 117.053 117.053 119.103 -2.050 25149
3952 1 11 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.366 0.139 25149
3953 1 11 . 1 1 22 22 ASP C C 22 176.501 176.501 176.364 0.137 25149
3954 1 11 . 1 1 22 22 ASP CA C 22 55.017 55.017 55.830 -0.813 25149
3955 1 11 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.527 1.995 25149
3956 1 11 . 1 1 22 22 ASP H H 22 8.395 8.395 8.456 -0.061 25149
3957 1 11 . 1 1 23 23 CYS N N 23 123.353 123.353 117.194 6.159 25149
3958 1 11 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.279 0.014 25149
3959 1 11 . 1 1 23 23 CYS C C 23 175.214 175.214 175.655 -0.441 25149
3960 1 11 . 1 1 23 23 CYS CA C 23 61.633 61.633 59.437 2.196 25149
3961 1 11 . 1 1 23 23 CYS CB C 23 31.542 31.542 28.163 3.379 25149
3962 1 11 . 1 1 23 23 CYS H H 23 7.246 7.246 7.885 -0.639 25149
3963 1 11 . 1 1 24 24 LYS N N 24 117.539 117.539 127.934 -10.395 25149
3964 1 11 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.103 0.127 25149
3965 1 11 . 1 1 24 24 LYS C C 24 177.106 177.106 176.027 1.079 25149
3966 1 11 . 1 1 24 24 LYS CA C 24 56.921 56.921 57.626 -0.705 25149
3967 1 11 . 1 1 24 24 LYS CB C 24 34.615 34.615 32.394 2.221 25149
3968 1 11 . 1 1 24 24 LYS H H 24 8.173 8.173 8.351 -0.178 25149
3969 1 11 . 1 1 25 25 VAL N N 25 120.661 120.661 117.258 3.403 25149
3970 1 11 . 1 1 25 25 VAL HA H 25 4.429 4.429 3.886 0.543 25149
3971 1 11 . 1 1 25 25 VAL C C 25 174.027 174.027 174.148 -0.121 25149
3972 1 11 . 1 1 25 25 VAL CA C 25 59.934 59.934 62.066 -2.132 25149
3973 1 11 . 1 1 25 25 VAL CB C 25 33.507 33.507 29.462 4.045 25149
3974 1 11 . 1 1 25 25 VAL H H 25 7.787 7.787 7.665 0.122 25149
3975 1 11 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.421 -0.085 25149
3976 1 11 . 1 1 26 26 PRO CA C 26 63.279 63.279 63.854 -0.575 25149
3977 1 11 . 1 1 26 26 PRO CB C 26 32.077 32.077 32.473 -0.396 25149
3978 1 11 . 1 1 27 27 GLY N N 27 109.926 109.926 108.273 1.653 25149
3979 1 11 . 1 1 27 27 GLY C C 27 175.169 175.169 172.559 2.610 25149
3980 1 11 . 1 1 27 27 GLY CA C 27 45.042 45.042 45.443 -0.401 25149
3981 1 11 . 1 1 27 27 GLY H H 27 8.569 8.569 7.701 0.868 25149
3982 1 11 . 1 1 28 28 ASP N N 28 122.592 122.592 119.974 2.618 25149
3983 1 11 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.755 -0.524 25149
3984 1 11 . 1 1 28 28 ASP C C 28 176.602 176.602 175.413 1.189 25149
3985 1 11 . 1 1 28 28 ASP CA C 28 56.402 56.402 54.100 2.302 25149
3986 1 11 . 1 1 28 28 ASP CB C 28 40.912 40.912 41.765 -0.853 25149
3987 1 11 . 1 1 28 28 ASP H H 28 8.214 8.214 8.361 -0.147 25149
3988 1 11 . 1 1 29 29 ASP N N 29 117.500 117.500 121.852 -4.352 25149
3989 1 11 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.851 -0.404 25149
3990 1 11 . 1 1 29 29 ASP C C 29 175.505 175.505 175.225 0.280 25149
3991 1 11 . 1 1 29 29 ASP CA C 29 55.266 55.266 54.001 1.265 25149
3992 1 11 . 1 1 29 29 ASP CB C 29 41.225 41.225 40.223 1.002 25149
3993 1 11 . 1 1 29 29 ASP H H 29 8.271 8.271 8.334 -0.063 25149
3994 1 11 . 1 1 30 30 CYS N N 30 124.470 124.470 121.501 2.969 25149
3995 1 11 . 1 1 30 30 CYS HA H 30 4.390 4.390 4.869 -0.479 25149
3996 1 11 . 1 1 30 30 CYS C C 30 171.755 171.755 172.893 -1.138 25149
3997 1 11 . 1 1 30 30 CYS CA C 30 57.676 57.676 56.515 1.161 25149
3998 1 11 . 1 1 30 30 CYS CB C 30 29.154 29.154 29.206 -0.052 25149
3999 1 11 . 1 1 30 30 CYS H H 30 7.912 7.912 8.335 -0.423 25149
4000 1 11 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.498 0.189 25149
4001 1 11 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.764 0.111 25149
4002 1 11 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.388 1.596 25149
4003 1 11 . 1 1 32 32 LEU N N 32 120.023 120.023 115.711 4.312 25149
4004 1 11 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.767 -0.051 25149
4005 1 11 . 1 1 32 32 LEU C C 32 176.300 176.300 175.099 1.201 25149
4006 1 11 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.930 -0.009 25149
4007 1 11 . 1 1 32 32 LEU CB C 32 43.336 43.336 45.243 -1.907 25149
4008 1 11 . 1 1 32 32 LEU H H 32 8.580 8.580 8.065 0.515 25149
4009 1 11 . 1 1 33 33 VAL N N 33 116.217 116.217 119.394 -3.177 25149
4010 1 11 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.856 -0.193 25149
4011 1 11 . 1 1 33 33 VAL C C 33 171.374 171.374 174.108 -2.734 25149
4012 1 11 . 1 1 33 33 VAL CA C 33 60.449 60.449 59.823 0.626 25149
4013 1 11 . 1 1 33 33 VAL CB C 33 36.448 36.448 35.407 1.041 25149
4014 1 11 . 1 1 33 33 VAL H H 33 8.594 8.594 8.510 0.084 25149
4015 1 11 . 1 1 34 34 TRP N N 34 122.711 122.711 124.459 -1.748 25149
4016 1 11 . 1 1 34 34 TRP HA H 34 5.339 5.339 5.156 0.183 25149
4017 1 11 . 1 1 34 34 TRP C C 34 176.770 176.770 175.546 1.224 25149
4018 1 11 . 1 1 34 34 TRP CA C 34 57.267 57.267 56.021 1.246 25149
4019 1 11 . 1 1 34 34 TRP CB C 34 33.780 33.780 34.057 -0.277 25149
4020 1 11 . 1 1 34 34 TRP H H 34 8.756 8.756 8.228 0.528 25149
4021 1 11 . 1 1 35 35 GLY N N 35 107.569 107.569 106.323 1.246 25149
4022 1 11 . 1 1 35 35 GLY C C 35 177.397 177.397 175.639 1.758 25149
4023 1 11 . 1 1 35 35 GLY CA C 35 44.070 44.070 44.125 -0.055 25149
4024 1 11 . 1 1 35 35 GLY H H 35 8.857 8.857 8.557 0.300 25149
4025 1 11 . 1 1 36 36 GLN N N 36 122.723 122.723 118.743 3.980 25149
4026 1 11 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.018 -0.272 25149
4027 1 11 . 1 1 36 36 GLN C C 36 176.445 176.445 175.589 0.856 25149
4028 1 11 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.103 0.326 25149
4029 1 11 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.103 -0.472 25149
4030 1 11 . 1 1 36 36 GLN H H 36 8.338 8.338 8.796 -0.458 25149
4031 1 11 . 1 1 37 37 CYS N N 37 115.763 115.763 113.029 2.734 25149
4032 1 11 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.905 -0.621 25149
4033 1 11 . 1 1 37 37 CYS C C 37 175.281 175.281 176.207 -0.926 25149
4034 1 11 . 1 1 37 37 CYS CA C 37 58.395 58.395 55.593 2.801 25149
4035 1 11 . 1 1 37 37 CYS CB C 37 31.143 31.143 31.354 -0.211 25149
4036 1 11 . 1 1 37 37 CYS H H 37 7.622 7.622 7.495 0.127 25149
4037 1 11 . 1 1 38 38 SER N N 38 114.540 114.540 115.639 -1.099 25149
4038 1 11 . 1 1 38 38 SER HA H 38 4.004 4.004 4.160 -0.156 25149
4039 1 11 . 1 1 38 38 SER C C 38 173.389 173.389 174.167 -0.778 25149
4040 1 11 . 1 1 38 38 SER CA C 38 62.285 62.285 60.715 1.571 25149
4041 1 11 . 1 1 38 38 SER H H 38 7.716 7.716 8.451 -0.735 25149
4042 1 11 . 1 1 39 39 HIS N N 39 121.947 121.947 119.272 2.675 25149
4043 1 11 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.329 0.115 25149
4044 1 11 . 1 1 39 39 HIS C C 39 172.326 172.326 173.098 -0.772 25149
4045 1 11 . 1 1 39 39 HIS CA C 39 61.320 61.320 57.201 4.119 25149
4046 1 11 . 1 1 39 39 HIS CB C 39 31.523 31.523 29.747 1.776 25149
4047 1 11 . 1 1 39 39 HIS H H 39 7.829 7.829 8.155 -0.326 25149
4048 1 11 . 1 1 40 40 CYS N N 40 121.859 121.859 123.012 -1.153 25149
4049 1 11 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.203 0.406 25149
4050 1 11 . 1 1 40 40 CYS C C 40 171.900 171.900 172.117 -0.217 25149
4051 1 11 . 1 1 40 40 CYS CA C 40 55.791 55.791 56.178 -0.387 25149
4052 1 11 . 1 1 40 40 CYS CB C 40 28.964 28.964 28.897 0.067 25149
4053 1 11 . 1 1 40 40 CYS H H 40 8.049 8.049 8.297 -0.248 25149
4054 1 11 . 1 1 41 41 PHE N N 41 120.690 120.690 119.656 1.034 25149
4055 1 11 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.568 0.609 25149
4056 1 11 . 1 1 41 41 PHE C C 41 176.613 176.613 174.367 2.246 25149
4057 1 11 . 1 1 41 41 PHE CA C 41 56.033 56.033 56.350 -0.317 25149
4058 1 11 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.671 2.089 25149
4059 1 11 . 1 1 41 41 PHE H H 41 8.368 8.368 8.438 -0.070 25149
4060 1 11 . 1 1 42 42 HIS N N 42 117.057 117.057 121.136 -4.079 25149
4061 1 11 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.537 0.132 25149
4062 1 11 . 1 1 42 42 HIS C C 42 177.464 177.464 176.039 1.425 25149
4063 1 11 . 1 1 42 42 HIS CA C 42 60.425 60.425 56.711 3.715 25149
4064 1 11 . 1 1 42 42 HIS CB C 42 29.740 29.740 30.235 -0.495 25149
4065 1 11 . 1 1 42 42 HIS H H 42 8.384 8.384 8.098 0.286 25149
4066 1 11 . 1 1 43 43 MET N N 43 128.543 128.543 125.685 2.858 25149
4067 1 11 . 1 1 43 43 MET HA H 43 3.965 3.965 4.064 -0.099 25149
4068 1 11 . 1 1 43 43 MET C C 43 177.845 177.845 177.322 0.523 25149
4069 1 11 . 1 1 43 43 MET CA C 43 59.209 59.209 60.555 -1.346 25149
4070 1 11 . 1 1 43 43 MET CB C 43 33.009 33.009 32.719 0.290 25149
4071 1 11 . 1 1 43 43 MET H H 43 9.439 9.439 8.332 1.107 25149
4072 1 11 . 1 1 44 44 HIS N N 44 116.500 116.500 117.937 -1.437 25149
4073 1 11 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.215 0.041 25149
4074 1 11 . 1 1 44 44 HIS C C 44 178.405 178.405 177.935 0.470 25149
4075 1 11 . 1 1 44 44 HIS CA C 44 58.793 58.793 58.975 -0.182 25149
4076 1 11 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.131 3.616 25149
4077 1 11 . 1 1 44 44 HIS H H 44 9.747 9.747 8.007 1.740 25149
4078 1 11 . 1 1 45 45 CYS N N 45 115.950 115.950 117.133 -1.183 25149
4079 1 11 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.206 -0.206 25149
4080 1 11 . 1 1 45 45 CYS C C 45 177.957 177.957 177.074 0.883 25149
4081 1 11 . 1 1 45 45 CYS CA C 45 62.923 62.923 63.328 -0.404 25149
4082 1 11 . 1 1 45 45 CYS CB C 45 29.102 29.102 26.497 2.606 25149
4083 1 11 . 1 1 45 45 CYS H H 45 6.845 6.845 8.190 -1.345 25149
4084 1 11 . 1 1 46 46 ILE N N 46 119.362 119.362 121.455 -2.093 25149
4085 1 11 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.660 0.005 25149
4086 1 11 . 1 1 46 46 ILE C C 46 176.613 176.613 177.502 -0.889 25149
4087 1 11 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.589 -4.347 25149
4088 1 11 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.752 -0.433 25149
4089 1 11 . 1 1 46 46 ILE H H 46 7.816 7.816 8.017 -0.201 25149
4090 1 11 . 1 1 47 47 LEU N N 47 122.180 122.180 120.455 1.725 25149
4091 1 11 . 1 1 47 47 LEU HA H 47 3.873 3.873 4.171 -0.298 25149
4092 1 11 . 1 1 47 47 LEU C C 47 179.726 179.726 179.015 0.711 25149
4093 1 11 . 1 1 47 47 LEU CA C 47 58.633 58.633 59.120 -0.487 25149
4094 1 11 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.991 -0.868 25149
4095 1 11 . 1 1 47 47 LEU H H 47 8.266 8.266 8.650 -0.384 25149
4096 1 11 . 1 1 48 48 LYS N N 48 118.251 118.251 118.302 -0.051 25149
4097 1 11 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.231 -0.367 25149
4098 1 11 . 1 1 48 48 LYS C C 48 179.423 179.423 178.611 0.812 25149
4099 1 11 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.914 0.073 25149
4100 1 11 . 1 1 48 48 LYS CB C 48 32.765 32.765 32.069 0.696 25149
4101 1 11 . 1 1 48 48 LYS H H 48 7.147 7.147 8.390 -1.243 25149
4102 1 11 . 1 1 49 49 TRP N N 49 120.745 120.745 120.736 0.009 25149
4103 1 11 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.368 -0.288 25149
4104 1 11 . 1 1 49 49 TRP C C 49 178.147 178.147 177.772 0.375 25149
4105 1 11 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.351 0.194 25149
4106 1 11 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.171 0.244 25149
4107 1 11 . 1 1 49 49 TRP H H 49 7.709 7.709 7.671 0.038 25149
4108 1 11 . 1 1 50 50 LEU N N 50 117.236 117.236 117.509 -0.273 25149
4109 1 11 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.700 -0.095 25149
4110 1 11 . 1 1 50 50 LEU C C 50 179.658 179.658 176.752 2.906 25149
4111 1 11 . 1 1 50 50 LEU CA C 50 57.330 57.330 54.678 2.652 25149
4112 1 11 . 1 1 50 50 LEU CB C 50 41.416 41.416 42.142 -0.726 25149
4113 1 11 . 1 1 50 50 LEU H H 50 8.512 8.512 7.872 0.640 25149
4114 1 11 . 1 1 51 51 HIS N N 51 115.650 115.650 118.277 -2.627 25149
4115 1 11 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.500 -0.226 25149
4116 1 11 . 1 1 51 51 HIS C C 51 175.942 175.942 176.005 -0.063 25149
4117 1 11 . 1 1 51 51 HIS CA C 51 57.320 57.320 56.401 0.919 25149
4118 1 11 . 1 1 51 51 HIS CB C 51 29.487 29.487 30.136 -0.649 25149
4119 1 11 . 1 1 51 51 HIS H H 51 7.713 7.713 8.209 -0.496 25149
4120 1 11 . 1 1 52 52 ALA N N 52 119.779 119.779 122.115 -2.336 25149
4121 1 11 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.206 -0.183 25149
4122 1 11 . 1 1 52 52 ALA C C 52 177.834 177.834 177.695 0.139 25149
4123 1 11 . 1 1 52 52 ALA CA C 52 52.865 52.865 53.474 -0.609 25149
4124 1 11 . 1 1 52 52 ALA CB C 52 18.951 18.951 19.475 -0.524 25149
4125 1 11 . 1 1 52 52 ALA H H 52 7.191 7.191 7.916 -0.725 25149
4126 1 11 . 1 1 53 53 GLN N N 53 117.047 117.047 117.349 -0.302 25149
4127 1 11 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.532 -0.599 25149
4128 1 11 . 1 1 53 53 GLN C C 53 175.998 175.998 175.365 0.633 25149
4129 1 11 . 1 1 53 53 GLN CA C 53 55.482 55.482 54.645 0.837 25149
4130 1 11 . 1 1 53 53 GLN CB C 53 28.887 28.887 30.772 -1.885 25149
4131 1 11 . 1 1 53 53 GLN H H 53 7.317 7.317 8.117 -0.800 25149
4132 1 11 . 1 1 54 54 GLN N N 54 118.463 118.463 119.078 -0.615 25149
4133 1 11 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.466 -0.477 25149
4134 1 11 . 1 1 54 54 GLN C C 54 176.300 176.300 177.149 -0.849 25149
4135 1 11 . 1 1 54 54 GLN CA C 54 57.314 57.314 55.842 1.472 25149
4136 1 11 . 1 1 54 54 GLN CB C 54 28.823 28.823 29.139 -0.316 25149
4137 1 11 . 1 1 54 54 GLN H H 54 7.949 7.949 8.557 -0.608 25149
4138 1 11 . 1 1 55 55 VAL N N 55 116.755 116.755 119.721 -2.966 25149
4139 1 11 . 1 1 55 55 VAL HA H 55 3.884 3.884 3.762 0.122 25149
4140 1 11 . 1 1 55 55 VAL C C 55 175.774 175.774 176.734 -0.960 25149
4141 1 11 . 1 1 55 55 VAL CA C 55 63.210 63.210 64.469 -1.260 25149
4142 1 11 . 1 1 55 55 VAL CB C 55 32.870 32.870 31.454 1.416 25149
4143 1 11 . 1 1 55 55 VAL H H 55 7.801 7.801 8.284 -0.483 25149
4144 1 11 . 1 1 56 56 GLN N N 56 120.192 120.192 117.472 2.720 25149
4145 1 11 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.616 -0.499 25149
4146 1 11 . 1 1 56 56 GLN C C 56 175.236 175.236 174.903 0.333 25149
4147 1 11 . 1 1 56 56 GLN CA C 56 55.697 55.697 55.218 0.479 25149
4148 1 11 . 1 1 56 56 GLN CB C 56 29.319 29.319 29.329 -0.010 25149
4149 1 11 . 1 1 56 56 GLN H H 56 8.018 8.018 7.856 0.162 25149
4150 1 11 . 1 1 57 57 GLN N N 57 121.276 121.276 121.024 0.252 25149
4151 1 11 . 1 1 57 57 GLN HA H 57 4.204 4.204 4.204 -0.000 25149
4152 1 11 . 1 1 57 57 GLN C C 57 175.819 175.819 175.418 0.401 25149
4153 1 11 . 1 1 57 57 GLN CA C 57 55.617 55.617 55.498 0.119 25149
4154 1 11 . 1 1 57 57 GLN CB C 57 29.094 29.094 29.531 -0.437 25149
4155 1 11 . 1 1 57 57 GLN H H 57 8.471 8.471 8.625 -0.154 25149
4156 1 11 . 1 1 58 58 HIS N N 58 120.001 120.001 119.582 0.419 25149
4157 1 11 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.455 0.719 25149
4158 1 11 . 1 1 58 58 HIS C C 58 173.636 173.636 176.069 -2.433 25149
4159 1 11 . 1 1 58 58 HIS CA C 58 54.353 54.353 57.431 -3.078 25149
4160 1 11 . 1 1 58 58 HIS CB C 58 33.057 33.057 29.739 3.318 25149
4161 1 11 . 1 1 58 58 HIS H H 58 8.366 8.366 7.784 0.582 25149
4162 1 11 . 1 1 59 59 CYS N N 59 121.924 121.924 121.329 0.595 25149
4163 1 11 . 1 1 59 59 CYS HA H 59 4.442 4.442 4.154 0.288 25149
4164 1 11 . 1 1 59 59 CYS C C 59 176.334 176.334 175.020 1.314 25149
4165 1 11 . 1 1 59 59 CYS CA C 59 56.772 56.772 60.479 -3.707 25149
4166 1 11 . 1 1 59 59 CYS CB C 59 32.642 32.642 27.681 4.961 25149
4167 1 11 . 1 1 59 59 CYS H H 59 9.035 9.035 8.371 0.664 25149
4168 1 11 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.378 -0.565 25149
4169 1 11 . 1 1 60 60 PRO CA C 60 64.661 64.661 65.033 -0.372 25149
4170 1 11 . 1 1 60 60 PRO CB C 60 30.659 30.659 31.156 -0.497 25149
4171 1 11 . 1 1 61 61 MET N N 61 117.676 117.676 116.259 1.417 25149
4172 1 11 . 1 1 61 61 MET HA H 61 4.317 4.317 4.374 -0.057 25149
4173 1 11 . 1 1 61 61 MET C C 61 177.117 177.117 176.364 0.753 25149
4174 1 11 . 1 1 61 61 MET CA C 61 56.408 56.408 56.553 -0.145 25149
4175 1 11 . 1 1 61 61 MET CB C 61 32.551 32.551 32.324 0.227 25149
4176 1 11 . 1 1 61 61 MET H H 61 9.135 9.135 7.887 1.248 25149
4177 1 11 . 1 1 62 62 CYS N N 62 117.214 117.214 116.999 0.215 25149
4178 1 11 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.590 0.284 25149
4179 1 11 . 1 1 62 62 CYS C C 62 175.740 175.740 175.039 0.701 25149
4180 1 11 . 1 1 62 62 CYS CA C 62 58.273 58.273 57.724 0.549 25149
4181 1 11 . 1 1 62 62 CYS CB C 62 32.776 32.776 29.075 3.701 25149
4182 1 11 . 1 1 62 62 CYS H H 62 8.011 8.011 7.711 0.300 25149
4183 1 11 . 1 1 63 63 ARG N N 63 116.555 116.555 118.474 -1.919 25149
4184 1 11 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.392 -0.467 25149
4185 1 11 . 1 1 63 63 ARG C C 63 175.326 175.326 175.794 -0.468 25149
4186 1 11 . 1 1 63 63 ARG CA C 63 58.073 58.073 55.903 2.170 25149
4187 1 11 . 1 1 63 63 ARG CB C 63 27.136 27.136 30.528 -3.392 25149
4188 1 11 . 1 1 63 63 ARG H H 63 8.086 8.086 8.337 -0.251 25149
4189 1 11 . 1 1 64 64 GLN N N 64 118.932 118.932 118.577 0.355 25149
4190 1 11 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.472 -0.213 25149
4191 1 11 . 1 1 64 64 GLN C C 64 176.054 176.054 175.423 0.631 25149
4192 1 11 . 1 1 64 64 GLN CA C 64 56.316 56.316 55.294 1.022 25149
4193 1 11 . 1 1 64 64 GLN CB C 64 30.083 30.083 29.699 0.384 25149
4194 1 11 . 1 1 64 64 GLN H H 64 8.003 8.003 7.955 0.048 25149
4195 1 11 . 1 1 65 65 GLU N N 65 122.038 122.038 121.180 0.858 25149
4196 1 11 . 1 1 65 65 GLU HA H 65 4.003 4.003 4.223 -0.220 25149
4197 1 11 . 1 1 65 65 GLU C C 65 176.781 176.781 176.193 0.588 25149
4198 1 11 . 1 1 65 65 GLU CA C 65 57.682 57.682 56.341 1.341 25149
4199 1 11 . 1 1 65 65 GLU CB C 65 29.900 29.900 29.076 0.824 25149
4200 1 11 . 1 1 65 65 GLU H H 65 8.657 8.657 8.688 -0.031 25149
4201 1 11 . 1 1 66 66 TRP N N 66 125.730 125.730 128.557 -2.827 25149
4202 1 11 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.239 0.165 25149
4203 1 11 . 1 1 66 66 TRP C C 66 175.460 175.460 175.253 0.207 25149
4204 1 11 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.589 0.036 25149
4205 1 11 . 1 1 66 66 TRP CB C 66 29.358 29.358 29.864 -0.506 25149
4206 1 11 . 1 1 66 66 TRP H H 66 8.499 8.499 8.159 0.340 25149
4207 1 11 . 1 1 67 67 LYS N N 67 127.396 127.396 127.168 0.228 25149
4208 1 11 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.105 -0.087 25149
4209 1 11 . 1 1 67 67 LYS C C 67 175.180 175.180 175.375 -0.195 25149
4210 1 11 . 1 1 67 67 LYS CA C 67 54.514 54.514 53.857 0.657 25149
4211 1 11 . 1 1 67 67 LYS CB C 67 36.231 36.231 34.535 1.696 25149
4212 1 11 . 1 1 67 67 LYS H H 67 6.930 6.930 8.525 -1.595 25149
4213 1 11 . 1 1 68 68 PHE N N 68 121.511 121.511 125.975 -4.464 25149
4214 1 11 . 1 1 68 68 PHE HA H 68 4.108 4.108 3.969 0.139 25149
4215 1 11 . 1 1 68 68 PHE C C 68 176.613 176.613 175.618 0.995 25149
4216 1 11 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.745 2.216 25149
4217 1 11 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.954 1.308 25149
4218 1 11 . 1 1 68 68 PHE H H 68 8.430 8.430 8.535 -0.105 25149
4219 1 11 . 1 1 69 69 LYS N N 69 124.210 124.210 122.583 1.627 25149
4220 1 11 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.261 -0.266 25149
4221 1 11 . 1 1 69 69 LYS C C 69 175.651 175.651 175.887 -0.236 25149
4222 1 11 . 1 1 69 69 LYS CA C 69 57.320 57.320 56.773 0.547 25149
4223 1 11 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.712 -0.351 25149
4224 1 11 . 1 1 69 69 LYS H H 69 8.738 8.738 8.126 0.612 25149
4225 1 12 . 1 1 2 2 SER HA H 2 4.417 4.417 5.016 -0.599 25149
4226 1 12 . 1 1 2 2 SER CA C 2 58.322 58.322 58.502 -0.180 25149
4227 1 12 . 1 1 2 2 SER CB C 2 64.169 64.169 64.054 0.115 25149
4228 1 12 . 1 1 3 3 VAL N N 3 121.214 121.214 123.314 -2.100 25149
4229 1 12 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.299 -0.253 25149
4230 1 12 . 1 1 3 3 VAL C C 3 175.879 175.879 174.578 1.301 25149
4231 1 12 . 1 1 3 3 VAL CA C 3 62.138 62.138 62.845 -0.707 25149
4232 1 12 . 1 1 3 3 VAL CB C 3 32.958 32.958 33.632 -0.674 25149
4233 1 12 . 1 1 3 3 VAL H H 3 8.170 8.170 8.086 0.084 25149
4234 1 12 . 1 1 4 4 ALA N N 4 127.312 127.312 128.943 -1.631 25149
4235 1 12 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.667 -0.470 25149
4236 1 12 . 1 1 4 4 ALA C C 4 177.497 177.497 176.223 1.274 25149
4237 1 12 . 1 1 4 4 ALA CA C 4 52.439 52.439 52.035 0.404 25149
4238 1 12 . 1 1 4 4 ALA CB C 4 19.424 19.424 19.529 -0.105 25149
4239 1 12 . 1 1 4 4 ALA H H 4 8.294 8.294 8.508 -0.214 25149
4240 1 12 . 1 1 5 5 ASN N N 5 117.674 117.674 117.220 0.454 25149
4241 1 12 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.838 -0.273 25149
4242 1 12 . 1 1 5 5 ASN C C 5 175.048 175.048 173.637 1.411 25149
4243 1 12 . 1 1 5 5 ASN CA C 5 53.725 53.725 52.555 1.170 25149
4244 1 12 . 1 1 5 5 ASN CB C 5 39.197 39.197 40.130 -0.933 25149
4245 1 12 . 1 1 5 5 ASN H H 5 8.252 8.252 7.669 0.583 25149
4246 1 12 . 1 1 6 6 ASP N N 6 119.896 119.896 116.893 3.003 25149
4247 1 12 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.393 0.127 25149
4248 1 12 . 1 1 6 6 ASP C C 6 176.269 176.269 175.868 0.401 25149
4249 1 12 . 1 1 6 6 ASP CA C 6 54.497 54.497 55.134 -0.637 25149
4250 1 12 . 1 1 6 6 ASP CB C 6 41.104 41.104 40.069 1.036 25149
4251 1 12 . 1 1 6 6 ASP H H 6 8.215 8.215 8.844 -0.629 25149
4252 1 12 . 1 1 7 7 GLU N N 7 119.101 119.101 113.547 5.554 25149
4253 1 12 . 1 1 7 7 GLU HA H 7 4.243 4.243 3.945 0.298 25149
4254 1 12 . 1 1 7 7 GLU C C 7 175.006 175.006 175.265 -0.259 25149
4255 1 12 . 1 1 7 7 GLU CA C 7 56.689 56.689 57.796 -1.107 25149
4256 1 12 . 1 1 7 7 GLU CB C 7 30.379 30.379 30.069 0.310 25149
4257 1 12 . 1 1 7 7 GLU H H 7 8.065 8.065 8.561 -0.496 25149
4258 1 12 . 1 1 8 8 ASN N N 8 116.852 116.852 115.251 1.601 25149
4259 1 12 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.442 -0.284 25149
4260 1 12 . 1 1 8 8 ASN C C 8 172.706 172.706 174.319 -1.613 25149
4261 1 12 . 1 1 8 8 ASN CA C 8 51.165 51.165 50.843 0.322 25149
4262 1 12 . 1 1 8 8 ASN CB C 8 40.702 40.702 40.522 0.180 25149
4263 1 12 . 1 1 8 8 ASN H H 8 7.505 7.505 7.678 -0.173 25149
4264 1 12 . 1 1 9 9 CYS N N 9 122.855 122.855 119.575 3.280 25149
4265 1 12 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.797 -0.003 25149
4266 1 12 . 1 1 9 9 CYS C C 9 178.370 178.370 176.453 1.917 25149
4267 1 12 . 1 1 9 9 CYS CA C 9 59.552 59.552 61.063 -1.511 25149
4268 1 12 . 1 1 9 9 CYS CB C 9 31.526 31.526 28.143 3.383 25149
4269 1 12 . 1 1 9 9 CYS H H 9 7.614 7.614 7.741 -0.127 25149
4270 1 12 . 1 1 10 10 GLY N N 10 117.295 117.295 108.025 9.270 25149
4271 1 12 . 1 1 10 10 GLY C C 10 174.111 174.111 174.710 -0.599 25149
4272 1 12 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.608 1.359 25149
4273 1 12 . 1 1 10 10 GLY H H 10 9.235 9.235 7.722 1.513 25149
4274 1 12 . 1 1 11 11 ILE N N 11 119.811 119.811 120.361 -0.550 25149
4275 1 12 . 1 1 11 11 ILE HA H 11 3.809 3.809 4.052 -0.243 25149
4276 1 12 . 1 1 11 11 ILE C C 11 176.121 176.121 176.414 -0.293 25149
4277 1 12 . 1 1 11 11 ILE CA C 11 64.041 64.041 64.341 -0.300 25149
4278 1 12 . 1 1 11 11 ILE CB C 11 39.411 39.411 38.890 0.521 25149
4279 1 12 . 1 1 11 11 ILE H H 11 8.285 8.285 7.854 0.431 25149
4280 1 12 . 1 1 12 12 CYS N N 12 116.728 116.728 114.205 2.523 25149
4281 1 12 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.636 -0.060 25149
4282 1 12 . 1 1 12 12 CYS C C 12 175.975 175.975 173.771 2.204 25149
4283 1 12 . 1 1 12 12 CYS CA C 12 59.225 59.225 56.971 2.254 25149
4284 1 12 . 1 1 12 12 CYS CB C 12 32.246 32.246 29.643 2.603 25149
4285 1 12 . 1 1 12 12 CYS H H 12 7.607 7.607 7.779 -0.172 25149
4286 1 12 . 1 1 13 13 ARG N N 13 116.073 116.073 118.834 -2.761 25149
4287 1 12 . 1 1 13 13 ARG HA H 13 3.742 3.742 3.946 -0.204 25149
4288 1 12 . 1 1 13 13 ARG C C 13 174.979 174.979 174.261 0.718 25149
4289 1 12 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.844 0.792 25149
4290 1 12 . 1 1 13 13 ARG CB C 13 26.326 26.326 27.137 -0.811 25149
4291 1 12 . 1 1 13 13 ARG H H 13 7.987 7.987 8.141 -0.154 25149
4292 1 12 . 1 1 14 14 MET N N 14 119.313 119.313 118.907 0.406 25149
4293 1 12 . 1 1 14 14 MET HA H 14 4.547 4.547 4.557 -0.010 25149
4294 1 12 . 1 1 14 14 MET C C 14 176.143 176.143 175.251 0.892 25149
4295 1 12 . 1 1 14 14 MET CA C 14 54.208 54.208 53.588 0.620 25149
4296 1 12 . 1 1 14 14 MET CB C 14 33.951 33.951 35.160 -1.209 25149
4297 1 12 . 1 1 14 14 MET H H 14 8.624 8.624 7.616 1.008 25149
4298 1 12 . 1 1 15 15 ALA N N 15 122.683 122.683 129.936 -7.253 25149
4299 1 12 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.090 0.182 25149
4300 1 12 . 1 1 15 15 ALA C C 15 180.117 180.117 178.264 1.853 25149
4301 1 12 . 1 1 15 15 ALA CA C 15 52.346 52.346 52.639 -0.293 25149
4302 1 12 . 1 1 15 15 ALA CB C 15 19.487 19.487 18.803 0.683 25149
4303 1 12 . 1 1 15 15 ALA H H 15 7.965 7.965 8.442 -0.477 25149
4304 1 12 . 1 1 16 16 PHE N N 16 119.313 119.313 121.292 -1.979 25149
4305 1 12 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.283 -0.242 25149
4306 1 12 . 1 1 16 16 PHE C C 16 176.423 176.423 176.924 -0.501 25149
4307 1 12 . 1 1 16 16 PHE CA C 16 59.130 59.130 60.115 -0.986 25149
4308 1 12 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.292 0.098 25149
4309 1 12 . 1 1 16 16 PHE H H 16 8.095 8.095 7.891 0.204 25149
4310 1 12 . 1 1 17 17 ASN N N 17 112.313 112.313 115.996 -3.683 25149
4311 1 12 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.844 -0.208 25149
4312 1 12 . 1 1 17 17 ASN C C 17 175.337 175.337 175.119 0.218 25149
4313 1 12 . 1 1 17 17 ASN CA C 17 52.961 52.961 53.487 -0.526 25149
4314 1 12 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.729 -1.555 25149
4315 1 12 . 1 1 17 17 ASN H H 17 7.823 7.823 8.166 -0.343 25149
4316 1 12 . 1 1 18 18 GLY N N 18 107.742 107.742 107.151 0.591 25149
4317 1 12 . 1 1 18 18 GLY C C 18 173.759 173.759 172.659 1.100 25149
4318 1 12 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.368 0.096 25149
4319 1 12 . 1 1 18 18 GLY H H 18 7.579 7.579 7.934 -0.355 25149
4320 1 12 . 1 1 19 19 CYS N N 19 117.050 117.050 118.417 -1.367 25149
4321 1 12 . 1 1 19 19 CYS HA H 19 4.571 4.571 4.389 0.182 25149
4322 1 12 . 1 1 19 19 CYS C C 19 174.039 174.039 175.002 -0.963 25149
4323 1 12 . 1 1 19 19 CYS CA C 19 58.433 58.433 58.412 0.021 25149
4324 1 12 . 1 1 19 19 CYS CB C 19 30.681 30.681 29.393 1.288 25149
4325 1 12 . 1 1 19 19 CYS H H 19 8.198 8.198 8.250 -0.052 25149
4326 1 12 . 1 1 20 20 CYS N N 20 123.923 123.923 121.978 1.945 25149
4327 1 12 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.497 -0.486 25149
4328 1 12 . 1 1 20 20 CYS C C 20 173.736 173.736 174.299 -0.563 25149
4329 1 12 . 1 1 20 20 CYS CA C 20 57.999 57.999 56.896 1.103 25149
4330 1 12 . 1 1 20 20 CYS CB C 20 28.205 28.205 27.285 0.920 25149
4331 1 12 . 1 1 20 20 CYS H H 20 8.466 8.466 8.608 -0.142 25149
4332 1 12 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.363 -0.334 25149
4333 1 12 . 1 1 21 21 PRO CA C 21 65.426 65.426 64.772 0.654 25149
4334 1 12 . 1 1 21 21 PRO CB C 21 32.801 32.801 31.923 0.878 25149
4335 1 12 . 1 1 22 22 ASP N N 22 117.053 117.053 118.401 -1.348 25149
4336 1 12 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.667 -0.162 25149
4337 1 12 . 1 1 22 22 ASP C C 22 176.501 176.501 175.058 1.443 25149
4338 1 12 . 1 1 22 22 ASP CA C 22 55.017 55.017 54.687 0.330 25149
4339 1 12 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.703 1.819 25149
4340 1 12 . 1 1 22 22 ASP H H 22 8.395 8.395 8.661 -0.266 25149
4341 1 12 . 1 1 23 23 CYS N N 23 123.353 123.353 119.867 3.486 25149
4342 1 12 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.519 -0.226 25149
4343 1 12 . 1 1 23 23 CYS C C 23 175.214 175.214 173.772 1.442 25149
4344 1 12 . 1 1 23 23 CYS CA C 23 61.633 61.633 58.202 3.431 25149
4345 1 12 . 1 1 23 23 CYS CB C 23 31.542 31.542 29.360 2.182 25149
4346 1 12 . 1 1 23 23 CYS H H 23 7.246 7.246 7.138 0.108 25149
4347 1 12 . 1 1 24 24 LYS N N 24 117.539 117.539 127.448 -9.909 25149
4348 1 12 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.416 -0.186 25149
4349 1 12 . 1 1 24 24 LYS C C 24 177.106 177.106 176.239 0.867 25149
4350 1 12 . 1 1 24 24 LYS CA C 24 56.921 56.921 55.180 1.741 25149
4351 1 12 . 1 1 24 24 LYS CB C 24 34.615 34.615 31.700 2.915 25149
4352 1 12 . 1 1 24 24 LYS H H 24 8.173 8.173 8.367 -0.195 25149
4353 1 12 . 1 1 25 25 VAL N N 25 120.661 120.661 123.028 -2.367 25149
4354 1 12 . 1 1 25 25 VAL HA H 25 4.429 4.429 3.841 0.588 25149
4355 1 12 . 1 1 25 25 VAL C C 25 174.027 174.027 175.676 -1.649 25149
4356 1 12 . 1 1 25 25 VAL CA C 25 59.934 59.934 62.090 -2.156 25149
4357 1 12 . 1 1 25 25 VAL CB C 25 33.507 33.507 32.280 1.227 25149
4358 1 12 . 1 1 25 25 VAL H H 25 7.787 7.787 7.749 0.038 25149
4359 1 12 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.407 -0.071 25149
4360 1 12 . 1 1 26 26 PRO CA C 26 63.279 63.279 63.123 0.156 25149
4361 1 12 . 1 1 26 26 PRO CB C 26 32.077 32.077 29.804 2.273 25149
4362 1 12 . 1 1 27 27 GLY N N 27 109.926 109.926 110.103 -0.177 25149
4363 1 12 . 1 1 27 27 GLY C C 27 175.169 175.169 172.765 2.404 25149
4364 1 12 . 1 1 27 27 GLY CA C 27 45.042 45.042 45.388 -0.346 25149
4365 1 12 . 1 1 27 27 GLY H H 27 8.569 8.569 7.822 0.747 25149
4366 1 12 . 1 1 28 28 ASP N N 28 122.592 122.592 119.922 2.670 25149
4367 1 12 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.647 -0.416 25149
4368 1 12 . 1 1 28 28 ASP C C 28 176.602 176.602 175.865 0.737 25149
4369 1 12 . 1 1 28 28 ASP CA C 28 56.402 56.402 54.576 1.826 25149
4370 1 12 . 1 1 28 28 ASP CB C 28 40.912 40.912 41.523 -0.612 25149
4371 1 12 . 1 1 28 28 ASP H H 28 8.214 8.214 8.518 -0.304 25149
4372 1 12 . 1 1 29 29 ASP N N 29 117.500 117.500 121.494 -3.994 25149
4373 1 12 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.680 -0.233 25149
4374 1 12 . 1 1 29 29 ASP C C 29 175.505 175.505 175.747 -0.242 25149
4375 1 12 . 1 1 29 29 ASP CA C 29 55.266 55.266 54.256 1.010 25149
4376 1 12 . 1 1 29 29 ASP CB C 29 41.225 41.225 39.630 1.595 25149
4377 1 12 . 1 1 29 29 ASP H H 29 8.271 8.271 8.317 -0.046 25149
4378 1 12 . 1 1 30 30 CYS N N 30 124.470 124.470 123.484 0.986 25149
4379 1 12 . 1 1 30 30 CYS HA H 30 4.390 4.390 4.929 -0.539 25149
4380 1 12 . 1 1 30 30 CYS C C 30 171.755 171.755 172.736 -0.981 25149
4381 1 12 . 1 1 30 30 CYS CA C 30 57.676 57.676 55.627 2.049 25149
4382 1 12 . 1 1 30 30 CYS CB C 30 29.154 29.154 27.881 1.273 25149
4383 1 12 . 1 1 30 30 CYS H H 30 7.912 7.912 8.305 -0.393 25149
4384 1 12 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.610 0.077 25149
4385 1 12 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.592 0.283 25149
4386 1 12 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.467 1.518 25149
4387 1 12 . 1 1 32 32 LEU N N 32 120.023 120.023 116.791 3.232 25149
4388 1 12 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.549 0.167 25149
4389 1 12 . 1 1 32 32 LEU C C 32 176.300 176.300 175.013 1.287 25149
4390 1 12 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.539 0.382 25149
4391 1 12 . 1 1 32 32 LEU CB C 32 43.336 43.336 43.445 -0.109 25149
4392 1 12 . 1 1 32 32 LEU H H 32 8.580 8.580 7.850 0.730 25149
4393 1 12 . 1 1 33 33 VAL N N 33 116.217 116.217 118.063 -1.846 25149
4394 1 12 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.467 0.196 25149
4395 1 12 . 1 1 33 33 VAL C C 33 171.374 171.374 173.938 -2.564 25149
4396 1 12 . 1 1 33 33 VAL CA C 33 60.449 60.449 60.507 -0.058 25149
4397 1 12 . 1 1 33 33 VAL CB C 33 36.448 36.448 35.922 0.526 25149
4398 1 12 . 1 1 33 33 VAL H H 33 8.594 8.594 8.224 0.370 25149
4399 1 12 . 1 1 34 34 TRP N N 34 122.711 122.711 125.964 -3.253 25149
4400 1 12 . 1 1 34 34 TRP HA H 34 5.339 5.339 5.076 0.263 25149
4401 1 12 . 1 1 34 34 TRP C C 34 176.770 176.770 175.564 1.206 25149
4402 1 12 . 1 1 34 34 TRP CA C 34 57.267 57.267 55.882 1.385 25149
4403 1 12 . 1 1 34 34 TRP CB C 34 33.780 33.780 33.163 0.617 25149
4404 1 12 . 1 1 34 34 TRP H H 34 8.756 8.756 8.596 0.160 25149
4405 1 12 . 1 1 35 35 GLY N N 35 107.569 107.569 106.557 1.012 25149
4406 1 12 . 1 1 35 35 GLY C C 35 177.397 177.397 175.592 1.805 25149
4407 1 12 . 1 1 35 35 GLY CA C 35 44.070 44.070 44.063 0.007 25149
4408 1 12 . 1 1 35 35 GLY H H 35 8.857 8.857 8.652 0.205 25149
4409 1 12 . 1 1 36 36 GLN N N 36 122.723 122.723 119.128 3.595 25149
4410 1 12 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.060 -0.314 25149
4411 1 12 . 1 1 36 36 GLN C C 36 176.445 176.445 176.066 0.379 25149
4412 1 12 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.136 0.293 25149
4413 1 12 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.257 -0.626 25149
4414 1 12 . 1 1 36 36 GLN H H 36 8.338 8.338 8.769 -0.431 25149
4415 1 12 . 1 1 37 37 CYS N N 37 115.763 115.763 113.323 2.440 25149
4416 1 12 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.820 -0.536 25149
4417 1 12 . 1 1 37 37 CYS C C 37 175.281 175.281 176.033 -0.752 25149
4418 1 12 . 1 1 37 37 CYS CA C 37 58.395 58.395 55.910 2.486 25149
4419 1 12 . 1 1 37 37 CYS CB C 37 31.143 31.143 31.182 -0.039 25149
4420 1 12 . 1 1 37 37 CYS H H 37 7.622 7.622 7.555 0.067 25149
4421 1 12 . 1 1 38 38 SER N N 38 114.540 114.540 115.334 -0.794 25149
4422 1 12 . 1 1 38 38 SER HA H 38 4.004 4.004 4.239 -0.235 25149
4423 1 12 . 1 1 38 38 SER C C 38 173.389 173.389 174.140 -0.751 25149
4424 1 12 . 1 1 38 38 SER CA C 38 62.285 62.285 60.551 1.734 25149
4425 1 12 . 1 1 38 38 SER H H 38 7.716 7.716 8.625 -0.909 25149
4426 1 12 . 1 1 39 39 HIS N N 39 121.947 121.947 120.882 1.065 25149
4427 1 12 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.343 0.101 25149
4428 1 12 . 1 1 39 39 HIS C C 39 172.326 172.326 174.075 -1.749 25149
4429 1 12 . 1 1 39 39 HIS CA C 39 61.320 61.320 57.014 4.306 25149
4430 1 12 . 1 1 39 39 HIS CB C 39 31.523 31.523 29.272 2.251 25149
4431 1 12 . 1 1 39 39 HIS H H 39 7.829 7.829 7.583 0.246 25149
4432 1 12 . 1 1 40 40 CYS N N 40 121.859 121.859 123.315 -1.456 25149
4433 1 12 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.618 -0.009 25149
4434 1 12 . 1 1 40 40 CYS C C 40 171.900 171.900 172.212 -0.312 25149
4435 1 12 . 1 1 40 40 CYS CA C 40 55.791 55.791 55.924 -0.133 25149
4436 1 12 . 1 1 40 40 CYS CB C 40 28.964 28.964 28.466 0.498 25149
4437 1 12 . 1 1 40 40 CYS H H 40 8.049 8.049 8.676 -0.627 25149
4438 1 12 . 1 1 41 41 PHE N N 41 120.690 120.690 120.876 -0.186 25149
4439 1 12 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.702 0.475 25149
4440 1 12 . 1 1 41 41 PHE C C 41 176.613 176.613 175.112 1.501 25149
4441 1 12 . 1 1 41 41 PHE CA C 41 56.033 56.033 55.270 0.763 25149
4442 1 12 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.492 2.268 25149
4443 1 12 . 1 1 41 41 PHE H H 41 8.368 8.368 8.481 -0.113 25149
4444 1 12 . 1 1 42 42 HIS N N 42 117.057 117.057 121.569 -4.512 25149
4445 1 12 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.392 0.277 25149
4446 1 12 . 1 1 42 42 HIS C C 42 177.464 177.464 176.326 1.138 25149
4447 1 12 . 1 1 42 42 HIS CA C 42 60.425 60.425 56.642 3.783 25149
4448 1 12 . 1 1 42 42 HIS CB C 42 29.740 29.740 30.017 -0.277 25149
4449 1 12 . 1 1 42 42 HIS H H 42 8.384 8.384 7.885 0.499 25149
4450 1 12 . 1 1 43 43 MET N N 43 128.543 128.543 125.804 2.739 25149
4451 1 12 . 1 1 43 43 MET HA H 43 3.965 3.965 4.019 -0.054 25149
4452 1 12 . 1 1 43 43 MET C C 43 177.845 177.845 177.440 0.405 25149
4453 1 12 . 1 1 43 43 MET CA C 43 59.209 59.209 60.285 -1.075 25149
4454 1 12 . 1 1 43 43 MET CB C 43 33.009 33.009 32.620 0.389 25149
4455 1 12 . 1 1 43 43 MET H H 43 9.439 9.439 8.419 1.020 25149
4456 1 12 . 1 1 44 44 HIS N N 44 116.500 116.500 117.865 -1.365 25149
4457 1 12 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.197 0.059 25149
4458 1 12 . 1 1 44 44 HIS C C 44 178.405 178.405 177.841 0.564 25149
4459 1 12 . 1 1 44 44 HIS CA C 44 58.793 58.793 59.111 -0.318 25149
4460 1 12 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.084 3.663 25149
4461 1 12 . 1 1 44 44 HIS H H 44 9.747 9.747 8.000 1.747 25149
4462 1 12 . 1 1 45 45 CYS N N 45 115.950 115.950 117.338 -1.388 25149
4463 1 12 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.176 -0.176 25149
4464 1 12 . 1 1 45 45 CYS C C 45 177.957 177.957 176.978 0.979 25149
4465 1 12 . 1 1 45 45 CYS CA C 45 62.923 62.923 63.981 -1.058 25149
4466 1 12 . 1 1 45 45 CYS CB C 45 29.102 29.102 27.377 1.726 25149
4467 1 12 . 1 1 45 45 CYS H H 45 6.845 6.845 7.987 -1.142 25149
4468 1 12 . 1 1 46 46 ILE N N 46 119.362 119.362 120.675 -1.313 25149
4469 1 12 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.631 0.034 25149
4470 1 12 . 1 1 46 46 ILE C C 46 176.613 176.613 177.599 -0.986 25149
4471 1 12 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.622 -4.380 25149
4472 1 12 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.822 -0.503 25149
4473 1 12 . 1 1 46 46 ILE H H 46 7.816 7.816 7.929 -0.113 25149
4474 1 12 . 1 1 47 47 LEU N N 47 122.180 122.180 120.498 1.682 25149
4475 1 12 . 1 1 47 47 LEU HA H 47 3.873 3.873 4.201 -0.328 25149
4476 1 12 . 1 1 47 47 LEU C C 47 179.726 179.726 178.968 0.758 25149
4477 1 12 . 1 1 47 47 LEU CA C 47 58.633 58.633 59.199 -0.566 25149
4478 1 12 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.947 -0.824 25149
4479 1 12 . 1 1 47 47 LEU H H 47 8.266 8.266 8.654 -0.388 25149
4480 1 12 . 1 1 48 48 LYS N N 48 118.251 118.251 118.543 -0.292 25149
4481 1 12 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.210 -0.346 25149
4482 1 12 . 1 1 48 48 LYS C C 48 179.423 179.423 178.661 0.762 25149
4483 1 12 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.655 0.332 25149
4484 1 12 . 1 1 48 48 LYS CB C 48 32.765 32.765 31.909 0.856 25149
4485 1 12 . 1 1 48 48 LYS H H 48 7.147 7.147 8.319 -1.172 25149
4486 1 12 . 1 1 49 49 TRP N N 49 120.745 120.745 121.089 -0.344 25149
4487 1 12 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.396 -0.316 25149
4488 1 12 . 1 1 49 49 TRP C C 49 178.147 178.147 178.175 -0.028 25149
4489 1 12 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.229 0.316 25149
4490 1 12 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.036 0.379 25149
4491 1 12 . 1 1 49 49 TRP H H 49 7.709 7.709 7.601 0.108 25149
4492 1 12 . 1 1 50 50 LEU N N 50 117.236 117.236 118.136 -0.900 25149
4493 1 12 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.694 -0.089 25149
4494 1 12 . 1 1 50 50 LEU C C 50 179.658 179.658 177.317 2.341 25149
4495 1 12 . 1 1 50 50 LEU CA C 50 57.330 57.330 55.072 2.258 25149
4496 1 12 . 1 1 50 50 LEU CB C 50 41.416 41.416 41.980 -0.564 25149
4497 1 12 . 1 1 50 50 LEU H H 50 8.512 8.512 7.919 0.593 25149
4498 1 12 . 1 1 51 51 HIS N N 51 115.650 115.650 118.550 -2.900 25149
4499 1 12 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.532 -0.258 25149
4500 1 12 . 1 1 51 51 HIS C C 51 175.942 175.942 175.338 0.604 25149
4501 1 12 . 1 1 51 51 HIS CA C 51 57.320 57.320 57.220 0.100 25149
4502 1 12 . 1 1 51 51 HIS CB C 51 29.487 29.487 30.302 -0.815 25149
4503 1 12 . 1 1 51 51 HIS H H 51 7.713 7.713 8.450 -0.737 25149
4504 1 12 . 1 1 52 52 ALA N N 52 119.779 119.779 121.457 -1.678 25149
4505 1 12 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.315 -0.292 25149
4506 1 12 . 1 1 52 52 ALA C C 52 177.834 177.834 176.656 1.178 25149
4507 1 12 . 1 1 52 52 ALA CA C 52 52.865 52.865 52.971 -0.106 25149
4508 1 12 . 1 1 52 52 ALA CB C 52 18.951 18.951 20.033 -1.082 25149
4509 1 12 . 1 1 52 52 ALA H H 52 7.191 7.191 7.982 -0.791 25149
4510 1 12 . 1 1 53 53 GLN N N 53 117.047 117.047 120.355 -3.308 25149
4511 1 12 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.258 -0.325 25149
4512 1 12 . 1 1 53 53 GLN C C 53 175.998 175.998 176.227 -0.229 25149
4513 1 12 . 1 1 53 53 GLN CA C 53 55.482 55.482 55.535 -0.053 25149
4514 1 12 . 1 1 53 53 GLN CB C 53 28.887 28.887 28.124 0.763 25149
4515 1 12 . 1 1 53 53 GLN H H 53 7.317 7.317 7.686 -0.369 25149
4516 1 12 . 1 1 54 54 GLN N N 54 118.463 118.463 123.583 -5.120 25149
4517 1 12 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.095 -0.106 25149
4518 1 12 . 1 1 54 54 GLN C C 54 176.300 176.300 176.678 -0.378 25149
4519 1 12 . 1 1 54 54 GLN CA C 54 57.314 57.314 57.328 -0.014 25149
4520 1 12 . 1 1 54 54 GLN CB C 54 28.823 28.823 28.579 0.244 25149
4521 1 12 . 1 1 54 54 GLN H H 54 7.949 7.949 8.514 -0.565 25149
4522 1 12 . 1 1 55 55 VAL N N 55 116.755 116.755 115.661 1.094 25149
4523 1 12 . 1 1 55 55 VAL HA H 55 3.884 3.884 3.765 0.119 25149
4524 1 12 . 1 1 55 55 VAL C C 55 175.774 175.774 175.808 -0.034 25149
4525 1 12 . 1 1 55 55 VAL CA C 55 63.210 63.210 63.906 -0.696 25149
4526 1 12 . 1 1 55 55 VAL CB C 55 32.870 32.870 31.509 1.361 25149
4527 1 12 . 1 1 55 55 VAL H H 55 7.801 7.801 7.894 -0.093 25149
4528 1 12 . 1 1 56 56 GLN N N 56 120.192 120.192 118.163 2.029 25149
4529 1 12 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.573 -0.456 25149
4530 1 12 . 1 1 56 56 GLN C C 56 175.236 175.236 174.598 0.638 25149
4531 1 12 . 1 1 56 56 GLN CA C 56 55.697 55.697 55.074 0.623 25149
4532 1 12 . 1 1 56 56 GLN CB C 56 29.319 29.319 31.290 -1.971 25149
4533 1 12 . 1 1 56 56 GLN H H 56 8.018 8.018 7.788 0.230 25149
4534 1 12 . 1 1 57 57 GLN N N 57 121.276 121.276 119.815 1.461 25149
4535 1 12 . 1 1 57 57 GLN HA H 57 4.204 4.204 4.170 0.034 25149
4536 1 12 . 1 1 57 57 GLN C C 57 175.819 175.819 175.804 0.015 25149
4537 1 12 . 1 1 57 57 GLN CA C 57 55.617 55.617 55.818 -0.201 25149
4538 1 12 . 1 1 57 57 GLN CB C 57 29.094 29.094 29.352 -0.258 25149
4539 1 12 . 1 1 57 57 GLN H H 57 8.471 8.471 8.486 -0.015 25149
4540 1 12 . 1 1 58 58 HIS N N 58 120.001 120.001 119.343 0.658 25149
4541 1 12 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.396 0.778 25149
4542 1 12 . 1 1 58 58 HIS C C 58 173.636 173.636 176.039 -2.403 25149
4543 1 12 . 1 1 58 58 HIS CA C 58 54.353 54.353 57.302 -2.949 25149
4544 1 12 . 1 1 58 58 HIS CB C 58 33.057 33.057 29.097 3.960 25149
4545 1 12 . 1 1 58 58 HIS H H 58 8.366 8.366 8.032 0.334 25149
4546 1 12 . 1 1 59 59 CYS N N 59 121.924 121.924 122.203 -0.279 25149
4547 1 12 . 1 1 59 59 CYS HA H 59 4.442 4.442 3.937 0.505 25149
4548 1 12 . 1 1 59 59 CYS C C 59 176.334 176.334 174.688 1.646 25149
4549 1 12 . 1 1 59 59 CYS CA C 59 56.772 56.772 61.712 -4.941 25149
4550 1 12 . 1 1 59 59 CYS CB C 59 32.642 32.642 28.561 4.081 25149
4551 1 12 . 1 1 59 59 CYS H H 59 9.035 9.035 8.194 0.841 25149
4552 1 12 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.203 -0.390 25149
4553 1 12 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.718 -0.056 25149
4554 1 12 . 1 1 60 60 PRO CB C 60 30.659 30.659 31.210 -0.551 25149
4555 1 12 . 1 1 61 61 MET N N 61 117.676 117.676 116.243 1.433 25149
4556 1 12 . 1 1 61 61 MET HA H 61 4.317 4.317 4.317 0.000 25149
4557 1 12 . 1 1 61 61 MET C C 61 177.117 177.117 176.155 0.962 25149
4558 1 12 . 1 1 61 61 MET CA C 61 56.408 56.408 56.423 -0.015 25149
4559 1 12 . 1 1 61 61 MET CB C 61 32.551 32.551 32.601 -0.050 25149
4560 1 12 . 1 1 61 61 MET H H 61 9.135 9.135 7.621 1.514 25149
4561 1 12 . 1 1 62 62 CYS N N 62 117.214 117.214 116.841 0.373 25149
4562 1 12 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.794 0.080 25149
4563 1 12 . 1 1 62 62 CYS C C 62 175.740 175.740 175.036 0.704 25149
4564 1 12 . 1 1 62 62 CYS CA C 62 58.273 58.273 56.258 2.015 25149
4565 1 12 . 1 1 62 62 CYS CB C 62 32.776 32.776 30.985 1.790 25149
4566 1 12 . 1 1 62 62 CYS H H 62 8.011 8.011 7.694 0.317 25149
4567 1 12 . 1 1 63 63 ARG N N 63 116.555 116.555 117.933 -1.378 25149
4568 1 12 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.308 -0.383 25149
4569 1 12 . 1 1 63 63 ARG C C 63 175.326 175.326 176.291 -0.965 25149
4570 1 12 . 1 1 63 63 ARG CA C 63 58.073 58.073 56.699 1.374 25149
4571 1 12 . 1 1 63 63 ARG CB C 63 27.136 27.136 30.197 -3.061 25149
4572 1 12 . 1 1 63 63 ARG H H 63 8.086 8.086 8.351 -0.265 25149
4573 1 12 . 1 1 64 64 GLN N N 64 118.932 118.932 120.280 -1.348 25149
4574 1 12 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.243 0.016 25149
4575 1 12 . 1 1 64 64 GLN C C 64 176.054 176.054 175.920 0.134 25149
4576 1 12 . 1 1 64 64 GLN CA C 64 56.316 56.316 55.779 0.537 25149
4577 1 12 . 1 1 64 64 GLN CB C 64 30.083 30.083 28.991 1.092 25149
4578 1 12 . 1 1 64 64 GLN H H 64 8.003 8.003 7.863 0.140 25149
4579 1 12 . 1 1 65 65 GLU N N 65 122.038 122.038 121.645 0.393 25149
4580 1 12 . 1 1 65 65 GLU HA H 65 4.003 4.003 4.029 -0.026 25149
4581 1 12 . 1 1 65 65 GLU C C 65 176.781 176.781 176.635 0.146 25149
4582 1 12 . 1 1 65 65 GLU CA C 65 57.682 57.682 57.029 0.653 25149
4583 1 12 . 1 1 65 65 GLU CB C 65 29.900 29.900 29.799 0.101 25149
4584 1 12 . 1 1 65 65 GLU H H 65 8.657 8.657 8.682 -0.025 25149
4585 1 12 . 1 1 66 66 TRP N N 66 125.730 125.730 128.054 -2.324 25149
4586 1 12 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.317 0.087 25149
4587 1 12 . 1 1 66 66 TRP C C 66 175.460 175.460 175.157 0.303 25149
4588 1 12 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.432 0.193 25149
4589 1 12 . 1 1 66 66 TRP CB C 66 29.358 29.358 30.005 -0.647 25149
4590 1 12 . 1 1 66 66 TRP H H 66 8.499 8.499 8.242 0.257 25149
4591 1 12 . 1 1 67 67 LYS N N 67 127.396 127.396 127.427 -0.031 25149
4592 1 12 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.112 -0.094 25149
4593 1 12 . 1 1 67 67 LYS C C 67 175.180 175.180 174.740 0.440 25149
4594 1 12 . 1 1 67 67 LYS CA C 67 54.514 54.514 53.739 0.775 25149
4595 1 12 . 1 1 67 67 LYS CB C 67 36.231 36.231 35.019 1.212 25149
4596 1 12 . 1 1 67 67 LYS H H 67 6.930 6.930 8.599 -1.669 25149
4597 1 12 . 1 1 68 68 PHE N N 68 121.511 121.511 124.895 -3.384 25149
4598 1 12 . 1 1 68 68 PHE HA H 68 4.108 4.108 3.907 0.201 25149
4599 1 12 . 1 1 68 68 PHE C C 68 176.613 176.613 175.334 1.279 25149
4600 1 12 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.845 2.116 25149
4601 1 12 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.460 1.802 25149
4602 1 12 . 1 1 68 68 PHE H H 68 8.430 8.430 8.473 -0.043 25149
4603 1 12 . 1 1 69 69 LYS N N 69 124.210 124.210 122.261 1.949 25149
4604 1 12 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.123 -0.128 25149
4605 1 12 . 1 1 69 69 LYS C C 69 175.651 175.651 175.936 -0.285 25149
4606 1 12 . 1 1 69 69 LYS CA C 69 57.320 57.320 56.663 0.658 25149
4607 1 12 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.862 -0.501 25149
4608 1 12 . 1 1 69 69 LYS H H 69 8.738 8.738 8.057 0.681 25149
4609 1 13 . 1 1 2 2 SER HA H 2 4.417 4.417 4.596 -0.179 25149
4610 1 13 . 1 1 2 2 SER CA C 2 58.322 58.322 58.386 -0.064 25149
4611 1 13 . 1 1 2 2 SER CB C 2 64.169 64.169 63.200 0.968 25149
4612 1 13 . 1 1 3 3 VAL N N 3 121.214 121.214 121.382 -0.168 25149
4613 1 13 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.125 -0.079 25149
4614 1 13 . 1 1 3 3 VAL C C 3 175.879 175.879 175.053 0.826 25149
4615 1 13 . 1 1 3 3 VAL CA C 3 62.138 62.138 62.278 -0.140 25149
4616 1 13 . 1 1 3 3 VAL CB C 3 32.958 32.958 32.838 0.120 25149
4617 1 13 . 1 1 3 3 VAL H H 3 8.170 8.170 7.699 0.471 25149
4618 1 13 . 1 1 4 4 ALA N N 4 127.312 127.312 127.836 -0.524 25149
4619 1 13 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.585 -0.388 25149
4620 1 13 . 1 1 4 4 ALA C C 4 177.497 177.497 176.234 1.263 25149
4621 1 13 . 1 1 4 4 ALA CA C 4 52.439 52.439 51.067 1.372 25149
4622 1 13 . 1 1 4 4 ALA CB C 4 19.424 19.424 18.852 0.572 25149
4623 1 13 . 1 1 4 4 ALA H H 4 8.294 8.294 8.482 -0.188 25149
4624 1 13 . 1 1 5 5 ASN N N 5 117.674 117.674 122.140 -4.466 25149
4625 1 13 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.564 0.001 25149
4626 1 13 . 1 1 5 5 ASN C C 5 175.048 175.048 175.203 -0.155 25149
4627 1 13 . 1 1 5 5 ASN CA C 5 53.725 53.725 54.224 -0.499 25149
4628 1 13 . 1 1 5 5 ASN CB C 5 39.197 39.197 38.852 0.344 25149
4629 1 13 . 1 1 5 5 ASN H H 5 8.252 8.252 8.402 -0.150 25149
4630 1 13 . 1 1 6 6 ASP N N 6 119.896 119.896 122.251 -2.355 25149
4631 1 13 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.826 -0.306 25149
4632 1 13 . 1 1 6 6 ASP C C 6 176.269 176.269 176.144 0.125 25149
4633 1 13 . 1 1 6 6 ASP CA C 6 54.497 54.497 54.112 0.385 25149
4634 1 13 . 1 1 6 6 ASP CB C 6 41.104 41.104 41.853 -0.749 25149
4635 1 13 . 1 1 6 6 ASP H H 6 8.215 8.215 8.668 -0.453 25149
4636 1 13 . 1 1 7 7 GLU N N 7 119.101 119.101 117.441 1.660 25149
4637 1 13 . 1 1 7 7 GLU HA H 7 4.243 4.243 4.338 -0.095 25149
4638 1 13 . 1 1 7 7 GLU C C 7 175.006 175.006 175.217 -0.211 25149
4639 1 13 . 1 1 7 7 GLU CA C 7 56.689 56.689 56.594 0.095 25149
4640 1 13 . 1 1 7 7 GLU CB C 7 30.379 30.379 29.715 0.664 25149
4641 1 13 . 1 1 7 7 GLU H H 7 8.065 8.065 8.313 -0.248 25149
4642 1 13 . 1 1 8 8 ASN N N 8 116.852 116.852 116.393 0.459 25149
4643 1 13 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.457 -0.299 25149
4644 1 13 . 1 1 8 8 ASN C C 8 172.706 172.706 174.604 -1.898 25149
4645 1 13 . 1 1 8 8 ASN CA C 8 51.165 51.165 51.257 -0.092 25149
4646 1 13 . 1 1 8 8 ASN CB C 8 40.702 40.702 40.588 0.114 25149
4647 1 13 . 1 1 8 8 ASN H H 8 7.505 7.505 7.703 -0.198 25149
4648 1 13 . 1 1 9 9 CYS N N 9 122.855 122.855 120.652 2.203 25149
4649 1 13 . 1 1 9 9 CYS HA H 9 3.794 3.794 4.392 -0.598 25149
4650 1 13 . 1 1 9 9 CYS C C 9 178.370 178.370 176.728 1.642 25149
4651 1 13 . 1 1 9 9 CYS CA C 9 59.552 59.552 61.385 -1.833 25149
4652 1 13 . 1 1 9 9 CYS CB C 9 31.526 31.526 29.089 2.437 25149
4653 1 13 . 1 1 9 9 CYS H H 9 7.614 7.614 7.779 -0.165 25149
4654 1 13 . 1 1 10 10 GLY N N 10 117.295 117.295 111.152 6.143 25149
4655 1 13 . 1 1 10 10 GLY C C 10 174.111 174.111 174.440 -0.329 25149
4656 1 13 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.498 1.469 25149
4657 1 13 . 1 1 10 10 GLY H H 10 9.235 9.235 8.825 0.409 25149
4658 1 13 . 1 1 11 11 ILE N N 11 119.811 119.811 119.431 0.380 25149
4659 1 13 . 1 1 11 11 ILE HA H 11 3.809 3.809 3.935 -0.126 25149
4660 1 13 . 1 1 11 11 ILE C C 11 176.121 176.121 176.286 -0.165 25149
4661 1 13 . 1 1 11 11 ILE CA C 11 64.041 64.041 62.648 1.393 25149
4662 1 13 . 1 1 11 11 ILE CB C 11 39.411 39.411 38.827 0.584 25149
4663 1 13 . 1 1 11 11 ILE H H 11 8.285 8.285 7.007 1.278 25149
4664 1 13 . 1 1 12 12 CYS N N 12 116.728 116.728 116.149 0.579 25149
4665 1 13 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.646 -0.070 25149
4666 1 13 . 1 1 12 12 CYS C C 12 175.975 175.975 173.830 2.145 25149
4667 1 13 . 1 1 12 12 CYS CA C 12 59.225 59.225 57.636 1.589 25149
4668 1 13 . 1 1 12 12 CYS CB C 12 32.246 32.246 30.009 2.237 25149
4669 1 13 . 1 1 12 12 CYS H H 12 7.607 7.607 7.584 0.023 25149
4670 1 13 . 1 1 13 13 ARG N N 13 116.073 116.073 117.156 -1.083 25149
4671 1 13 . 1 1 13 13 ARG HA H 13 3.742 3.742 4.094 -0.352 25149
4672 1 13 . 1 1 13 13 ARG C C 13 174.979 174.979 174.272 0.707 25149
4673 1 13 . 1 1 13 13 ARG CA C 13 57.636 57.636 57.144 0.492 25149
4674 1 13 . 1 1 13 13 ARG CB C 13 26.326 26.326 27.452 -1.126 25149
4675 1 13 . 1 1 13 13 ARG H H 13 7.987 7.987 8.183 -0.196 25149
4676 1 13 . 1 1 14 14 MET N N 14 119.313 119.313 118.419 0.894 25149
4677 1 13 . 1 1 14 14 MET HA H 14 4.547 4.547 4.478 0.069 25149
4678 1 13 . 1 1 14 14 MET C C 14 176.143 176.143 175.719 0.424 25149
4679 1 13 . 1 1 14 14 MET CA C 14 54.208 54.208 53.929 0.279 25149
4680 1 13 . 1 1 14 14 MET CB C 14 33.951 33.951 33.142 0.809 25149
4681 1 13 . 1 1 14 14 MET H H 14 8.624 8.624 7.627 0.997 25149
4682 1 13 . 1 1 15 15 ALA N N 15 122.683 122.683 130.551 -7.868 25149
4683 1 13 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.083 0.189 25149
4684 1 13 . 1 1 15 15 ALA C C 15 180.117 180.117 178.255 1.862 25149
4685 1 13 . 1 1 15 15 ALA CA C 15 52.346 52.346 52.463 -0.117 25149
4686 1 13 . 1 1 15 15 ALA CB C 15 19.487 19.487 18.994 0.493 25149
4687 1 13 . 1 1 15 15 ALA H H 15 7.965 7.965 8.448 -0.483 25149
4688 1 13 . 1 1 16 16 PHE N N 16 119.313 119.313 120.258 -0.945 25149
4689 1 13 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.123 -0.082 25149
4690 1 13 . 1 1 16 16 PHE C C 16 176.423 176.423 176.406 0.017 25149
4691 1 13 . 1 1 16 16 PHE CA C 16 59.130 59.130 59.822 -0.692 25149
4692 1 13 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.538 -0.148 25149
4693 1 13 . 1 1 16 16 PHE H H 16 8.095 8.095 8.153 -0.058 25149
4694 1 13 . 1 1 17 17 ASN N N 17 112.313 112.313 116.078 -3.765 25149
4695 1 13 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.933 -0.297 25149
4696 1 13 . 1 1 17 17 ASN C C 17 175.337 175.337 174.785 0.552 25149
4697 1 13 . 1 1 17 17 ASN CA C 17 52.961 52.961 53.230 -0.269 25149
4698 1 13 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.561 -1.387 25149
4699 1 13 . 1 1 17 17 ASN H H 17 7.823 7.823 8.040 -0.217 25149
4700 1 13 . 1 1 18 18 GLY N N 18 107.742 107.742 107.627 0.115 25149
4701 1 13 . 1 1 18 18 GLY C C 18 173.759 173.759 172.822 0.937 25149
4702 1 13 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.584 -0.119 25149
4703 1 13 . 1 1 18 18 GLY H H 18 7.579 7.579 8.297 -0.718 25149
4704 1 13 . 1 1 19 19 CYS N N 19 117.050 117.050 119.179 -2.129 25149
4705 1 13 . 1 1 19 19 CYS HA H 19 4.571 4.571 4.579 -0.008 25149
4706 1 13 . 1 1 19 19 CYS C C 19 174.039 174.039 174.893 -0.854 25149
4707 1 13 . 1 1 19 19 CYS CA C 19 58.433 58.433 57.591 0.842 25149
4708 1 13 . 1 1 19 19 CYS CB C 19 30.681 30.681 29.133 1.548 25149
4709 1 13 . 1 1 19 19 CYS H H 19 8.198 8.198 8.172 0.026 25149
4710 1 13 . 1 1 20 20 CYS N N 20 123.923 123.923 123.158 0.765 25149
4711 1 13 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.482 -0.471 25149
4712 1 13 . 1 1 20 20 CYS C C 20 173.736 173.736 174.564 -0.828 25149
4713 1 13 . 1 1 20 20 CYS CA C 20 57.999 57.999 56.789 1.210 25149
4714 1 13 . 1 1 20 20 CYS CB C 20 28.205 28.205 27.971 0.234 25149
4715 1 13 . 1 1 20 20 CYS H H 20 8.466 8.466 8.624 -0.158 25149
4716 1 13 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.295 -0.266 25149
4717 1 13 . 1 1 21 21 PRO CA C 21 65.426 65.426 65.211 0.215 25149
4718 1 13 . 1 1 21 21 PRO CB C 21 32.801 32.801 31.980 0.821 25149
4719 1 13 . 1 1 22 22 ASP N N 22 117.053 117.053 117.932 -0.879 25149
4720 1 13 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.535 -0.030 25149
4721 1 13 . 1 1 22 22 ASP C C 22 176.501 176.501 175.376 1.125 25149
4722 1 13 . 1 1 22 22 ASP CA C 22 55.017 55.017 53.439 1.578 25149
4723 1 13 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.287 2.235 25149
4724 1 13 . 1 1 22 22 ASP H H 22 8.395 8.395 8.364 0.031 25149
4725 1 13 . 1 1 23 23 CYS N N 23 123.353 123.353 119.078 4.275 25149
4726 1 13 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.173 0.120 25149
4727 1 13 . 1 1 23 23 CYS C C 23 175.214 175.214 175.866 -0.652 25149
4728 1 13 . 1 1 23 23 CYS CA C 23 61.633 61.633 59.678 1.955 25149
4729 1 13 . 1 1 23 23 CYS CB C 23 31.542 31.542 28.032 3.510 25149
4730 1 13 . 1 1 23 23 CYS H H 23 7.246 7.246 7.884 -0.638 25149
4731 1 13 . 1 1 24 24 LYS N N 24 117.539 117.539 128.617 -11.078 25149
4732 1 13 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.061 0.169 25149
4733 1 13 . 1 1 24 24 LYS C C 24 177.106 177.106 175.520 1.586 25149
4734 1 13 . 1 1 24 24 LYS CA C 24 56.921 56.921 57.888 -0.967 25149
4735 1 13 . 1 1 24 24 LYS CB C 24 34.615 34.615 32.225 2.390 25149
4736 1 13 . 1 1 24 24 LYS H H 24 8.173 8.173 8.756 -0.583 25149
4737 1 13 . 1 1 25 25 VAL N N 25 120.661 120.661 114.743 5.918 25149
4738 1 13 . 1 1 25 25 VAL HA H 25 4.429 4.429 4.396 0.033 25149
4739 1 13 . 1 1 25 25 VAL C C 25 174.027 174.027 173.097 0.930 25149
4740 1 13 . 1 1 25 25 VAL CA C 25 59.934 59.934 59.786 0.148 25149
4741 1 13 . 1 1 25 25 VAL CB C 25 33.507 33.507 32.712 0.795 25149
4742 1 13 . 1 1 25 25 VAL H H 25 7.787 7.787 7.352 0.435 25149
4743 1 13 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.616 -0.280 25149
4744 1 13 . 1 1 26 26 PRO CA C 26 63.279 63.279 62.753 0.526 25149
4745 1 13 . 1 1 26 26 PRO CB C 26 32.077 32.077 32.261 -0.184 25149
4746 1 13 . 1 1 27 27 GLY N N 27 109.926 109.926 112.906 -2.980 25149
4747 1 13 . 1 1 27 27 GLY C C 27 175.169 175.169 174.031 1.138 25149
4748 1 13 . 1 1 27 27 GLY CA C 27 45.042 45.042 45.696 -0.654 25149
4749 1 13 . 1 1 27 27 GLY H H 27 8.569 8.569 8.466 0.103 25149
4750 1 13 . 1 1 28 28 ASP N N 28 122.592 122.592 120.056 2.536 25149
4751 1 13 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.701 -0.470 25149
4752 1 13 . 1 1 28 28 ASP C C 28 176.602 176.602 175.830 0.772 25149
4753 1 13 . 1 1 28 28 ASP CA C 28 56.402 56.402 54.286 2.116 25149
4754 1 13 . 1 1 28 28 ASP CB C 28 40.912 40.912 41.062 -0.150 25149
4755 1 13 . 1 1 28 28 ASP H H 28 8.214 8.214 8.514 -0.300 25149
4756 1 13 . 1 1 29 29 ASP N N 29 117.500 117.500 121.821 -4.321 25149
4757 1 13 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.867 -0.420 25149
4758 1 13 . 1 1 29 29 ASP C C 29 175.505 175.505 174.616 0.889 25149
4759 1 13 . 1 1 29 29 ASP CA C 29 55.266 55.266 53.846 1.420 25149
4760 1 13 . 1 1 29 29 ASP CB C 29 41.225 41.225 40.132 1.093 25149
4761 1 13 . 1 1 29 29 ASP H H 29 8.271 8.271 8.457 -0.186 25149
4762 1 13 . 1 1 30 30 CYS N N 30 124.470 124.470 119.424 5.046 25149
4763 1 13 . 1 1 30 30 CYS HA H 30 4.390 4.390 4.877 -0.487 25149
4764 1 13 . 1 1 30 30 CYS C C 30 171.755 171.755 172.853 -1.098 25149
4765 1 13 . 1 1 30 30 CYS CA C 30 57.676 57.676 56.699 0.977 25149
4766 1 13 . 1 1 30 30 CYS CB C 30 29.154 29.154 29.973 -0.819 25149
4767 1 13 . 1 1 30 30 CYS H H 30 7.912 7.912 8.362 -0.450 25149
4768 1 13 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.596 0.091 25149
4769 1 13 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.621 0.254 25149
4770 1 13 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.251 1.734 25149
4771 1 13 . 1 1 32 32 LEU N N 32 120.023 120.023 118.161 1.862 25149
4772 1 13 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.412 0.304 25149
4773 1 13 . 1 1 32 32 LEU C C 32 176.300 176.300 175.508 0.792 25149
4774 1 13 . 1 1 32 32 LEU CA C 32 53.921 53.921 54.076 -0.155 25149
4775 1 13 . 1 1 32 32 LEU CB C 32 43.336 43.336 43.031 0.305 25149
4776 1 13 . 1 1 32 32 LEU H H 32 8.580 8.580 8.005 0.575 25149
4777 1 13 . 1 1 33 33 VAL N N 33 116.217 116.217 117.023 -0.806 25149
4778 1 13 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.339 0.324 25149
4779 1 13 . 1 1 33 33 VAL C C 33 171.374 171.374 174.082 -2.708 25149
4780 1 13 . 1 1 33 33 VAL CA C 33 60.449 60.449 61.697 -1.248 25149
4781 1 13 . 1 1 33 33 VAL CB C 33 36.448 36.448 35.477 0.971 25149
4782 1 13 . 1 1 33 33 VAL H H 33 8.594 8.594 8.097 0.497 25149
4783 1 13 . 1 1 34 34 TRP N N 34 122.711 122.711 123.778 -1.067 25149
4784 1 13 . 1 1 34 34 TRP HA H 34 5.339 5.339 4.765 0.574 25149
4785 1 13 . 1 1 34 34 TRP C C 34 176.770 176.770 175.298 1.472 25149
4786 1 13 . 1 1 34 34 TRP CA C 34 57.267 57.267 55.684 1.583 25149
4787 1 13 . 1 1 34 34 TRP CB C 34 33.780 33.780 33.533 0.247 25149
4788 1 13 . 1 1 34 34 TRP H H 34 8.756 8.756 8.173 0.583 25149
4789 1 13 . 1 1 35 35 GLY N N 35 107.569 107.569 105.800 1.769 25149
4790 1 13 . 1 1 35 35 GLY C C 35 177.397 177.397 173.445 3.952 25149
4791 1 13 . 1 1 35 35 GLY CA C 35 44.070 44.070 43.845 0.225 25149
4792 1 13 . 1 1 35 35 GLY H H 35 8.857 8.857 8.146 0.711 25149
4793 1 13 . 1 1 36 36 GLN N N 36 122.723 122.723 118.591 4.132 25149
4794 1 13 . 1 1 36 36 GLN HA H 36 3.746 3.746 3.997 -0.251 25149
4795 1 13 . 1 1 36 36 GLN C C 36 176.445 176.445 175.913 0.532 25149
4796 1 13 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.194 0.235 25149
4797 1 13 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.403 -0.772 25149
4798 1 13 . 1 1 36 36 GLN H H 36 8.338 8.338 8.615 -0.277 25149
4799 1 13 . 1 1 37 37 CYS N N 37 115.763 115.763 114.000 1.763 25149
4800 1 13 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.873 -0.589 25149
4801 1 13 . 1 1 37 37 CYS C C 37 175.281 175.281 176.258 -0.977 25149
4802 1 13 . 1 1 37 37 CYS CA C 37 58.395 58.395 55.575 2.820 25149
4803 1 13 . 1 1 37 37 CYS CB C 37 31.143 31.143 31.080 0.063 25149
4804 1 13 . 1 1 37 37 CYS H H 37 7.622 7.622 7.413 0.209 25149
4805 1 13 . 1 1 38 38 SER N N 38 114.540 114.540 115.832 -1.292 25149
4806 1 13 . 1 1 38 38 SER HA H 38 4.004 4.004 4.124 -0.120 25149
4807 1 13 . 1 1 38 38 SER C C 38 173.389 173.389 174.396 -1.007 25149
4808 1 13 . 1 1 38 38 SER CA C 38 62.285 62.285 60.815 1.470 25149
4809 1 13 . 1 1 38 38 SER H H 38 7.716 7.716 8.401 -0.685 25149
4810 1 13 . 1 1 39 39 HIS N N 39 121.947 121.947 119.259 2.688 25149
4811 1 13 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.044 0.400 25149
4812 1 13 . 1 1 39 39 HIS C C 39 172.326 172.326 173.658 -1.332 25149
4813 1 13 . 1 1 39 39 HIS CA C 39 61.320 61.320 57.003 4.317 25149
4814 1 13 . 1 1 39 39 HIS CB C 39 31.523 31.523 29.544 1.979 25149
4815 1 13 . 1 1 39 39 HIS H H 39 7.829 7.829 8.060 -0.231 25149
4816 1 13 . 1 1 40 40 CYS N N 40 121.859 121.859 121.349 0.510 25149
4817 1 13 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.310 0.299 25149
4818 1 13 . 1 1 40 40 CYS C C 40 171.900 171.900 171.583 0.317 25149
4819 1 13 . 1 1 40 40 CYS CA C 40 55.791 55.791 56.046 -0.255 25149
4820 1 13 . 1 1 40 40 CYS CB C 40 28.964 28.964 28.309 0.655 25149
4821 1 13 . 1 1 40 40 CYS H H 40 8.049 8.049 7.946 0.103 25149
4822 1 13 . 1 1 41 41 PHE N N 41 120.690 120.690 119.857 0.833 25149
4823 1 13 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.866 0.311 25149
4824 1 13 . 1 1 41 41 PHE C C 41 176.613 176.613 175.281 1.332 25149
4825 1 13 . 1 1 41 41 PHE CA C 41 56.033 56.033 54.717 1.317 25149
4826 1 13 . 1 1 41 41 PHE CB C 41 45.760 45.760 42.779 2.981 25149
4827 1 13 . 1 1 41 41 PHE H H 41 8.368 8.368 8.286 0.082 25149
4828 1 13 . 1 1 42 42 HIS N N 42 117.057 117.057 119.826 -2.769 25149
4829 1 13 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.547 0.122 25149
4830 1 13 . 1 1 42 42 HIS C C 42 177.464 177.464 176.499 0.965 25149
4831 1 13 . 1 1 42 42 HIS CA C 42 60.425 60.425 58.026 2.399 25149
4832 1 13 . 1 1 42 42 HIS CB C 42 29.740 29.740 29.908 -0.168 25149
4833 1 13 . 1 1 42 42 HIS H H 42 8.384 8.384 9.114 -0.730 25149
4834 1 13 . 1 1 43 43 MET N N 43 128.543 128.543 126.135 2.408 25149
4835 1 13 . 1 1 43 43 MET HA H 43 3.965 3.965 4.115 -0.150 25149
4836 1 13 . 1 1 43 43 MET C C 43 177.845 177.845 177.255 0.590 25149
4837 1 13 . 1 1 43 43 MET CA C 43 59.209 59.209 60.712 -1.503 25149
4838 1 13 . 1 1 43 43 MET CB C 43 33.009 33.009 32.709 0.300 25149
4839 1 13 . 1 1 43 43 MET H H 43 9.439 9.439 7.987 1.452 25149
4840 1 13 . 1 1 44 44 HIS N N 44 116.500 116.500 117.567 -1.067 25149
4841 1 13 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.312 -0.056 25149
4842 1 13 . 1 1 44 44 HIS C C 44 178.405 178.405 177.905 0.500 25149
4843 1 13 . 1 1 44 44 HIS CA C 44 58.793 58.793 59.483 -0.690 25149
4844 1 13 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.012 3.735 25149
4845 1 13 . 1 1 44 44 HIS H H 44 9.747 9.747 8.062 1.685 25149
4846 1 13 . 1 1 45 45 CYS N N 45 115.950 115.950 117.821 -1.871 25149
4847 1 13 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.129 -0.129 25149
4848 1 13 . 1 1 45 45 CYS C C 45 177.957 177.957 177.015 0.942 25149
4849 1 13 . 1 1 45 45 CYS CA C 45 62.923 62.923 63.485 -0.562 25149
4850 1 13 . 1 1 45 45 CYS CB C 45 29.102 29.102 26.400 2.702 25149
4851 1 13 . 1 1 45 45 CYS H H 45 6.845 6.845 8.224 -1.379 25149
4852 1 13 . 1 1 46 46 ILE N N 46 119.362 119.362 121.005 -1.643 25149
4853 1 13 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.773 -0.108 25149
4854 1 13 . 1 1 46 46 ILE C C 46 176.613 176.613 177.804 -1.191 25149
4855 1 13 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.347 -4.105 25149
4856 1 13 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.822 -0.503 25149
4857 1 13 . 1 1 46 46 ILE H H 46 7.816 7.816 7.961 -0.145 25149
4858 1 13 . 1 1 47 47 LEU N N 47 122.180 122.180 121.033 1.147 25149
4859 1 13 . 1 1 47 47 LEU HA H 47 3.873 3.873 4.233 -0.360 25149
4860 1 13 . 1 1 47 47 LEU C C 47 179.726 179.726 178.989 0.737 25149
4861 1 13 . 1 1 47 47 LEU CA C 47 58.633 58.633 59.328 -0.695 25149
4862 1 13 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.948 -0.825 25149
4863 1 13 . 1 1 47 47 LEU H H 47 8.266 8.266 8.620 -0.354 25149
4864 1 13 . 1 1 48 48 LYS N N 48 118.251 118.251 118.810 -0.559 25149
4865 1 13 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.165 -0.300 25149
4866 1 13 . 1 1 48 48 LYS C C 48 179.423 179.423 178.744 0.679 25149
4867 1 13 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.631 0.356 25149
4868 1 13 . 1 1 48 48 LYS CB C 48 32.765 32.765 31.980 0.784 25149
4869 1 13 . 1 1 48 48 LYS H H 48 7.147 7.147 8.594 -1.447 25149
4870 1 13 . 1 1 49 49 TRP N N 49 120.745 120.745 121.061 -0.316 25149
4871 1 13 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.292 -0.212 25149
4872 1 13 . 1 1 49 49 TRP C C 49 178.147 178.147 178.314 -0.167 25149
4873 1 13 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.813 -0.268 25149
4874 1 13 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.303 0.112 25149
4875 1 13 . 1 1 49 49 TRP H H 49 7.709 7.709 8.095 -0.386 25149
4876 1 13 . 1 1 50 50 LEU N N 50 117.236 117.236 117.651 -0.415 25149
4877 1 13 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.525 0.080 25149
4878 1 13 . 1 1 50 50 LEU C C 50 179.658 179.658 177.084 2.574 25149
4879 1 13 . 1 1 50 50 LEU CA C 50 57.330 57.330 55.460 1.870 25149
4880 1 13 . 1 1 50 50 LEU CB C 50 41.416 41.416 41.950 -0.534 25149
4881 1 13 . 1 1 50 50 LEU H H 50 8.512 8.512 7.921 0.591 25149
4882 1 13 . 1 1 51 51 HIS N N 51 115.650 115.650 117.866 -2.216 25149
4883 1 13 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.492 -0.218 25149
4884 1 13 . 1 1 51 51 HIS C C 51 175.942 175.942 175.545 0.397 25149
4885 1 13 . 1 1 51 51 HIS CA C 51 57.320 57.320 56.498 0.822 25149
4886 1 13 . 1 1 51 51 HIS CB C 51 29.487 29.487 30.384 -0.897 25149
4887 1 13 . 1 1 51 51 HIS H H 51 7.713 7.713 8.340 -0.627 25149
4888 1 13 . 1 1 52 52 ALA N N 52 119.779 119.779 122.021 -2.242 25149
4889 1 13 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.412 -0.389 25149
4890 1 13 . 1 1 52 52 ALA C C 52 177.834 177.834 177.607 0.227 25149
4891 1 13 . 1 1 52 52 ALA CA C 52 52.865 52.865 52.764 0.102 25149
4892 1 13 . 1 1 52 52 ALA CB C 52 18.951 18.951 19.666 -0.715 25149
4893 1 13 . 1 1 52 52 ALA H H 52 7.191 7.191 7.863 -0.672 25149
4894 1 13 . 1 1 53 53 GLN N N 53 117.047 117.047 119.351 -2.304 25149
4895 1 13 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.227 -0.294 25149
4896 1 13 . 1 1 53 53 GLN C C 53 175.998 175.998 175.542 0.456 25149
4897 1 13 . 1 1 53 53 GLN CA C 53 55.482 55.482 55.922 -0.441 25149
4898 1 13 . 1 1 53 53 GLN CB C 53 28.887 28.887 28.990 -0.103 25149
4899 1 13 . 1 1 53 53 GLN H H 53 7.317 7.317 7.763 -0.446 25149
4900 1 13 . 1 1 54 54 GLN N N 54 118.463 118.463 121.516 -3.053 25149
4901 1 13 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.478 -0.489 25149
4902 1 13 . 1 1 54 54 GLN C C 54 176.300 176.300 175.537 0.763 25149
4903 1 13 . 1 1 54 54 GLN CA C 54 57.314 57.314 55.758 1.556 25149
4904 1 13 . 1 1 54 54 GLN CB C 54 28.823 28.823 27.643 1.179 25149
4905 1 13 . 1 1 54 54 GLN H H 54 7.949 7.949 8.547 -0.598 25149
4906 1 13 . 1 1 55 55 VAL N N 55 116.755 116.755 116.472 0.283 25149
4907 1 13 . 1 1 55 55 VAL HA H 55 3.884 3.884 4.115 -0.231 25149
4908 1 13 . 1 1 55 55 VAL C C 55 175.774 175.774 175.644 0.130 25149
4909 1 13 . 1 1 55 55 VAL CA C 55 63.210 63.210 61.936 1.274 25149
4910 1 13 . 1 1 55 55 VAL CB C 55 32.870 32.870 32.081 0.789 25149
4911 1 13 . 1 1 55 55 VAL H H 55 7.801 7.801 7.757 0.044 25149
4912 1 13 . 1 1 56 56 GLN N N 56 120.192 120.192 118.871 1.321 25149
4913 1 13 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.605 -0.488 25149
4914 1 13 . 1 1 56 56 GLN C C 56 175.236 175.236 175.093 0.143 25149
4915 1 13 . 1 1 56 56 GLN CA C 56 55.697 55.697 55.278 0.419 25149
4916 1 13 . 1 1 56 56 GLN CB C 56 29.319 29.319 31.569 -2.250 25149
4917 1 13 . 1 1 56 56 GLN H H 56 8.018 8.018 7.672 0.346 25149
4918 1 13 . 1 1 57 57 GLN N N 57 121.276 121.276 121.067 0.209 25149
4919 1 13 . 1 1 57 57 GLN HA H 57 4.204 4.204 4.214 -0.010 25149
4920 1 13 . 1 1 57 57 GLN C C 57 175.819 175.819 175.936 -0.117 25149
4921 1 13 . 1 1 57 57 GLN CA C 57 55.617 55.617 55.914 -0.297 25149
4922 1 13 . 1 1 57 57 GLN CB C 57 29.094 29.094 28.933 0.161 25149
4923 1 13 . 1 1 57 57 GLN H H 57 8.471 8.471 8.644 -0.173 25149
4924 1 13 . 1 1 58 58 HIS N N 58 120.001 120.001 120.453 -0.452 25149
4925 1 13 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.675 0.499 25149
4926 1 13 . 1 1 58 58 HIS C C 58 173.636 173.636 176.270 -2.634 25149
4927 1 13 . 1 1 58 58 HIS CA C 58 54.353 54.353 56.722 -2.369 25149
4928 1 13 . 1 1 58 58 HIS CB C 58 33.057 33.057 29.502 3.555 25149
4929 1 13 . 1 1 58 58 HIS H H 58 8.366 8.366 7.702 0.664 25149
4930 1 13 . 1 1 59 59 CYS N N 59 121.924 121.924 123.077 -1.153 25149
4931 1 13 . 1 1 59 59 CYS HA H 59 4.442 4.442 4.165 0.277 25149
4932 1 13 . 1 1 59 59 CYS C C 59 176.334 176.334 174.798 1.536 25149
4933 1 13 . 1 1 59 59 CYS CA C 59 56.772 56.772 58.715 -1.942 25149
4934 1 13 . 1 1 59 59 CYS CB C 59 32.642 32.642 27.799 4.843 25149
4935 1 13 . 1 1 59 59 CYS H H 59 9.035 9.035 8.737 0.298 25149
4936 1 13 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.254 -0.441 25149
4937 1 13 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.955 -0.294 25149
4938 1 13 . 1 1 60 60 PRO CB C 60 30.659 30.659 31.142 -0.483 25149
4939 1 13 . 1 1 61 61 MET N N 61 117.676 117.676 115.473 2.203 25149
4940 1 13 . 1 1 61 61 MET HA H 61 4.317 4.317 4.191 0.126 25149
4941 1 13 . 1 1 61 61 MET C C 61 177.117 177.117 176.714 0.403 25149
4942 1 13 . 1 1 61 61 MET CA C 61 56.408 56.408 57.387 -0.979 25149
4943 1 13 . 1 1 61 61 MET CB C 61 32.551 32.551 32.684 -0.133 25149
4944 1 13 . 1 1 61 61 MET H H 61 9.135 9.135 7.745 1.390 25149
4945 1 13 . 1 1 62 62 CYS N N 62 117.214 117.214 115.550 1.664 25149
4946 1 13 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.548 0.326 25149
4947 1 13 . 1 1 62 62 CYS C C 62 175.740 175.740 175.158 0.582 25149
4948 1 13 . 1 1 62 62 CYS CA C 62 58.273 58.273 57.157 1.116 25149
4949 1 13 . 1 1 62 62 CYS CB C 62 32.776 32.776 29.810 2.966 25149
4950 1 13 . 1 1 62 62 CYS H H 62 8.011 8.011 7.669 0.342 25149
4951 1 13 . 1 1 63 63 ARG N N 63 116.555 116.555 118.948 -2.393 25149
4952 1 13 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.491 -0.566 25149
4953 1 13 . 1 1 63 63 ARG C C 63 175.326 175.326 175.324 0.002 25149
4954 1 13 . 1 1 63 63 ARG CA C 63 58.073 58.073 55.419 2.654 25149
4955 1 13 . 1 1 63 63 ARG CB C 63 27.136 27.136 30.484 -3.348 25149
4956 1 13 . 1 1 63 63 ARG H H 63 8.086 8.086 8.445 -0.359 25149
4957 1 13 . 1 1 64 64 GLN N N 64 118.932 118.932 119.185 -0.253 25149
4958 1 13 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.635 -0.376 25149
4959 1 13 . 1 1 64 64 GLN C C 64 176.054 176.054 175.861 0.193 25149
4960 1 13 . 1 1 64 64 GLN CA C 64 56.316 56.316 54.282 2.034 25149
4961 1 13 . 1 1 64 64 GLN CB C 64 30.083 30.083 30.105 -0.022 25149
4962 1 13 . 1 1 64 64 GLN H H 64 8.003 8.003 7.694 0.309 25149
4963 1 13 . 1 1 65 65 GLU N N 65 122.038 122.038 121.467 0.571 25149
4964 1 13 . 1 1 65 65 GLU HA H 65 4.003 4.003 4.175 -0.172 25149
4965 1 13 . 1 1 65 65 GLU C C 65 176.781 176.781 176.064 0.717 25149
4966 1 13 . 1 1 65 65 GLU CA C 65 57.682 57.682 56.595 1.087 25149
4967 1 13 . 1 1 65 65 GLU CB C 65 29.900 29.900 28.726 1.174 25149
4968 1 13 . 1 1 65 65 GLU H H 65 8.657 8.657 8.728 -0.071 25149
4969 1 13 . 1 1 66 66 TRP N N 66 125.730 125.730 126.685 -0.955 25149
4970 1 13 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.434 -0.030 25149
4971 1 13 . 1 1 66 66 TRP C C 66 175.460 175.460 174.746 0.714 25149
4972 1 13 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.967 -0.342 25149
4973 1 13 . 1 1 66 66 TRP CB C 66 29.358 29.358 29.948 -0.590 25149
4974 1 13 . 1 1 66 66 TRP H H 66 8.499 8.499 8.054 0.445 25149
4975 1 13 . 1 1 67 67 LYS N N 67 127.396 127.396 127.180 0.216 25149
4976 1 13 . 1 1 67 67 LYS HA H 67 4.018 4.018 3.921 0.097 25149
4977 1 13 . 1 1 67 67 LYS C C 67 175.180 175.180 175.488 -0.308 25149
4978 1 13 . 1 1 67 67 LYS CA C 67 54.514 54.514 53.994 0.520 25149
4979 1 13 . 1 1 67 67 LYS CB C 67 36.231 36.231 34.622 1.609 25149
4980 1 13 . 1 1 67 67 LYS H H 67 6.930 6.930 8.194 -1.264 25149
4981 1 13 . 1 1 68 68 PHE N N 68 121.511 121.511 123.530 -2.019 25149
4982 1 13 . 1 1 68 68 PHE HA H 68 4.108 4.108 3.919 0.189 25149
4983 1 13 . 1 1 68 68 PHE C C 68 176.613 176.613 176.018 0.595 25149
4984 1 13 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.810 2.151 25149
4985 1 13 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.344 1.918 25149
4986 1 13 . 1 1 68 68 PHE H H 68 8.430 8.430 8.460 -0.030 25149
4987 1 13 . 1 1 69 69 LYS N N 69 124.210 124.210 122.507 1.703 25149
4988 1 13 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.211 -0.216 25149
4989 1 13 . 1 1 69 69 LYS C C 69 175.651 175.651 175.645 0.006 25149
4990 1 13 . 1 1 69 69 LYS CA C 69 57.320 57.320 56.398 0.922 25149
4991 1 13 . 1 1 69 69 LYS CB C 69 33.361 33.361 34.186 -0.825 25149
4992 1 13 . 1 1 69 69 LYS H H 69 8.738 8.738 8.126 0.612 25149
4993 1 14 . 1 1 2 2 SER HA H 2 4.417 4.417 4.555 -0.138 25149
4994 1 14 . 1 1 2 2 SER CA C 2 58.322 58.322 57.981 0.341 25149
4995 1 14 . 1 1 2 2 SER CB C 2 64.169 64.169 64.424 -0.255 25149
4996 1 14 . 1 1 3 3 VAL N N 3 121.214 121.214 120.263 0.951 25149
4997 1 14 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.166 -0.120 25149
4998 1 14 . 1 1 3 3 VAL C C 3 175.879 175.879 174.656 1.223 25149
4999 1 14 . 1 1 3 3 VAL CA C 3 62.138 62.138 62.260 -0.122 25149
5000 1 14 . 1 1 3 3 VAL CB C 3 32.958 32.958 30.107 2.851 25149
5001 1 14 . 1 1 3 3 VAL H H 3 8.170 8.170 8.346 -0.176 25149
5002 1 14 . 1 1 4 4 ALA N N 4 127.312 127.312 130.704 -3.392 25149
5003 1 14 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.773 -0.576 25149
5004 1 14 . 1 1 4 4 ALA C C 4 177.497 177.497 176.258 1.239 25149
5005 1 14 . 1 1 4 4 ALA CA C 4 52.439 52.439 51.612 0.827 25149
5006 1 14 . 1 1 4 4 ALA CB C 4 19.424 19.424 20.361 -0.937 25149
5007 1 14 . 1 1 4 4 ALA H H 4 8.294 8.294 8.083 0.211 25149
5008 1 14 . 1 1 5 5 ASN N N 5 117.674 117.674 122.291 -4.617 25149
5009 1 14 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.798 -0.233 25149
5010 1 14 . 1 1 5 5 ASN C C 5 175.048 175.048 174.023 1.025 25149
5011 1 14 . 1 1 5 5 ASN CA C 5 53.725 53.725 52.579 1.146 25149
5012 1 14 . 1 1 5 5 ASN CB C 5 39.197 39.197 41.215 -2.018 25149
5013 1 14 . 1 1 5 5 ASN H H 5 8.252 8.252 8.349 -0.097 25149
5014 1 14 . 1 1 6 6 ASP N N 6 119.896 119.896 117.414 2.482 25149
5015 1 14 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.410 0.110 25149
5016 1 14 . 1 1 6 6 ASP C C 6 176.269 176.269 175.351 0.918 25149
5017 1 14 . 1 1 6 6 ASP CA C 6 54.497 54.497 55.654 -1.157 25149
5018 1 14 . 1 1 6 6 ASP CB C 6 41.104 41.104 40.231 0.873 25149
5019 1 14 . 1 1 6 6 ASP H H 6 8.215 8.215 8.546 -0.331 25149
5020 1 14 . 1 1 7 7 GLU N N 7 119.101 119.101 117.133 1.968 25149
5021 1 14 . 1 1 7 7 GLU HA H 7 4.243 4.243 4.546 -0.303 25149
5022 1 14 . 1 1 7 7 GLU C C 7 175.006 175.006 174.839 0.167 25149
5023 1 14 . 1 1 7 7 GLU CA C 7 56.689 56.689 55.994 0.695 25149
5024 1 14 . 1 1 7 7 GLU CB C 7 30.379 30.379 29.980 0.399 25149
5025 1 14 . 1 1 7 7 GLU H H 7 8.065 8.065 8.421 -0.356 25149
5026 1 14 . 1 1 8 8 ASN N N 8 116.852 116.852 115.289 1.563 25149
5027 1 14 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.740 -0.582 25149
5028 1 14 . 1 1 8 8 ASN C C 8 172.706 172.706 174.986 -2.280 25149
5029 1 14 . 1 1 8 8 ASN CA C 8 51.165 51.165 50.995 0.170 25149
5030 1 14 . 1 1 8 8 ASN CB C 8 40.702 40.702 40.400 0.302 25149
5031 1 14 . 1 1 8 8 ASN H H 8 7.505 7.505 7.599 -0.094 25149
5032 1 14 . 1 1 9 9 CYS N N 9 122.855 122.855 119.601 3.254 25149
5033 1 14 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.885 -0.091 25149
5034 1 14 . 1 1 9 9 CYS C C 9 178.370 178.370 176.361 2.009 25149
5035 1 14 . 1 1 9 9 CYS CA C 9 59.552 59.552 60.764 -1.212 25149
5036 1 14 . 1 1 9 9 CYS CB C 9 31.526 31.526 28.670 2.856 25149
5037 1 14 . 1 1 9 9 CYS H H 9 7.614 7.614 7.789 -0.175 25149
5038 1 14 . 1 1 10 10 GLY N N 10 117.295 117.295 108.694 8.601 25149
5039 1 14 . 1 1 10 10 GLY C C 10 174.111 174.111 174.686 -0.575 25149
5040 1 14 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.768 1.199 25149
5041 1 14 . 1 1 10 10 GLY H H 10 9.235 9.235 7.744 1.491 25149
5042 1 14 . 1 1 11 11 ILE N N 11 119.811 119.811 119.401 0.410 25149
5043 1 14 . 1 1 11 11 ILE HA H 11 3.809 3.809 4.026 -0.217 25149
5044 1 14 . 1 1 11 11 ILE C C 11 176.121 176.121 176.487 -0.366 25149
5045 1 14 . 1 1 11 11 ILE CA C 11 64.041 64.041 64.056 -0.015 25149
5046 1 14 . 1 1 11 11 ILE CB C 11 39.411 39.411 38.997 0.414 25149
5047 1 14 . 1 1 11 11 ILE H H 11 8.285 8.285 7.682 0.603 25149
5048 1 14 . 1 1 12 12 CYS N N 12 116.728 116.728 116.887 -0.159 25149
5049 1 14 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.679 -0.103 25149
5050 1 14 . 1 1 12 12 CYS C C 12 175.975 175.975 173.722 2.253 25149
5051 1 14 . 1 1 12 12 CYS CA C 12 59.225 59.225 57.981 1.244 25149
5052 1 14 . 1 1 12 12 CYS CB C 12 32.246 32.246 29.915 2.331 25149
5053 1 14 . 1 1 12 12 CYS H H 12 7.607 7.607 7.645 -0.038 25149
5054 1 14 . 1 1 13 13 ARG N N 13 116.073 116.073 116.221 -0.148 25149
5055 1 14 . 1 1 13 13 ARG HA H 13 3.742 3.742 4.006 -0.264 25149
5056 1 14 . 1 1 13 13 ARG C C 13 174.979 174.979 175.062 -0.083 25149
5057 1 14 . 1 1 13 13 ARG CA C 13 57.636 57.636 57.261 0.374 25149
5058 1 14 . 1 1 13 13 ARG CB C 13 26.326 26.326 27.243 -0.917 25149
5059 1 14 . 1 1 13 13 ARG H H 13 7.987 7.987 8.039 -0.052 25149
5060 1 14 . 1 1 14 14 MET N N 14 119.313 119.313 116.541 2.772 25149
5061 1 14 . 1 1 14 14 MET HA H 14 4.547 4.547 4.310 0.237 25149
5062 1 14 . 1 1 14 14 MET C C 14 176.143 176.143 175.708 0.435 25149
5063 1 14 . 1 1 14 14 MET CA C 14 54.208 54.208 55.068 -0.860 25149
5064 1 14 . 1 1 14 14 MET CB C 14 33.951 33.951 34.055 -0.104 25149
5065 1 14 . 1 1 14 14 MET H H 14 8.624 8.624 7.682 0.942 25149
5066 1 14 . 1 1 15 15 ALA N N 15 122.683 122.683 120.893 1.790 25149
5067 1 14 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.415 -0.143 25149
5068 1 14 . 1 1 15 15 ALA C C 15 180.117 180.117 178.180 1.937 25149
5069 1 14 . 1 1 15 15 ALA CA C 15 52.346 52.346 50.427 1.919 25149
5070 1 14 . 1 1 15 15 ALA CB C 15 19.487 19.487 19.751 -0.264 25149
5071 1 14 . 1 1 15 15 ALA H H 15 7.965 7.965 8.270 -0.305 25149
5072 1 14 . 1 1 16 16 PHE N N 16 119.313 119.313 123.028 -3.715 25149
5073 1 14 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.222 -0.181 25149
5074 1 14 . 1 1 16 16 PHE C C 16 176.423 176.423 176.729 -0.306 25149
5075 1 14 . 1 1 16 16 PHE CA C 16 59.130 59.130 60.098 -0.968 25149
5076 1 14 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.558 -0.168 25149
5077 1 14 . 1 1 16 16 PHE H H 16 8.095 8.095 7.869 0.226 25149
5078 1 14 . 1 1 17 17 ASN N N 17 112.313 112.313 116.212 -3.899 25149
5079 1 14 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.827 -0.191 25149
5080 1 14 . 1 1 17 17 ASN C C 17 175.337 175.337 175.276 0.061 25149
5081 1 14 . 1 1 17 17 ASN CA C 17 52.961 52.961 53.572 -0.611 25149
5082 1 14 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.715 -1.541 25149
5083 1 14 . 1 1 17 17 ASN H H 17 7.823 7.823 8.244 -0.421 25149
5084 1 14 . 1 1 18 18 GLY N N 18 107.742 107.742 108.400 -0.658 25149
5085 1 14 . 1 1 18 18 GLY C C 18 173.759 173.759 172.499 1.260 25149
5086 1 14 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.560 -0.096 25149
5087 1 14 . 1 1 18 18 GLY H H 18 7.579 7.579 8.400 -0.821 25149
5088 1 14 . 1 1 19 19 CYS N N 19 117.050 117.050 116.488 0.562 25149
5089 1 14 . 1 1 19 19 CYS HA H 19 4.571 4.571 5.046 -0.475 25149
5090 1 14 . 1 1 19 19 CYS C C 19 174.039 174.039 174.603 -0.564 25149
5091 1 14 . 1 1 19 19 CYS CA C 19 58.433 58.433 55.707 2.726 25149
5092 1 14 . 1 1 19 19 CYS CB C 19 30.681 30.681 30.392 0.289 25149
5093 1 14 . 1 1 19 19 CYS H H 19 8.198 8.198 8.076 0.122 25149
5094 1 14 . 1 1 20 20 CYS N N 20 123.923 123.923 120.068 3.855 25149
5095 1 14 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.428 -0.417 25149
5096 1 14 . 1 1 20 20 CYS C C 20 173.736 173.736 174.980 -1.244 25149
5097 1 14 . 1 1 20 20 CYS CA C 20 57.999 57.999 57.413 0.586 25149
5098 1 14 . 1 1 20 20 CYS CB C 20 28.205 28.205 27.053 1.151 25149
5099 1 14 . 1 1 20 20 CYS H H 20 8.466 8.466 8.670 -0.204 25149
5100 1 14 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.368 -0.339 25149
5101 1 14 . 1 1 21 21 PRO CA C 21 65.426 65.426 64.781 0.645 25149
5102 1 14 . 1 1 21 21 PRO CB C 21 32.801 32.801 32.340 0.461 25149
5103 1 14 . 1 1 22 22 ASP N N 22 117.053 117.053 118.158 -1.105 25149
5104 1 14 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.666 -0.161 25149
5105 1 14 . 1 1 22 22 ASP C C 22 176.501 176.501 175.822 0.679 25149
5106 1 14 . 1 1 22 22 ASP CA C 22 55.017 55.017 54.371 0.646 25149
5107 1 14 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.634 1.888 25149
5108 1 14 . 1 1 22 22 ASP H H 22 8.395 8.395 8.497 -0.102 25149
5109 1 14 . 1 1 23 23 CYS N N 23 123.353 123.353 120.645 2.708 25149
5110 1 14 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.105 0.188 25149
5111 1 14 . 1 1 23 23 CYS C C 23 175.214 175.214 175.374 -0.160 25149
5112 1 14 . 1 1 23 23 CYS CA C 23 61.633 61.633 59.878 1.755 25149
5113 1 14 . 1 1 23 23 CYS CB C 23 31.542 31.542 26.758 4.784 25149
5114 1 14 . 1 1 23 23 CYS H H 23 7.246 7.246 7.786 -0.540 25149
5115 1 14 . 1 1 24 24 LYS N N 24 117.539 117.539 126.225 -8.686 25149
5116 1 14 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.037 0.193 25149
5117 1 14 . 1 1 24 24 LYS C C 24 177.106 177.106 175.811 1.295 25149
5118 1 14 . 1 1 24 24 LYS CA C 24 56.921 56.921 57.793 -0.872 25149
5119 1 14 . 1 1 24 24 LYS CB C 24 34.615 34.615 32.260 2.355 25149
5120 1 14 . 1 1 24 24 LYS H H 24 8.173 8.173 8.335 -0.162 25149
5121 1 14 . 1 1 25 25 VAL N N 25 120.661 120.661 117.682 2.979 25149
5122 1 14 . 1 1 25 25 VAL HA H 25 4.429 4.429 4.275 0.154 25149
5123 1 14 . 1 1 25 25 VAL C C 25 174.027 174.027 173.311 0.716 25149
5124 1 14 . 1 1 25 25 VAL CA C 25 59.934 59.934 59.454 0.480 25149
5125 1 14 . 1 1 25 25 VAL CB C 25 33.507 33.507 33.853 -0.346 25149
5126 1 14 . 1 1 25 25 VAL H H 25 7.787 7.787 7.770 0.017 25149
5127 1 14 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.562 -0.226 25149
5128 1 14 . 1 1 26 26 PRO CA C 26 63.279 63.279 63.056 0.223 25149
5129 1 14 . 1 1 26 26 PRO CB C 26 32.077 32.077 32.457 -0.380 25149
5130 1 14 . 1 1 27 27 GLY N N 27 109.926 109.926 111.985 -2.059 25149
5131 1 14 . 1 1 27 27 GLY C C 27 175.169 175.169 174.066 1.103 25149
5132 1 14 . 1 1 27 27 GLY CA C 27 45.042 45.042 45.245 -0.203 25149
5133 1 14 . 1 1 27 27 GLY H H 27 8.569 8.569 8.646 -0.077 25149
5134 1 14 . 1 1 28 28 ASP N N 28 122.592 122.592 120.343 2.249 25149
5135 1 14 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.927 -0.696 25149
5136 1 14 . 1 1 28 28 ASP C C 28 176.602 176.602 175.564 1.038 25149
5137 1 14 . 1 1 28 28 ASP CA C 28 56.402 56.402 54.082 2.320 25149
5138 1 14 . 1 1 28 28 ASP CB C 28 40.912 40.912 41.545 -0.633 25149
5139 1 14 . 1 1 28 28 ASP H H 28 8.214 8.214 8.582 -0.368 25149
5140 1 14 . 1 1 29 29 ASP N N 29 117.500 117.500 121.422 -3.922 25149
5141 1 14 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.914 -0.467 25149
5142 1 14 . 1 1 29 29 ASP C C 29 175.505 175.505 174.940 0.565 25149
5143 1 14 . 1 1 29 29 ASP CA C 29 55.266 55.266 54.244 1.022 25149
5144 1 14 . 1 1 29 29 ASP CB C 29 41.225 41.225 40.521 0.704 25149
5145 1 14 . 1 1 29 29 ASP H H 29 8.271 8.271 8.458 -0.187 25149
5146 1 14 . 1 1 30 30 CYS N N 30 124.470 124.470 119.467 5.003 25149
5147 1 14 . 1 1 30 30 CYS HA H 30 4.390 4.390 4.832 -0.442 25149
5148 1 14 . 1 1 30 30 CYS C C 30 171.755 171.755 173.273 -1.518 25149
5149 1 14 . 1 1 30 30 CYS CA C 30 57.676 57.676 56.557 1.119 25149
5150 1 14 . 1 1 30 30 CYS CB C 30 29.154 29.154 29.083 0.071 25149
5151 1 14 . 1 1 30 30 CYS H H 30 7.912 7.912 8.344 -0.432 25149
5152 1 14 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.587 0.100 25149
5153 1 14 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.774 0.101 25149
5154 1 14 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.376 1.608 25149
5155 1 14 . 1 1 32 32 LEU N N 32 120.023 120.023 115.509 4.514 25149
5156 1 14 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.738 -0.022 25149
5157 1 14 . 1 1 32 32 LEU C C 32 176.300 176.300 175.029 1.271 25149
5158 1 14 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.291 0.631 25149
5159 1 14 . 1 1 32 32 LEU CB C 32 43.336 43.336 44.068 -0.732 25149
5160 1 14 . 1 1 32 32 LEU H H 32 8.580 8.580 8.014 0.566 25149
5161 1 14 . 1 1 33 33 VAL N N 33 116.217 116.217 118.041 -1.824 25149
5162 1 14 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.593 0.070 25149
5163 1 14 . 1 1 33 33 VAL C C 33 171.374 171.374 173.853 -2.479 25149
5164 1 14 . 1 1 33 33 VAL CA C 33 60.449 60.449 60.348 0.101 25149
5165 1 14 . 1 1 33 33 VAL CB C 33 36.448 36.448 35.656 0.793 25149
5166 1 14 . 1 1 33 33 VAL H H 33 8.594 8.594 7.930 0.664 25149
5167 1 14 . 1 1 34 34 TRP N N 34 122.711 122.711 125.969 -3.258 25149
5168 1 14 . 1 1 34 34 TRP HA H 34 5.339 5.339 5.132 0.207 25149
5169 1 14 . 1 1 34 34 TRP C C 34 176.770 176.770 175.493 1.277 25149
5170 1 14 . 1 1 34 34 TRP CA C 34 57.267 57.267 55.682 1.585 25149
5171 1 14 . 1 1 34 34 TRP CB C 34 33.780 33.780 33.461 0.319 25149
5172 1 14 . 1 1 34 34 TRP H H 34 8.756 8.756 8.600 0.156 25149
5173 1 14 . 1 1 35 35 GLY N N 35 107.569 107.569 107.350 0.219 25149
5174 1 14 . 1 1 35 35 GLY C C 35 177.397 177.397 174.612 2.785 25149
5175 1 14 . 1 1 35 35 GLY CA C 35 44.070 44.070 44.153 -0.083 25149
5176 1 14 . 1 1 35 35 GLY H H 35 8.857 8.857 8.612 0.245 25149
5177 1 14 . 1 1 36 36 GLN N N 36 122.723 122.723 118.432 4.291 25149
5178 1 14 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.066 -0.320 25149
5179 1 14 . 1 1 36 36 GLN C C 36 176.445 176.445 176.086 0.359 25149
5180 1 14 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.114 0.315 25149
5181 1 14 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.320 -0.689 25149
5182 1 14 . 1 1 36 36 GLN H H 36 8.338 8.338 8.516 -0.178 25149
5183 1 14 . 1 1 37 37 CYS N N 37 115.763 115.763 113.426 2.337 25149
5184 1 14 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.908 -0.624 25149
5185 1 14 . 1 1 37 37 CYS C C 37 175.281 175.281 175.662 -0.381 25149
5186 1 14 . 1 1 37 37 CYS CA C 37 58.395 58.395 55.719 2.676 25149
5187 1 14 . 1 1 37 37 CYS CB C 37 31.143 31.143 31.105 0.038 25149
5188 1 14 . 1 1 37 37 CYS H H 37 7.622 7.622 7.726 -0.104 25149
5189 1 14 . 1 1 38 38 SER N N 38 114.540 114.540 114.952 -0.412 25149
5190 1 14 . 1 1 38 38 SER HA H 38 4.004 4.004 4.273 -0.269 25149
5191 1 14 . 1 1 38 38 SER C C 38 173.389 173.389 174.173 -0.784 25149
5192 1 14 . 1 1 38 38 SER CA C 38 62.285 62.285 60.488 1.797 25149
5193 1 14 . 1 1 38 38 SER H H 38 7.716 7.716 8.667 -0.951 25149
5194 1 14 . 1 1 39 39 HIS N N 39 121.947 121.947 120.184 1.763 25149
5195 1 14 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.338 0.105 25149
5196 1 14 . 1 1 39 39 HIS C C 39 172.326 172.326 173.605 -1.279 25149
5197 1 14 . 1 1 39 39 HIS CA C 39 61.320 61.320 57.007 4.313 25149
5198 1 14 . 1 1 39 39 HIS CB C 39 31.523 31.523 29.639 1.884 25149
5199 1 14 . 1 1 39 39 HIS H H 39 7.829 7.829 7.584 0.245 25149
5200 1 14 . 1 1 40 40 CYS N N 40 121.859 121.859 123.446 -1.587 25149
5201 1 14 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.522 0.087 25149
5202 1 14 . 1 1 40 40 CYS C C 40 171.900 171.900 172.234 -0.334 25149
5203 1 14 . 1 1 40 40 CYS CA C 40 55.791 55.791 55.523 0.268 25149
5204 1 14 . 1 1 40 40 CYS CB C 40 28.964 28.964 27.860 1.104 25149
5205 1 14 . 1 1 40 40 CYS H H 40 8.049 8.049 8.563 -0.514 25149
5206 1 14 . 1 1 41 41 PHE N N 41 120.690 120.690 121.555 -0.865 25149
5207 1 14 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.645 0.532 25149
5208 1 14 . 1 1 41 41 PHE C C 41 176.613 176.613 175.364 1.249 25149
5209 1 14 . 1 1 41 41 PHE CA C 41 56.033 56.033 55.517 0.516 25149
5210 1 14 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.150 2.610 25149
5211 1 14 . 1 1 41 41 PHE H H 41 8.368 8.368 8.458 -0.090 25149
5212 1 14 . 1 1 42 42 HIS N N 42 117.057 117.057 122.935 -5.878 25149
5213 1 14 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.306 0.363 25149
5214 1 14 . 1 1 42 42 HIS C C 42 177.464 177.464 176.219 1.245 25149
5215 1 14 . 1 1 42 42 HIS CA C 42 60.425 60.425 56.750 3.675 25149
5216 1 14 . 1 1 42 42 HIS CB C 42 29.740 29.740 29.564 0.176 25149
5217 1 14 . 1 1 42 42 HIS H H 42 8.384 8.384 7.590 0.794 25149
5218 1 14 . 1 1 43 43 MET N N 43 128.543 128.543 125.576 2.967 25149
5219 1 14 . 1 1 43 43 MET HA H 43 3.965 3.965 4.034 -0.069 25149
5220 1 14 . 1 1 43 43 MET C C 43 177.845 177.845 177.601 0.244 25149
5221 1 14 . 1 1 43 43 MET CA C 43 59.209 59.209 60.454 -1.245 25149
5222 1 14 . 1 1 43 43 MET CB C 43 33.009 33.009 32.748 0.261 25149
5223 1 14 . 1 1 43 43 MET H H 43 9.439 9.439 8.571 0.868 25149
5224 1 14 . 1 1 44 44 HIS N N 44 116.500 116.500 117.483 -0.983 25149
5225 1 14 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.222 0.034 25149
5226 1 14 . 1 1 44 44 HIS C C 44 178.405 178.405 178.000 0.405 25149
5227 1 14 . 1 1 44 44 HIS CA C 44 58.793 58.793 58.799 -0.006 25149
5228 1 14 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.308 3.439 25149
5229 1 14 . 1 1 44 44 HIS H H 44 9.747 9.747 8.034 1.713 25149
5230 1 14 . 1 1 45 45 CYS N N 45 115.950 115.950 117.256 -1.306 25149
5231 1 14 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.197 -0.197 25149
5232 1 14 . 1 1 45 45 CYS C C 45 177.957 177.957 176.624 1.333 25149
5233 1 14 . 1 1 45 45 CYS CA C 45 62.923 62.923 63.499 -0.576 25149
5234 1 14 . 1 1 45 45 CYS CB C 45 29.102 29.102 26.624 2.478 25149
5235 1 14 . 1 1 45 45 CYS H H 45 6.845 6.845 8.327 -1.482 25149
5236 1 14 . 1 1 46 46 ILE N N 46 119.362 119.362 120.939 -1.577 25149
5237 1 14 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.662 0.003 25149
5238 1 14 . 1 1 46 46 ILE C C 46 176.613 176.613 177.670 -1.057 25149
5239 1 14 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.648 -4.406 25149
5240 1 14 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.816 -0.497 25149
5241 1 14 . 1 1 46 46 ILE H H 46 7.816 7.816 7.925 -0.109 25149
5242 1 14 . 1 1 47 47 LEU N N 47 122.180 122.180 120.484 1.696 25149
5243 1 14 . 1 1 47 47 LEU HA H 47 3.873 3.873 4.183 -0.310 25149
5244 1 14 . 1 1 47 47 LEU C C 47 179.726 179.726 178.953 0.773 25149
5245 1 14 . 1 1 47 47 LEU CA C 47 58.633 58.633 59.183 -0.550 25149
5246 1 14 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.934 -0.811 25149
5247 1 14 . 1 1 47 47 LEU H H 47 8.266 8.266 8.643 -0.377 25149
5248 1 14 . 1 1 48 48 LYS N N 48 118.251 118.251 118.602 -0.351 25149
5249 1 14 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.207 -0.343 25149
5250 1 14 . 1 1 48 48 LYS C C 48 179.423 179.423 178.641 0.782 25149
5251 1 14 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.683 0.304 25149
5252 1 14 . 1 1 48 48 LYS CB C 48 32.765 32.765 31.893 0.872 25149
5253 1 14 . 1 1 48 48 LYS H H 48 7.147 7.147 8.356 -1.209 25149
5254 1 14 . 1 1 49 49 TRP N N 49 120.745 120.745 120.896 -0.151 25149
5255 1 14 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.351 -0.271 25149
5256 1 14 . 1 1 49 49 TRP C C 49 178.147 178.147 178.029 0.118 25149
5257 1 14 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.382 0.163 25149
5258 1 14 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.011 0.405 25149
5259 1 14 . 1 1 49 49 TRP H H 49 7.709 7.709 7.562 0.147 25149
5260 1 14 . 1 1 50 50 LEU N N 50 117.236 117.236 117.256 -0.020 25149
5261 1 14 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.583 0.022 25149
5262 1 14 . 1 1 50 50 LEU C C 50 179.658 179.658 176.745 2.913 25149
5263 1 14 . 1 1 50 50 LEU CA C 50 57.330 57.330 55.081 2.249 25149
5264 1 14 . 1 1 50 50 LEU CB C 50 41.416 41.416 41.970 -0.554 25149
5265 1 14 . 1 1 50 50 LEU H H 50 8.512 8.512 7.837 0.675 25149
5266 1 14 . 1 1 51 51 HIS N N 51 115.650 115.650 117.984 -2.334 25149
5267 1 14 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.471 -0.197 25149
5268 1 14 . 1 1 51 51 HIS C C 51 175.942 175.942 176.068 -0.126 25149
5269 1 14 . 1 1 51 51 HIS CA C 51 57.320 57.320 56.451 0.869 25149
5270 1 14 . 1 1 51 51 HIS CB C 51 29.487 29.487 30.458 -0.971 25149
5271 1 14 . 1 1 51 51 HIS H H 51 7.713 7.713 8.200 -0.487 25149
5272 1 14 . 1 1 52 52 ALA N N 52 119.779 119.779 122.091 -2.312 25149
5273 1 14 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.212 -0.189 25149
5274 1 14 . 1 1 52 52 ALA C C 52 177.834 177.834 177.760 0.074 25149
5275 1 14 . 1 1 52 52 ALA CA C 52 52.865 52.865 53.074 -0.209 25149
5276 1 14 . 1 1 52 52 ALA CB C 52 18.951 18.951 19.255 -0.304 25149
5277 1 14 . 1 1 52 52 ALA H H 52 7.191 7.191 8.092 -0.901 25149
5278 1 14 . 1 1 53 53 GLN N N 53 117.047 117.047 116.891 0.156 25149
5279 1 14 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.270 -0.337 25149
5280 1 14 . 1 1 53 53 GLN C C 53 175.998 175.998 175.903 0.095 25149
5281 1 14 . 1 1 53 53 GLN CA C 53 55.482 55.482 54.941 0.541 25149
5282 1 14 . 1 1 53 53 GLN CB C 53 28.887 28.887 28.882 0.005 25149
5283 1 14 . 1 1 53 53 GLN H H 53 7.317 7.317 8.027 -0.710 25149
5284 1 14 . 1 1 54 54 GLN N N 54 118.463 118.463 117.659 0.804 25149
5285 1 14 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.388 -0.399 25149
5286 1 14 . 1 1 54 54 GLN C C 54 176.300 176.300 175.641 0.659 25149
5287 1 14 . 1 1 54 54 GLN CA C 54 57.314 57.314 57.222 0.092 25149
5288 1 14 . 1 1 54 54 GLN CB C 54 28.823 28.823 29.515 -0.692 25149
5289 1 14 . 1 1 54 54 GLN H H 54 7.949 7.949 8.548 -0.599 25149
5290 1 14 . 1 1 55 55 VAL N N 55 116.755 116.755 117.286 -0.531 25149
5291 1 14 . 1 1 55 55 VAL HA H 55 3.884 3.884 4.363 -0.479 25149
5292 1 14 . 1 1 55 55 VAL C C 55 175.774 175.774 176.191 -0.417 25149
5293 1 14 . 1 1 55 55 VAL CA C 55 63.210 63.210 62.251 0.959 25149
5294 1 14 . 1 1 55 55 VAL CB C 55 32.870 32.870 31.117 1.753 25149
5295 1 14 . 1 1 55 55 VAL H H 55 7.801 7.801 7.603 0.198 25149
5296 1 14 . 1 1 56 56 GLN N N 56 120.192 120.192 121.807 -1.615 25149
5297 1 14 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.192 -0.075 25149
5298 1 14 . 1 1 56 56 GLN C C 56 175.236 175.236 175.915 -0.679 25149
5299 1 14 . 1 1 56 56 GLN CA C 56 55.697 55.697 56.538 -0.841 25149
5300 1 14 . 1 1 56 56 GLN CB C 56 29.319 29.319 29.194 0.125 25149
5301 1 14 . 1 1 56 56 GLN H H 56 8.018 8.018 8.348 -0.330 25149
5302 1 14 . 1 1 57 57 GLN N N 57 121.276 121.276 120.653 0.623 25149
5303 1 14 . 1 1 57 57 GLN HA H 57 4.204 4.204 4.202 0.002 25149
5304 1 14 . 1 1 57 57 GLN C C 57 175.819 175.819 175.716 0.103 25149
5305 1 14 . 1 1 57 57 GLN CA C 57 55.617 55.617 55.862 -0.245 25149
5306 1 14 . 1 1 57 57 GLN CB C 57 29.094 29.094 29.010 0.084 25149
5307 1 14 . 1 1 57 57 GLN H H 57 8.471 8.471 8.541 -0.070 25149
5308 1 14 . 1 1 58 58 HIS N N 58 120.001 120.001 119.623 0.378 25149
5309 1 14 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.370 0.804 25149
5310 1 14 . 1 1 58 58 HIS C C 58 173.636 173.636 176.037 -2.401 25149
5311 1 14 . 1 1 58 58 HIS CA C 58 54.353 54.353 57.568 -3.215 25149
5312 1 14 . 1 1 58 58 HIS CB C 58 33.057 33.057 29.505 3.552 25149
5313 1 14 . 1 1 58 58 HIS H H 58 8.366 8.366 7.918 0.448 25149
5314 1 14 . 1 1 59 59 CYS N N 59 121.924 121.924 122.785 -0.861 25149
5315 1 14 . 1 1 59 59 CYS HA H 59 4.442 4.442 4.074 0.368 25149
5316 1 14 . 1 1 59 59 CYS C C 59 176.334 176.334 174.754 1.580 25149
5317 1 14 . 1 1 59 59 CYS CA C 59 56.772 56.772 59.812 -3.040 25149
5318 1 14 . 1 1 59 59 CYS CB C 59 32.642 32.642 27.756 4.886 25149
5319 1 14 . 1 1 59 59 CYS H H 59 9.035 9.035 8.249 0.786 25149
5320 1 14 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.311 -0.498 25149
5321 1 14 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.746 -0.085 25149
5322 1 14 . 1 1 60 60 PRO CB C 60 30.659 30.659 31.333 -0.674 25149
5323 1 14 . 1 1 61 61 MET N N 61 117.676 117.676 115.881 1.795 25149
5324 1 14 . 1 1 61 61 MET HA H 61 4.317 4.317 4.444 -0.127 25149
5325 1 14 . 1 1 61 61 MET C C 61 177.117 177.117 175.979 1.138 25149
5326 1 14 . 1 1 61 61 MET CA C 61 56.408 56.408 55.789 0.619 25149
5327 1 14 . 1 1 61 61 MET CB C 61 32.551 32.551 33.010 -0.459 25149
5328 1 14 . 1 1 61 61 MET H H 61 9.135 9.135 7.502 1.633 25149
5329 1 14 . 1 1 62 62 CYS N N 62 117.214 117.214 118.874 -1.660 25149
5330 1 14 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.540 0.334 25149
5331 1 14 . 1 1 62 62 CYS C C 62 175.740 175.740 175.538 0.202 25149
5332 1 14 . 1 1 62 62 CYS CA C 62 58.273 58.273 57.644 0.629 25149
5333 1 14 . 1 1 62 62 CYS CB C 62 32.776 32.776 30.017 2.759 25149
5334 1 14 . 1 1 62 62 CYS H H 62 8.011 8.011 7.943 0.068 25149
5335 1 14 . 1 1 63 63 ARG N N 63 116.555 116.555 119.347 -2.792 25149
5336 1 14 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.167 -0.242 25149
5337 1 14 . 1 1 63 63 ARG C C 63 175.326 175.326 176.103 -0.777 25149
5338 1 14 . 1 1 63 63 ARG CA C 63 58.073 58.073 56.978 1.095 25149
5339 1 14 . 1 1 63 63 ARG CB C 63 27.136 27.136 29.846 -2.710 25149
5340 1 14 . 1 1 63 63 ARG H H 63 8.086 8.086 8.409 -0.323 25149
5341 1 14 . 1 1 64 64 GLN N N 64 118.932 118.932 121.060 -2.128 25149
5342 1 14 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.311 -0.052 25149
5343 1 14 . 1 1 64 64 GLN C C 64 176.054 176.054 175.822 0.232 25149
5344 1 14 . 1 1 64 64 GLN CA C 64 56.316 56.316 56.179 0.137 25149
5345 1 14 . 1 1 64 64 GLN CB C 64 30.083 30.083 28.798 1.285 25149
5346 1 14 . 1 1 64 64 GLN H H 64 8.003 8.003 7.939 0.064 25149
5347 1 14 . 1 1 65 65 GLU N N 65 122.038 122.038 120.771 1.267 25149
5348 1 14 . 1 1 65 65 GLU HA H 65 4.003 4.003 4.056 -0.053 25149
5349 1 14 . 1 1 65 65 GLU C C 65 176.781 176.781 176.226 0.555 25149
5350 1 14 . 1 1 65 65 GLU CA C 65 57.682 57.682 56.364 1.318 25149
5351 1 14 . 1 1 65 65 GLU CB C 65 29.900 29.900 29.391 0.509 25149
5352 1 14 . 1 1 65 65 GLU H H 65 8.657 8.657 8.574 0.083 25149
5353 1 14 . 1 1 66 66 TRP N N 66 125.730 125.730 127.598 -1.868 25149
5354 1 14 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.251 0.153 25149
5355 1 14 . 1 1 66 66 TRP C C 66 175.460 175.460 175.309 0.151 25149
5356 1 14 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.588 0.037 25149
5357 1 14 . 1 1 66 66 TRP CB C 66 29.358 29.358 29.834 -0.476 25149
5358 1 14 . 1 1 66 66 TRP H H 66 8.499 8.499 8.252 0.247 25149
5359 1 14 . 1 1 67 67 LYS N N 67 127.396 127.396 127.289 0.107 25149
5360 1 14 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.109 -0.091 25149
5361 1 14 . 1 1 67 67 LYS C C 67 175.180 175.180 174.831 0.349 25149
5362 1 14 . 1 1 67 67 LYS CA C 67 54.514 54.514 53.987 0.527 25149
5363 1 14 . 1 1 67 67 LYS CB C 67 36.231 36.231 34.553 1.678 25149
5364 1 14 . 1 1 67 67 LYS H H 67 6.930 6.930 8.621 -1.691 25149
5365 1 14 . 1 1 68 68 PHE N N 68 121.511 121.511 126.071 -4.560 25149
5366 1 14 . 1 1 68 68 PHE HA H 68 4.108 4.108 4.001 0.107 25149
5367 1 14 . 1 1 68 68 PHE C C 68 176.613 176.613 175.688 0.925 25149
5368 1 14 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.553 2.408 25149
5369 1 14 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.970 1.292 25149
5370 1 14 . 1 1 68 68 PHE H H 68 8.430 8.430 8.502 -0.072 25149
5371 1 14 . 1 1 69 69 LYS N N 69 124.210 124.210 123.274 0.936 25149
5372 1 14 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.125 -0.130 25149
5373 1 14 . 1 1 69 69 LYS C C 69 175.651 175.651 175.939 -0.288 25149
5374 1 14 . 1 1 69 69 LYS CA C 69 57.320 57.320 57.132 0.188 25149
5375 1 14 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.161 0.200 25149
5376 1 14 . 1 1 69 69 LYS H H 69 8.738 8.738 7.995 0.743 25149
5377 1 15 . 1 1 2 2 SER HA H 2 4.417 4.417 4.765 -0.348 25149
5378 1 15 . 1 1 2 2 SER CA C 2 58.322 58.322 58.120 0.202 25149
5379 1 15 . 1 1 2 2 SER CB C 2 64.169 64.169 64.552 -0.383 25149
5380 1 15 . 1 1 3 3 VAL N N 3 121.214 121.214 123.600 -2.386 25149
5381 1 15 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.266 -0.220 25149
5382 1 15 . 1 1 3 3 VAL C C 3 175.879 175.879 175.676 0.203 25149
5383 1 15 . 1 1 3 3 VAL CA C 3 62.138 62.138 62.489 -0.351 25149
5384 1 15 . 1 1 3 3 VAL CB C 3 32.958 32.958 32.277 0.681 25149
5385 1 15 . 1 1 3 3 VAL H H 3 8.170 8.170 8.743 -0.573 25149
5386 1 15 . 1 1 4 4 ALA N N 4 127.312 127.312 129.488 -2.176 25149
5387 1 15 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.442 -0.245 25149
5388 1 15 . 1 1 4 4 ALA C C 4 177.497 177.497 176.701 0.796 25149
5389 1 15 . 1 1 4 4 ALA CA C 4 52.439 52.439 51.892 0.546 25149
5390 1 15 . 1 1 4 4 ALA CB C 4 19.424 19.424 19.124 0.300 25149
5391 1 15 . 1 1 4 4 ALA H H 4 8.294 8.294 8.662 -0.368 25149
5392 1 15 . 1 1 5 5 ASN N N 5 117.674 117.674 118.062 -0.388 25149
5393 1 15 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.730 -0.165 25149
5394 1 15 . 1 1 5 5 ASN C C 5 175.048 175.048 174.484 0.564 25149
5395 1 15 . 1 1 5 5 ASN CA C 5 53.725 53.725 53.119 0.606 25149
5396 1 15 . 1 1 5 5 ASN CB C 5 39.197 39.197 39.101 0.096 25149
5397 1 15 . 1 1 5 5 ASN H H 5 8.252 8.252 7.908 0.344 25149
5398 1 15 . 1 1 6 6 ASP N N 6 119.896 119.896 122.506 -2.610 25149
5399 1 15 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.757 -0.237 25149
5400 1 15 . 1 1 6 6 ASP C C 6 176.269 176.269 175.804 0.465 25149
5401 1 15 . 1 1 6 6 ASP CA C 6 54.497 54.497 53.794 0.703 25149
5402 1 15 . 1 1 6 6 ASP CB C 6 41.104 41.104 41.812 -0.708 25149
5403 1 15 . 1 1 6 6 ASP H H 6 8.215 8.215 8.722 -0.507 25149
5404 1 15 . 1 1 7 7 GLU N N 7 119.101 119.101 116.991 2.110 25149
5405 1 15 . 1 1 7 7 GLU HA H 7 4.243 4.243 3.950 0.293 25149
5406 1 15 . 1 1 7 7 GLU C C 7 175.006 175.006 174.532 0.474 25149
5407 1 15 . 1 1 7 7 GLU CA C 7 56.689 56.689 56.528 0.161 25149
5408 1 15 . 1 1 7 7 GLU CB C 7 30.379 30.379 29.597 0.782 25149
5409 1 15 . 1 1 7 7 GLU H H 7 8.065 8.065 8.152 -0.087 25149
5410 1 15 . 1 1 8 8 ASN N N 8 116.852 116.852 115.913 0.939 25149
5411 1 15 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.537 -0.379 25149
5412 1 15 . 1 1 8 8 ASN C C 8 172.706 172.706 175.085 -2.379 25149
5413 1 15 . 1 1 8 8 ASN CA C 8 51.165 51.165 51.067 0.098 25149
5414 1 15 . 1 1 8 8 ASN CB C 8 40.702 40.702 40.716 -0.014 25149
5415 1 15 . 1 1 8 8 ASN H H 8 7.505 7.505 7.603 -0.098 25149
5416 1 15 . 1 1 9 9 CYS N N 9 122.855 122.855 120.091 2.764 25149
5417 1 15 . 1 1 9 9 CYS HA H 9 3.794 3.794 4.712 -0.918 25149
5418 1 15 . 1 1 9 9 CYS C C 9 178.370 178.370 176.908 1.462 25149
5419 1 15 . 1 1 9 9 CYS CA C 9 59.552 59.552 61.755 -2.203 25149
5420 1 15 . 1 1 9 9 CYS CB C 9 31.526 31.526 28.952 2.574 25149
5421 1 15 . 1 1 9 9 CYS H H 9 7.614 7.614 8.188 -0.574 25149
5422 1 15 . 1 1 10 10 GLY N N 10 117.295 117.295 109.917 7.378 25149
5423 1 15 . 1 1 10 10 GLY C C 10 174.111 174.111 174.482 -0.371 25149
5424 1 15 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.391 1.576 25149
5425 1 15 . 1 1 10 10 GLY H H 10 9.235 9.235 8.321 0.914 25149
5426 1 15 . 1 1 11 11 ILE N N 11 119.811 119.811 120.801 -0.990 25149
5427 1 15 . 1 1 11 11 ILE HA H 11 3.809 3.809 3.935 -0.126 25149
5428 1 15 . 1 1 11 11 ILE C C 11 176.121 176.121 176.635 -0.514 25149
5429 1 15 . 1 1 11 11 ILE CA C 11 64.041 64.041 62.547 1.494 25149
5430 1 15 . 1 1 11 11 ILE CB C 11 39.411 39.411 38.398 1.013 25149
5431 1 15 . 1 1 11 11 ILE H H 11 8.285 8.285 7.222 1.063 25149
5432 1 15 . 1 1 12 12 CYS N N 12 116.728 116.728 117.780 -1.052 25149
5433 1 15 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.592 -0.016 25149
5434 1 15 . 1 1 12 12 CYS C C 12 175.975 175.975 174.028 1.947 25149
5435 1 15 . 1 1 12 12 CYS CA C 12 59.225 59.225 57.502 1.723 25149
5436 1 15 . 1 1 12 12 CYS CB C 12 32.246 32.246 28.542 3.704 25149
5437 1 15 . 1 1 12 12 CYS H H 12 7.607 7.607 7.647 -0.040 25149
5438 1 15 . 1 1 13 13 ARG N N 13 116.073 116.073 117.121 -1.048 25149
5439 1 15 . 1 1 13 13 ARG HA H 13 3.742 3.742 4.126 -0.384 25149
5440 1 15 . 1 1 13 13 ARG C C 13 174.979 174.979 174.592 0.387 25149
5441 1 15 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.463 1.173 25149
5442 1 15 . 1 1 13 13 ARG CB C 13 26.326 26.326 27.381 -1.055 25149
5443 1 15 . 1 1 13 13 ARG H H 13 7.987 7.987 7.980 0.007 25149
5444 1 15 . 1 1 14 14 MET N N 14 119.313 119.313 119.614 -0.301 25149
5445 1 15 . 1 1 14 14 MET HA H 14 4.547 4.547 4.767 -0.220 25149
5446 1 15 . 1 1 14 14 MET C C 14 176.143 176.143 175.442 0.701 25149
5447 1 15 . 1 1 14 14 MET CA C 14 54.208 54.208 53.241 0.967 25149
5448 1 15 . 1 1 14 14 MET CB C 14 33.951 33.951 35.825 -1.874 25149
5449 1 15 . 1 1 14 14 MET H H 14 8.624 8.624 7.902 0.722 25149
5450 1 15 . 1 1 15 15 ALA N N 15 122.683 122.683 130.565 -7.882 25149
5451 1 15 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.228 0.044 25149
5452 1 15 . 1 1 15 15 ALA C C 15 180.117 180.117 178.357 1.760 25149
5453 1 15 . 1 1 15 15 ALA CA C 15 52.346 52.346 52.405 -0.059 25149
5454 1 15 . 1 1 15 15 ALA CB C 15 19.487 19.487 19.104 0.383 25149
5455 1 15 . 1 1 15 15 ALA H H 15 7.965 7.965 8.573 -0.608 25149
5456 1 15 . 1 1 16 16 PHE N N 16 119.313 119.313 120.718 -1.405 25149
5457 1 15 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.165 -0.124 25149
5458 1 15 . 1 1 16 16 PHE C C 16 176.423 176.423 176.727 -0.304 25149
5459 1 15 . 1 1 16 16 PHE CA C 16 59.130 59.130 58.493 0.637 25149
5460 1 15 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.487 -0.097 25149
5461 1 15 . 1 1 16 16 PHE H H 16 8.095 8.095 8.347 -0.252 25149
5462 1 15 . 1 1 17 17 ASN N N 17 112.313 112.313 116.444 -4.131 25149
5463 1 15 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.875 -0.239 25149
5464 1 15 . 1 1 17 17 ASN C C 17 175.337 175.337 175.019 0.318 25149
5465 1 15 . 1 1 17 17 ASN CA C 17 52.961 52.961 53.310 -0.349 25149
5466 1 15 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.638 -1.464 25149
5467 1 15 . 1 1 17 17 ASN H H 17 7.823 7.823 8.176 -0.353 25149
5468 1 15 . 1 1 18 18 GLY N N 18 107.742 107.742 108.376 -0.634 25149
5469 1 15 . 1 1 18 18 GLY C C 18 173.759 173.759 172.862 0.897 25149
5470 1 15 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.885 -0.421 25149
5471 1 15 . 1 1 18 18 GLY H H 18 7.579 7.579 8.269 -0.690 25149
5472 1 15 . 1 1 19 19 CYS N N 19 117.050 117.050 117.055 -0.005 25149
5473 1 15 . 1 1 19 19 CYS HA H 19 4.571 4.571 5.042 -0.471 25149
5474 1 15 . 1 1 19 19 CYS C C 19 174.039 174.039 174.169 -0.130 25149
5475 1 15 . 1 1 19 19 CYS CA C 19 58.433 58.433 55.964 2.469 25149
5476 1 15 . 1 1 19 19 CYS CB C 19 30.681 30.681 31.559 -0.878 25149
5477 1 15 . 1 1 19 19 CYS H H 19 8.198 8.198 8.107 0.091 25149
5478 1 15 . 1 1 20 20 CYS N N 20 123.923 123.923 121.424 2.499 25149
5479 1 15 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.555 -0.544 25149
5480 1 15 . 1 1 20 20 CYS C C 20 173.736 173.736 174.323 -0.587 25149
5481 1 15 . 1 1 20 20 CYS CA C 20 57.999 57.999 57.867 0.132 25149
5482 1 15 . 1 1 20 20 CYS CB C 20 28.205 28.205 27.951 0.254 25149
5483 1 15 . 1 1 20 20 CYS H H 20 8.466 8.466 8.901 -0.435 25149
5484 1 15 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.348 -0.319 25149
5485 1 15 . 1 1 21 21 PRO CA C 21 65.426 65.426 64.908 0.518 25149
5486 1 15 . 1 1 21 21 PRO CB C 21 32.801 32.801 31.942 0.859 25149
5487 1 15 . 1 1 22 22 ASP N N 22 117.053 117.053 118.014 -0.961 25149
5488 1 15 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.654 -0.149 25149
5489 1 15 . 1 1 22 22 ASP C C 22 176.501 176.501 175.161 1.340 25149
5490 1 15 . 1 1 22 22 ASP CA C 22 55.017 55.017 54.213 0.804 25149
5491 1 15 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.068 2.454 25149
5492 1 15 . 1 1 22 22 ASP H H 22 8.395 8.395 8.586 -0.191 25149
5493 1 15 . 1 1 23 23 CYS N N 23 123.353 123.353 118.452 4.901 25149
5494 1 15 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.539 -0.246 25149
5495 1 15 . 1 1 23 23 CYS C C 23 175.214 175.214 173.209 2.005 25149
5496 1 15 . 1 1 23 23 CYS CA C 23 61.633 61.633 57.940 3.693 25149
5497 1 15 . 1 1 23 23 CYS CB C 23 31.542 31.542 30.674 0.868 25149
5498 1 15 . 1 1 23 23 CYS H H 23 7.246 7.246 7.093 0.153 25149
5499 1 15 . 1 1 24 24 LYS N N 24 117.539 117.539 124.680 -7.141 25149
5500 1 15 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.434 -0.204 25149
5501 1 15 . 1 1 24 24 LYS C C 24 177.106 177.106 175.688 1.418 25149
5502 1 15 . 1 1 24 24 LYS CA C 24 56.921 56.921 55.781 1.140 25149
5503 1 15 . 1 1 24 24 LYS CB C 24 34.615 34.615 33.239 1.376 25149
5504 1 15 . 1 1 24 24 LYS H H 24 8.173 8.173 8.272 -0.099 25149
5505 1 15 . 1 1 25 25 VAL N N 25 120.661 120.661 126.582 -5.921 25149
5506 1 15 . 1 1 25 25 VAL HA H 25 4.429 4.429 4.371 0.058 25149
5507 1 15 . 1 1 25 25 VAL C C 25 174.027 174.027 174.856 -0.829 25149
5508 1 15 . 1 1 25 25 VAL CA C 25 59.934 59.934 60.099 -0.165 25149
5509 1 15 . 1 1 25 25 VAL CB C 25 33.507 33.507 32.414 1.093 25149
5510 1 15 . 1 1 25 25 VAL H H 25 7.787 7.787 8.607 -0.820 25149
5511 1 15 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.432 -0.096 25149
5512 1 15 . 1 1 26 26 PRO CA C 26 63.279 63.279 63.909 -0.630 25149
5513 1 15 . 1 1 26 26 PRO CB C 26 32.077 32.077 32.266 -0.189 25149
5514 1 15 . 1 1 27 27 GLY N N 27 109.926 109.926 107.590 2.336 25149
5515 1 15 . 1 1 27 27 GLY C C 27 175.169 175.169 174.873 0.296 25149
5516 1 15 . 1 1 27 27 GLY CA C 27 45.042 45.042 45.049 -0.007 25149
5517 1 15 . 1 1 27 27 GLY H H 27 8.569 8.569 8.087 0.482 25149
5518 1 15 . 1 1 28 28 ASP N N 28 122.592 122.592 120.838 1.754 25149
5519 1 15 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.440 -0.209 25149
5520 1 15 . 1 1 28 28 ASP C C 28 176.602 176.602 176.059 0.543 25149
5521 1 15 . 1 1 28 28 ASP CA C 28 56.402 56.402 54.719 1.683 25149
5522 1 15 . 1 1 28 28 ASP CB C 28 40.912 40.912 40.868 0.044 25149
5523 1 15 . 1 1 28 28 ASP H H 28 8.214 8.214 8.186 0.028 25149
5524 1 15 . 1 1 29 29 ASP N N 29 117.500 117.500 116.543 0.957 25149
5525 1 15 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.316 0.131 25149
5526 1 15 . 1 1 29 29 ASP C C 29 175.505 175.505 174.774 0.731 25149
5527 1 15 . 1 1 29 29 ASP CA C 29 55.266 55.266 54.480 0.785 25149
5528 1 15 . 1 1 29 29 ASP CB C 29 41.225 41.225 39.504 1.721 25149
5529 1 15 . 1 1 29 29 ASP H H 29 8.271 8.271 8.206 0.065 25149
5530 1 15 . 1 1 30 30 CYS N N 30 124.470 124.470 114.867 9.603 25149
5531 1 15 . 1 1 30 30 CYS HA H 30 4.390 4.390 4.405 -0.015 25149
5532 1 15 . 1 1 30 30 CYS C C 30 171.755 171.755 173.748 -1.993 25149
5533 1 15 . 1 1 30 30 CYS CA C 30 57.676 57.676 56.527 1.149 25149
5534 1 15 . 1 1 30 30 CYS CB C 30 29.154 29.154 27.808 1.346 25149
5535 1 15 . 1 1 30 30 CYS H H 30 7.912 7.912 8.230 -0.318 25149
5536 1 15 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.454 0.233 25149
5537 1 15 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.643 0.232 25149
5538 1 15 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.329 1.655 25149
5539 1 15 . 1 1 32 32 LEU N N 32 120.023 120.023 116.408 3.615 25149
5540 1 15 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.403 0.313 25149
5541 1 15 . 1 1 32 32 LEU C C 32 176.300 176.300 175.946 0.354 25149
5542 1 15 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.345 0.576 25149
5543 1 15 . 1 1 32 32 LEU CB C 32 43.336 43.336 42.838 0.498 25149
5544 1 15 . 1 1 32 32 LEU H H 32 8.580 8.580 7.805 0.775 25149
5545 1 15 . 1 1 33 33 VAL N N 33 116.217 116.217 116.272 -0.055 25149
5546 1 15 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.263 0.400 25149
5547 1 15 . 1 1 33 33 VAL C C 33 171.374 171.374 173.963 -2.589 25149
5548 1 15 . 1 1 33 33 VAL CA C 33 60.449 60.449 61.329 -0.880 25149
5549 1 15 . 1 1 33 33 VAL CB C 33 36.448 36.448 35.016 1.432 25149
5550 1 15 . 1 1 33 33 VAL H H 33 8.594 8.594 8.053 0.541 25149
5551 1 15 . 1 1 34 34 TRP N N 34 122.711 122.711 124.413 -1.702 25149
5552 1 15 . 1 1 34 34 TRP HA H 34 5.339 5.339 4.828 0.511 25149
5553 1 15 . 1 1 34 34 TRP C C 34 176.770 176.770 175.595 1.175 25149
5554 1 15 . 1 1 34 34 TRP CA C 34 57.267 57.267 55.664 1.603 25149
5555 1 15 . 1 1 34 34 TRP CB C 34 33.780 33.780 32.872 0.908 25149
5556 1 15 . 1 1 34 34 TRP H H 34 8.756 8.756 8.636 0.120 25149
5557 1 15 . 1 1 35 35 GLY N N 35 107.569 107.569 106.754 0.815 25149
5558 1 15 . 1 1 35 35 GLY C C 35 177.397 177.397 173.618 3.779 25149
5559 1 15 . 1 1 35 35 GLY CA C 35 44.070 44.070 43.953 0.117 25149
5560 1 15 . 1 1 35 35 GLY H H 35 8.857 8.857 8.502 0.355 25149
5561 1 15 . 1 1 36 36 GLN N N 36 122.723 122.723 118.092 4.631 25149
5562 1 15 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.048 -0.302 25149
5563 1 15 . 1 1 36 36 GLN C C 36 176.445 176.445 176.170 0.275 25149
5564 1 15 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.093 0.336 25149
5565 1 15 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.802 -1.171 25149
5566 1 15 . 1 1 36 36 GLN H H 36 8.338 8.338 8.687 -0.349 25149
5567 1 15 . 1 1 37 37 CYS N N 37 115.763 115.763 113.949 1.814 25149
5568 1 15 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.903 -0.619 25149
5569 1 15 . 1 1 37 37 CYS C C 37 175.281 175.281 175.443 -0.162 25149
5570 1 15 . 1 1 37 37 CYS CA C 37 58.395 58.395 55.891 2.505 25149
5571 1 15 . 1 1 37 37 CYS CB C 37 31.143 31.143 31.070 0.073 25149
5572 1 15 . 1 1 37 37 CYS H H 37 7.622 7.622 7.679 -0.057 25149
5573 1 15 . 1 1 38 38 SER N N 38 114.540 114.540 115.146 -0.606 25149
5574 1 15 . 1 1 38 38 SER HA H 38 4.004 4.004 4.248 -0.244 25149
5575 1 15 . 1 1 38 38 SER C C 38 173.389 173.389 174.624 -1.235 25149
5576 1 15 . 1 1 38 38 SER CA C 38 62.285 62.285 60.622 1.663 25149
5577 1 15 . 1 1 38 38 SER H H 38 7.716 7.716 8.463 -0.747 25149
5578 1 15 . 1 1 39 39 HIS N N 39 121.947 121.947 119.802 2.145 25149
5579 1 15 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.038 0.406 25149
5580 1 15 . 1 1 39 39 HIS C C 39 172.326 172.326 173.057 -0.731 25149
5581 1 15 . 1 1 39 39 HIS CA C 39 61.320 61.320 56.987 4.333 25149
5582 1 15 . 1 1 39 39 HIS CB C 39 31.523 31.523 29.994 1.529 25149
5583 1 15 . 1 1 39 39 HIS H H 39 7.829 7.829 7.408 0.421 25149
5584 1 15 . 1 1 40 40 CYS N N 40 121.859 121.859 125.350 -3.491 25149
5585 1 15 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.327 0.282 25149
5586 1 15 . 1 1 40 40 CYS C C 40 171.900 171.900 171.709 0.191 25149
5587 1 15 . 1 1 40 40 CYS CA C 40 55.791 55.791 57.119 -1.328 25149
5588 1 15 . 1 1 40 40 CYS CB C 40 28.964 28.964 28.007 0.957 25149
5589 1 15 . 1 1 40 40 CYS H H 40 8.049 8.049 8.196 -0.147 25149
5590 1 15 . 1 1 41 41 PHE N N 41 120.690 120.690 123.987 -3.297 25149
5591 1 15 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.637 0.540 25149
5592 1 15 . 1 1 41 41 PHE C C 41 176.613 176.613 175.095 1.518 25149
5593 1 15 . 1 1 41 41 PHE CA C 41 56.033 56.033 54.049 1.984 25149
5594 1 15 . 1 1 41 41 PHE CB C 41 45.760 45.760 42.538 3.222 25149
5595 1 15 . 1 1 41 41 PHE H H 41 8.368 8.368 8.241 0.127 25149
5596 1 15 . 1 1 42 42 HIS N N 42 117.057 117.057 120.251 -3.194 25149
5597 1 15 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.349 0.320 25149
5598 1 15 . 1 1 42 42 HIS C C 42 177.464 177.464 176.041 1.423 25149
5599 1 15 . 1 1 42 42 HIS CA C 42 60.425 60.425 57.995 2.430 25149
5600 1 15 . 1 1 42 42 HIS CB C 42 29.740 29.740 29.466 0.274 25149
5601 1 15 . 1 1 42 42 HIS H H 42 8.384 8.384 8.485 -0.101 25149
5602 1 15 . 1 1 43 43 MET N N 43 128.543 128.543 125.999 2.544 25149
5603 1 15 . 1 1 43 43 MET HA H 43 3.965 3.965 3.991 -0.026 25149
5604 1 15 . 1 1 43 43 MET C C 43 177.845 177.845 177.290 0.555 25149
5605 1 15 . 1 1 43 43 MET CA C 43 59.209 59.209 60.554 -1.345 25149
5606 1 15 . 1 1 43 43 MET CB C 43 33.009 33.009 32.665 0.344 25149
5607 1 15 . 1 1 43 43 MET H H 43 9.439 9.439 7.925 1.514 25149
5608 1 15 . 1 1 44 44 HIS N N 44 116.500 116.500 117.663 -1.163 25149
5609 1 15 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.271 -0.015 25149
5610 1 15 . 1 1 44 44 HIS C C 44 178.405 178.405 177.863 0.542 25149
5611 1 15 . 1 1 44 44 HIS CA C 44 58.793 58.793 59.392 -0.599 25149
5612 1 15 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.081 3.666 25149
5613 1 15 . 1 1 44 44 HIS H H 44 9.747 9.747 8.131 1.616 25149
5614 1 15 . 1 1 45 45 CYS N N 45 115.950 115.950 118.002 -2.052 25149
5615 1 15 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.114 -0.114 25149
5616 1 15 . 1 1 45 45 CYS C C 45 177.957 177.957 177.195 0.762 25149
5617 1 15 . 1 1 45 45 CYS CA C 45 62.923 62.923 62.993 -0.070 25149
5618 1 15 . 1 1 45 45 CYS CB C 45 29.102 29.102 26.668 2.434 25149
5619 1 15 . 1 1 45 45 CYS H H 45 6.845 6.845 8.114 -1.269 25149
5620 1 15 . 1 1 46 46 ILE N N 46 119.362 119.362 120.922 -1.560 25149
5621 1 15 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.770 -0.105 25149
5622 1 15 . 1 1 46 46 ILE C C 46 176.613 176.613 177.754 -1.141 25149
5623 1 15 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.538 -4.296 25149
5624 1 15 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.905 -0.586 25149
5625 1 15 . 1 1 46 46 ILE H H 46 7.816 7.816 7.911 -0.095 25149
5626 1 15 . 1 1 47 47 LEU N N 47 122.180 122.180 120.917 1.263 25149
5627 1 15 . 1 1 47 47 LEU HA H 47 3.873 3.873 4.159 -0.286 25149
5628 1 15 . 1 1 47 47 LEU C C 47 179.726 179.726 178.988 0.738 25149
5629 1 15 . 1 1 47 47 LEU CA C 47 58.633 58.633 59.220 -0.587 25149
5630 1 15 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.933 -0.810 25149
5631 1 15 . 1 1 47 47 LEU H H 47 8.266 8.266 8.587 -0.321 25149
5632 1 15 . 1 1 48 48 LYS N N 48 118.251 118.251 118.625 -0.374 25149
5633 1 15 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.187 -0.323 25149
5634 1 15 . 1 1 48 48 LYS C C 48 179.423 179.423 178.796 0.627 25149
5635 1 15 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.548 0.438 25149
5636 1 15 . 1 1 48 48 LYS CB C 48 32.765 32.765 31.987 0.778 25149
5637 1 15 . 1 1 48 48 LYS H H 48 7.147 7.147 8.472 -1.325 25149
5638 1 15 . 1 1 49 49 TRP N N 49 120.745 120.745 121.286 -0.541 25149
5639 1 15 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.289 -0.209 25149
5640 1 15 . 1 1 49 49 TRP C C 49 178.147 178.147 177.954 0.193 25149
5641 1 15 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.938 -0.393 25149
5642 1 15 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.255 0.160 25149
5643 1 15 . 1 1 49 49 TRP H H 49 7.709 7.709 8.123 -0.414 25149
5644 1 15 . 1 1 50 50 LEU N N 50 117.236 117.236 117.455 -0.219 25149
5645 1 15 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.569 0.036 25149
5646 1 15 . 1 1 50 50 LEU C C 50 179.658 179.658 177.023 2.635 25149
5647 1 15 . 1 1 50 50 LEU CA C 50 57.330 57.330 55.112 2.218 25149
5648 1 15 . 1 1 50 50 LEU CB C 50 41.416 41.416 42.089 -0.673 25149
5649 1 15 . 1 1 50 50 LEU H H 50 8.512 8.512 7.971 0.541 25149
5650 1 15 . 1 1 51 51 HIS N N 51 115.650 115.650 118.306 -2.656 25149
5651 1 15 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.519 -0.245 25149
5652 1 15 . 1 1 51 51 HIS C C 51 175.942 175.942 176.248 -0.306 25149
5653 1 15 . 1 1 51 51 HIS CA C 51 57.320 57.320 56.164 1.156 25149
5654 1 15 . 1 1 51 51 HIS CB C 51 29.487 29.487 30.041 -0.554 25149
5655 1 15 . 1 1 51 51 HIS H H 51 7.713 7.713 8.334 -0.621 25149
5656 1 15 . 1 1 52 52 ALA N N 52 119.779 119.779 122.114 -2.335 25149
5657 1 15 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.167 -0.144 25149
5658 1 15 . 1 1 52 52 ALA C C 52 177.834 177.834 177.489 0.345 25149
5659 1 15 . 1 1 52 52 ALA CA C 52 52.865 52.865 53.933 -1.068 25149
5660 1 15 . 1 1 52 52 ALA CB C 52 18.951 18.951 19.407 -0.456 25149
5661 1 15 . 1 1 52 52 ALA H H 52 7.191 7.191 7.925 -0.734 25149
5662 1 15 . 1 1 53 53 GLN N N 53 117.047 117.047 117.137 -0.090 25149
5663 1 15 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.562 -0.629 25149
5664 1 15 . 1 1 53 53 GLN C C 53 175.998 175.998 175.322 0.676 25149
5665 1 15 . 1 1 53 53 GLN CA C 53 55.482 55.482 54.963 0.519 25149
5666 1 15 . 1 1 53 53 GLN CB C 53 28.887 28.887 30.820 -1.933 25149
5667 1 15 . 1 1 53 53 GLN H H 53 7.317 7.317 8.089 -0.772 25149
5668 1 15 . 1 1 54 54 GLN N N 54 118.463 118.463 120.188 -1.725 25149
5669 1 15 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.248 -0.259 25149
5670 1 15 . 1 1 54 54 GLN C C 54 176.300 176.300 175.869 0.431 25149
5671 1 15 . 1 1 54 54 GLN CA C 54 57.314 57.314 55.801 1.513 25149
5672 1 15 . 1 1 54 54 GLN CB C 54 28.823 28.823 28.561 0.262 25149
5673 1 15 . 1 1 54 54 GLN H H 54 7.949 7.949 8.590 -0.641 25149
5674 1 15 . 1 1 55 55 VAL N N 55 116.755 116.755 115.538 1.217 25149
5675 1 15 . 1 1 55 55 VAL HA H 55 3.884 3.884 3.872 0.012 25149
5676 1 15 . 1 1 55 55 VAL C C 55 175.774 175.774 175.647 0.127 25149
5677 1 15 . 1 1 55 55 VAL CA C 55 63.210 63.210 61.893 1.317 25149
5678 1 15 . 1 1 55 55 VAL CB C 55 32.870 32.870 32.010 0.860 25149
5679 1 15 . 1 1 55 55 VAL H H 55 7.801 7.801 7.357 0.444 25149
5680 1 15 . 1 1 56 56 GLN N N 56 120.192 120.192 120.178 0.014 25149
5681 1 15 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.245 -0.128 25149
5682 1 15 . 1 1 56 56 GLN C C 56 175.236 175.236 176.822 -1.586 25149
5683 1 15 . 1 1 56 56 GLN CA C 56 55.697 55.697 56.709 -1.012 25149
5684 1 15 . 1 1 56 56 GLN CB C 56 29.319 29.319 27.752 1.567 25149
5685 1 15 . 1 1 56 56 GLN H H 56 8.018 8.018 8.464 -0.446 25149
5686 1 15 . 1 1 57 57 GLN N N 57 121.276 121.276 120.540 0.736 25149
5687 1 15 . 1 1 57 57 GLN HA H 57 4.204 4.204 3.996 0.208 25149
5688 1 15 . 1 1 57 57 GLN C C 57 175.819 175.819 175.977 -0.158 25149
5689 1 15 . 1 1 57 57 GLN CA C 57 55.617 55.617 56.644 -1.027 25149
5690 1 15 . 1 1 57 57 GLN CB C 57 29.094 29.094 28.557 0.537 25149
5691 1 15 . 1 1 57 57 GLN H H 57 8.471 8.471 8.742 -0.271 25149
5692 1 15 . 1 1 58 58 HIS N N 58 120.001 120.001 118.640 1.361 25149
5693 1 15 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.628 0.546 25149
5694 1 15 . 1 1 58 58 HIS C C 58 173.636 173.636 176.458 -2.822 25149
5695 1 15 . 1 1 58 58 HIS CA C 58 54.353 54.353 57.435 -3.082 25149
5696 1 15 . 1 1 58 58 HIS CB C 58 33.057 33.057 29.138 3.919 25149
5697 1 15 . 1 1 58 58 HIS H H 58 8.366 8.366 7.995 0.371 25149
5698 1 15 . 1 1 59 59 CYS N N 59 121.924 121.924 122.290 -0.366 25149
5699 1 15 . 1 1 59 59 CYS HA H 59 4.442 4.442 4.173 0.269 25149
5700 1 15 . 1 1 59 59 CYS C C 59 176.334 176.334 174.879 1.455 25149
5701 1 15 . 1 1 59 59 CYS CA C 59 56.772 56.772 61.547 -4.775 25149
5702 1 15 . 1 1 59 59 CYS CB C 59 32.642 32.642 29.098 3.544 25149
5703 1 15 . 1 1 59 59 CYS H H 59 9.035 9.035 8.889 0.146 25149
5704 1 15 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.474 -0.661 25149
5705 1 15 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.832 -0.170 25149
5706 1 15 . 1 1 60 60 PRO CB C 60 30.659 30.659 31.364 -0.705 25149
5707 1 15 . 1 1 61 61 MET N N 61 117.676 117.676 113.592 4.084 25149
5708 1 15 . 1 1 61 61 MET HA H 61 4.317 4.317 4.439 -0.122 25149
5709 1 15 . 1 1 61 61 MET C C 61 177.117 177.117 176.942 0.175 25149
5710 1 15 . 1 1 61 61 MET CA C 61 56.408 56.408 56.281 0.127 25149
5711 1 15 . 1 1 61 61 MET CB C 61 32.551 32.551 32.160 0.391 25149
5712 1 15 . 1 1 61 61 MET H H 61 9.135 9.135 7.480 1.655 25149
5713 1 15 . 1 1 62 62 CYS N N 62 117.214 117.214 121.222 -4.008 25149
5714 1 15 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.207 0.667 25149
5715 1 15 . 1 1 62 62 CYS C C 62 175.740 175.740 175.885 -0.145 25149
5716 1 15 . 1 1 62 62 CYS CA C 62 58.273 58.273 61.155 -2.882 25149
5717 1 15 . 1 1 62 62 CYS CB C 62 32.776 32.776 27.095 5.681 25149
5718 1 15 . 1 1 62 62 CYS H H 62 8.011 8.011 7.850 0.161 25149
5719 1 15 . 1 1 63 63 ARG N N 63 116.555 116.555 114.671 1.884 25149
5720 1 15 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.020 -0.095 25149
5721 1 15 . 1 1 63 63 ARG C C 63 175.326 175.326 174.592 0.734 25149
5722 1 15 . 1 1 63 63 ARG CA C 63 58.073 58.073 57.725 0.348 25149
5723 1 15 . 1 1 63 63 ARG CB C 63 27.136 27.136 28.106 -0.970 25149
5724 1 15 . 1 1 63 63 ARG H H 63 8.086 8.086 8.301 -0.215 25149
5725 1 15 . 1 1 64 64 GLN N N 64 118.932 118.932 117.302 1.630 25149
5726 1 15 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.654 -0.395 25149
5727 1 15 . 1 1 64 64 GLN C C 64 176.054 176.054 175.197 0.857 25149
5728 1 15 . 1 1 64 64 GLN CA C 64 56.316 56.316 54.198 2.118 25149
5729 1 15 . 1 1 64 64 GLN CB C 64 30.083 30.083 31.570 -1.487 25149
5730 1 15 . 1 1 64 64 GLN H H 64 8.003 8.003 7.860 0.143 25149
5731 1 15 . 1 1 65 65 GLU N N 65 122.038 122.038 122.045 -0.007 25149
5732 1 15 . 1 1 65 65 GLU HA H 65 4.003 4.003 4.175 -0.172 25149
5733 1 15 . 1 1 65 65 GLU C C 65 176.781 176.781 176.350 0.431 25149
5734 1 15 . 1 1 65 65 GLU CA C 65 57.682 57.682 55.912 1.770 25149
5735 1 15 . 1 1 65 65 GLU CB C 65 29.900 29.900 28.858 1.042 25149
5736 1 15 . 1 1 65 65 GLU H H 65 8.657 8.657 8.740 -0.083 25149
5737 1 15 . 1 1 66 66 TRP N N 66 125.730 125.730 128.119 -2.389 25149
5738 1 15 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.283 0.121 25149
5739 1 15 . 1 1 66 66 TRP C C 66 175.460 175.460 175.029 0.431 25149
5740 1 15 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.944 -0.319 25149
5741 1 15 . 1 1 66 66 TRP CB C 66 29.358 29.358 29.792 -0.434 25149
5742 1 15 . 1 1 66 66 TRP H H 66 8.499 8.499 8.119 0.380 25149
5743 1 15 . 1 1 67 67 LYS N N 67 127.396 127.396 127.315 0.081 25149
5744 1 15 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.082 -0.064 25149
5745 1 15 . 1 1 67 67 LYS C C 67 175.180 175.180 175.181 -0.001 25149
5746 1 15 . 1 1 67 67 LYS CA C 67 54.514 54.514 53.644 0.870 25149
5747 1 15 . 1 1 67 67 LYS CB C 67 36.231 36.231 34.164 2.067 25149
5748 1 15 . 1 1 67 67 LYS H H 67 6.930 6.930 8.511 -1.581 25149
5749 1 15 . 1 1 68 68 PHE N N 68 121.511 121.511 127.043 -5.532 25149
5750 1 15 . 1 1 68 68 PHE HA H 68 4.108 4.108 3.914 0.194 25149
5751 1 15 . 1 1 68 68 PHE C C 68 176.613 176.613 175.422 1.191 25149
5752 1 15 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.804 2.157 25149
5753 1 15 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.569 1.693 25149
5754 1 15 . 1 1 68 68 PHE H H 68 8.430 8.430 8.533 -0.103 25149
5755 1 15 . 1 1 69 69 LYS N N 69 124.210 124.210 122.484 1.726 25149
5756 1 15 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.082 -0.087 25149
5757 1 15 . 1 1 69 69 LYS C C 69 175.651 175.651 175.885 -0.234 25149
5758 1 15 . 1 1 69 69 LYS CA C 69 57.320 57.320 56.841 0.479 25149
5759 1 15 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.795 -0.434 25149
5760 1 15 . 1 1 69 69 LYS H H 69 8.738 8.738 8.006 0.732 25149
5761 1 16 . 1 1 2 2 SER HA H 2 4.417 4.417 4.326 0.091 25149
5762 1 16 . 1 1 2 2 SER CA C 2 58.322 58.322 57.924 0.398 25149
5763 1 16 . 1 1 2 2 SER CB C 2 64.169 64.169 63.358 0.811 25149
5764 1 16 . 1 1 3 3 VAL N N 3 121.214 121.214 121.819 -0.605 25149
5765 1 16 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.000 0.046 25149
5766 1 16 . 1 1 3 3 VAL C C 3 175.879 175.879 175.638 0.241 25149
5767 1 16 . 1 1 3 3 VAL CA C 3 62.138 62.138 63.177 -1.039 25149
5768 1 16 . 1 1 3 3 VAL CB C 3 32.958 32.958 31.432 1.526 25149
5769 1 16 . 1 1 3 3 VAL H H 3 8.170 8.170 7.872 0.298 25149
5770 1 16 . 1 1 4 4 ALA N N 4 127.312 127.312 130.945 -3.633 25149
5771 1 16 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.466 -0.269 25149
5772 1 16 . 1 1 4 4 ALA C C 4 177.497 177.497 175.788 1.709 25149
5773 1 16 . 1 1 4 4 ALA CA C 4 52.439 52.439 51.906 0.533 25149
5774 1 16 . 1 1 4 4 ALA CB C 4 19.424 19.424 20.394 -0.970 25149
5775 1 16 . 1 1 4 4 ALA H H 4 8.294 8.294 8.336 -0.042 25149
5776 1 16 . 1 1 5 5 ASN N N 5 117.674 117.674 121.521 -3.847 25149
5777 1 16 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.906 -0.341 25149
5778 1 16 . 1 1 5 5 ASN C C 5 175.048 175.048 174.502 0.546 25149
5779 1 16 . 1 1 5 5 ASN CA C 5 53.725 53.725 53.776 -0.051 25149
5780 1 16 . 1 1 5 5 ASN CB C 5 39.197 39.197 40.347 -1.151 25149
5781 1 16 . 1 1 5 5 ASN H H 5 8.252 8.252 8.323 -0.071 25149
5782 1 16 . 1 1 6 6 ASP N N 6 119.896 119.896 121.402 -1.506 25149
5783 1 16 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.707 -0.187 25149
5784 1 16 . 1 1 6 6 ASP C C 6 176.269 176.269 176.115 0.154 25149
5785 1 16 . 1 1 6 6 ASP CA C 6 54.497 54.497 54.059 0.438 25149
5786 1 16 . 1 1 6 6 ASP CB C 6 41.104 41.104 41.425 -0.321 25149
5787 1 16 . 1 1 6 6 ASP H H 6 8.215 8.215 8.496 -0.281 25149
5788 1 16 . 1 1 7 7 GLU N N 7 119.101 119.101 118.720 0.381 25149
5789 1 16 . 1 1 7 7 GLU HA H 7 4.243 4.243 4.068 0.175 25149
5790 1 16 . 1 1 7 7 GLU C C 7 175.006 175.006 174.754 0.252 25149
5791 1 16 . 1 1 7 7 GLU CA C 7 56.689 56.689 57.155 -0.466 25149
5792 1 16 . 1 1 7 7 GLU CB C 7 30.379 30.379 29.735 0.644 25149
5793 1 16 . 1 1 7 7 GLU H H 7 8.065 8.065 8.453 -0.388 25149
5794 1 16 . 1 1 8 8 ASN N N 8 116.852 116.852 115.096 1.756 25149
5795 1 16 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.598 -0.440 25149
5796 1 16 . 1 1 8 8 ASN C C 8 172.706 172.706 175.161 -2.455 25149
5797 1 16 . 1 1 8 8 ASN CA C 8 51.165 51.165 51.156 0.009 25149
5798 1 16 . 1 1 8 8 ASN CB C 8 40.702 40.702 39.049 1.653 25149
5799 1 16 . 1 1 8 8 ASN H H 8 7.505 7.505 7.468 0.037 25149
5800 1 16 . 1 1 9 9 CYS N N 9 122.855 122.855 120.658 2.197 25149
5801 1 16 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.483 0.311 25149
5802 1 16 . 1 1 9 9 CYS C C 9 178.370 178.370 175.846 2.524 25149
5803 1 16 . 1 1 9 9 CYS CA C 9 59.552 59.552 61.314 -1.762 25149
5804 1 16 . 1 1 9 9 CYS CB C 9 31.526 31.526 28.415 3.111 25149
5805 1 16 . 1 1 9 9 CYS H H 9 7.614 7.614 8.356 -0.742 25149
5806 1 16 . 1 1 10 10 GLY N N 10 117.295 117.295 110.201 7.094 25149
5807 1 16 . 1 1 10 10 GLY C C 10 174.111 174.111 174.504 -0.393 25149
5808 1 16 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.616 1.351 25149
5809 1 16 . 1 1 10 10 GLY H H 10 9.235 9.235 7.743 1.492 25149
5810 1 16 . 1 1 11 11 ILE N N 11 119.811 119.811 119.210 0.601 25149
5811 1 16 . 1 1 11 11 ILE HA H 11 3.809 3.809 4.129 -0.320 25149
5812 1 16 . 1 1 11 11 ILE C C 11 176.121 176.121 176.400 -0.279 25149
5813 1 16 . 1 1 11 11 ILE CA C 11 64.041 64.041 63.712 0.329 25149
5814 1 16 . 1 1 11 11 ILE CB C 11 39.411 39.411 39.331 0.080 25149
5815 1 16 . 1 1 11 11 ILE H H 11 8.285 8.285 7.442 0.843 25149
5816 1 16 . 1 1 12 12 CYS N N 12 116.728 116.728 117.397 -0.669 25149
5817 1 16 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.718 -0.142 25149
5818 1 16 . 1 1 12 12 CYS C C 12 175.975 175.975 173.574 2.401 25149
5819 1 16 . 1 1 12 12 CYS CA C 12 59.225 59.225 57.532 1.692 25149
5820 1 16 . 1 1 12 12 CYS CB C 12 32.246 32.246 29.773 2.473 25149
5821 1 16 . 1 1 12 12 CYS H H 12 7.607 7.607 7.571 0.036 25149
5822 1 16 . 1 1 13 13 ARG N N 13 116.073 116.073 116.324 -0.251 25149
5823 1 16 . 1 1 13 13 ARG HA H 13 3.742 3.742 4.092 -0.350 25149
5824 1 16 . 1 1 13 13 ARG C C 13 174.979 174.979 174.687 0.292 25149
5825 1 16 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.618 1.018 25149
5826 1 16 . 1 1 13 13 ARG CB C 13 26.326 26.326 27.351 -1.024 25149
5827 1 16 . 1 1 13 13 ARG H H 13 7.987 7.987 8.109 -0.122 25149
5828 1 16 . 1 1 14 14 MET N N 14 119.313 119.313 118.671 0.642 25149
5829 1 16 . 1 1 14 14 MET HA H 14 4.547 4.547 4.398 0.149 25149
5830 1 16 . 1 1 14 14 MET C C 14 176.143 176.143 176.001 0.142 25149
5831 1 16 . 1 1 14 14 MET CA C 14 54.208 54.208 54.002 0.206 25149
5832 1 16 . 1 1 14 14 MET CB C 14 33.951 33.951 33.474 0.477 25149
5833 1 16 . 1 1 14 14 MET H H 14 8.624 8.624 7.735 0.889 25149
5834 1 16 . 1 1 15 15 ALA N N 15 122.683 122.683 128.258 -5.575 25149
5835 1 16 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.336 -0.064 25149
5836 1 16 . 1 1 15 15 ALA C C 15 180.117 180.117 178.947 1.170 25149
5837 1 16 . 1 1 15 15 ALA CA C 15 52.346 52.346 51.507 0.839 25149
5838 1 16 . 1 1 15 15 ALA CB C 15 19.487 19.487 19.351 0.136 25149
5839 1 16 . 1 1 15 15 ALA H H 15 7.965 7.965 8.370 -0.405 25149
5840 1 16 . 1 1 16 16 PHE N N 16 119.313 119.313 124.314 -5.001 25149
5841 1 16 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.271 -0.230 25149
5842 1 16 . 1 1 16 16 PHE C C 16 176.423 176.423 177.029 -0.606 25149
5843 1 16 . 1 1 16 16 PHE CA C 16 59.130 59.130 59.450 -0.320 25149
5844 1 16 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.207 0.183 25149
5845 1 16 . 1 1 16 16 PHE H H 16 8.095 8.095 7.966 0.129 25149
5846 1 16 . 1 1 17 17 ASN N N 17 112.313 112.313 116.633 -4.320 25149
5847 1 16 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.573 0.063 25149
5848 1 16 . 1 1 17 17 ASN C C 17 175.337 175.337 175.766 -0.429 25149
5849 1 16 . 1 1 17 17 ASN CA C 17 52.961 52.961 54.618 -1.657 25149
5850 1 16 . 1 1 17 17 ASN CB C 17 37.174 37.174 39.120 -1.946 25149
5851 1 16 . 1 1 17 17 ASN H H 17 7.823 7.823 8.512 -0.689 25149
5852 1 16 . 1 1 18 18 GLY N N 18 107.742 107.742 107.188 0.554 25149
5853 1 16 . 1 1 18 18 GLY C C 18 173.759 173.759 172.655 1.104 25149
5854 1 16 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.564 -0.100 25149
5855 1 16 . 1 1 18 18 GLY H H 18 7.579 7.579 8.174 -0.595 25149
5856 1 16 . 1 1 19 19 CYS N N 19 117.050 117.050 117.469 -0.419 25149
5857 1 16 . 1 1 19 19 CYS HA H 19 4.571 4.571 4.806 -0.235 25149
5858 1 16 . 1 1 19 19 CYS C C 19 174.039 174.039 174.424 -0.385 25149
5859 1 16 . 1 1 19 19 CYS CA C 19 58.433 58.433 57.712 0.721 25149
5860 1 16 . 1 1 19 19 CYS CB C 19 30.681 30.681 31.418 -0.737 25149
5861 1 16 . 1 1 19 19 CYS H H 19 8.198 8.198 8.172 0.026 25149
5862 1 16 . 1 1 20 20 CYS N N 20 123.923 123.923 122.058 1.865 25149
5863 1 16 . 1 1 20 20 CYS HA H 20 4.011 4.011 3.835 0.176 25149
5864 1 16 . 1 1 20 20 CYS C C 20 173.736 173.736 174.219 -0.483 25149
5865 1 16 . 1 1 20 20 CYS CA C 20 57.999 57.999 61.161 -3.163 25149
5866 1 16 . 1 1 20 20 CYS CB C 20 28.205 28.205 27.084 1.121 25149
5867 1 16 . 1 1 20 20 CYS H H 20 8.466 8.466 8.702 -0.236 25149
5868 1 16 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.234 -0.205 25149
5869 1 16 . 1 1 21 21 PRO CA C 21 65.426 65.426 64.399 1.027 25149
5870 1 16 . 1 1 21 21 PRO CB C 21 32.801 32.801 32.303 0.498 25149
5871 1 16 . 1 1 22 22 ASP N N 22 117.053 117.053 119.135 -2.082 25149
5872 1 16 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.363 0.142 25149
5873 1 16 . 1 1 22 22 ASP C C 22 176.501 176.501 176.499 0.002 25149
5874 1 16 . 1 1 22 22 ASP CA C 22 55.017 55.017 56.364 -1.347 25149
5875 1 16 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.518 2.004 25149
5876 1 16 . 1 1 22 22 ASP H H 22 8.395 8.395 8.536 -0.141 25149
5877 1 16 . 1 1 23 23 CYS N N 23 123.353 123.353 118.528 4.825 25149
5878 1 16 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.240 0.053 25149
5879 1 16 . 1 1 23 23 CYS C C 23 175.214 175.214 174.724 0.490 25149
5880 1 16 . 1 1 23 23 CYS CA C 23 61.633 61.633 60.850 0.783 25149
5881 1 16 . 1 1 23 23 CYS CB C 23 31.542 31.542 26.108 5.434 25149
5882 1 16 . 1 1 23 23 CYS H H 23 7.246 7.246 8.175 -0.929 25149
5883 1 16 . 1 1 24 24 LYS N N 24 117.539 117.539 124.620 -7.081 25149
5884 1 16 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.339 -0.109 25149
5885 1 16 . 1 1 24 24 LYS C C 24 177.106 177.106 175.352 1.754 25149
5886 1 16 . 1 1 24 24 LYS CA C 24 56.921 56.921 55.503 1.418 25149
5887 1 16 . 1 1 24 24 LYS CB C 24 34.615 34.615 32.096 2.519 25149
5888 1 16 . 1 1 24 24 LYS H H 24 8.173 8.173 8.262 -0.089 25149
5889 1 16 . 1 1 25 25 VAL N N 25 120.661 120.661 122.225 -1.564 25149
5890 1 16 . 1 1 25 25 VAL HA H 25 4.429 4.429 4.399 0.030 25149
5891 1 16 . 1 1 25 25 VAL C C 25 174.027 174.027 175.243 -1.216 25149
5892 1 16 . 1 1 25 25 VAL CA C 25 59.934 59.934 59.240 0.694 25149
5893 1 16 . 1 1 25 25 VAL CB C 25 33.507 33.507 32.512 0.995 25149
5894 1 16 . 1 1 25 25 VAL H H 25 7.787 7.787 7.623 0.164 25149
5895 1 16 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.479 -0.143 25149
5896 1 16 . 1 1 26 26 PRO CA C 26 63.279 63.279 62.978 0.301 25149
5897 1 16 . 1 1 26 26 PRO CB C 26 32.077 32.077 29.690 2.387 25149
5898 1 16 . 1 1 27 27 GLY N N 27 109.926 109.926 109.640 0.286 25149
5899 1 16 . 1 1 27 27 GLY C C 27 175.169 175.169 173.395 1.774 25149
5900 1 16 . 1 1 27 27 GLY CA C 27 45.042 45.042 45.374 -0.332 25149
5901 1 16 . 1 1 27 27 GLY H H 27 8.569 8.569 7.814 0.755 25149
5902 1 16 . 1 1 28 28 ASP N N 28 122.592 122.592 121.091 1.501 25149
5903 1 16 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.523 -0.292 25149
5904 1 16 . 1 1 28 28 ASP C C 28 176.602 176.602 176.805 -0.203 25149
5905 1 16 . 1 1 28 28 ASP CA C 28 56.402 56.402 54.366 2.036 25149
5906 1 16 . 1 1 28 28 ASP CB C 28 40.912 40.912 41.456 -0.544 25149
5907 1 16 . 1 1 28 28 ASP H H 28 8.214 8.214 8.490 -0.276 25149
5908 1 16 . 1 1 29 29 ASP N N 29 117.500 117.500 120.244 -2.744 25149
5909 1 16 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.684 -0.237 25149
5910 1 16 . 1 1 29 29 ASP C C 29 175.505 175.505 175.563 -0.058 25149
5911 1 16 . 1 1 29 29 ASP CA C 29 55.266 55.266 53.620 1.646 25149
5912 1 16 . 1 1 29 29 ASP CB C 29 41.225 41.225 39.414 1.811 25149
5913 1 16 . 1 1 29 29 ASP H H 29 8.271 8.271 8.504 -0.233 25149
5914 1 16 . 1 1 30 30 CYS N N 30 124.470 124.470 120.115 4.355 25149
5915 1 16 . 1 1 30 30 CYS HA H 30 4.390 4.390 4.868 -0.478 25149
5916 1 16 . 1 1 30 30 CYS C C 30 171.755 171.755 172.701 -0.946 25149
5917 1 16 . 1 1 30 30 CYS CA C 30 57.676 57.676 56.578 1.098 25149
5918 1 16 . 1 1 30 30 CYS CB C 30 29.154 29.154 28.288 0.866 25149
5919 1 16 . 1 1 30 30 CYS H H 30 7.912 7.912 8.242 -0.330 25149
5920 1 16 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.512 0.175 25149
5921 1 16 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.770 0.105 25149
5922 1 16 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.255 1.729 25149
5923 1 16 . 1 1 32 32 LEU N N 32 120.023 120.023 116.983 3.040 25149
5924 1 16 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.641 0.075 25149
5925 1 16 . 1 1 32 32 LEU C C 32 176.300 176.300 175.800 0.500 25149
5926 1 16 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.443 0.478 25149
5927 1 16 . 1 1 32 32 LEU CB C 32 43.336 43.336 42.788 0.548 25149
5928 1 16 . 1 1 32 32 LEU H H 32 8.580 8.580 7.903 0.677 25149
5929 1 16 . 1 1 33 33 VAL N N 33 116.217 116.217 118.154 -1.937 25149
5930 1 16 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.549 0.114 25149
5931 1 16 . 1 1 33 33 VAL C C 33 171.374 171.374 173.544 -2.170 25149
5932 1 16 . 1 1 33 33 VAL CA C 33 60.449 60.449 59.705 0.744 25149
5933 1 16 . 1 1 33 33 VAL CB C 33 36.448 36.448 36.151 0.298 25149
5934 1 16 . 1 1 33 33 VAL H H 33 8.594 8.594 8.155 0.439 25149
5935 1 16 . 1 1 34 34 TRP N N 34 122.711 122.711 125.194 -2.483 25149
5936 1 16 . 1 1 34 34 TRP HA H 34 5.339 5.339 5.379 -0.040 25149
5937 1 16 . 1 1 34 34 TRP C C 34 176.770 176.770 175.780 0.990 25149
5938 1 16 . 1 1 34 34 TRP CA C 34 57.267 57.267 55.669 1.598 25149
5939 1 16 . 1 1 34 34 TRP CB C 34 33.780 33.780 33.495 0.285 25149
5940 1 16 . 1 1 34 34 TRP H H 34 8.756 8.756 8.659 0.097 25149
5941 1 16 . 1 1 35 35 GLY N N 35 107.569 107.569 107.647 -0.078 25149
5942 1 16 . 1 1 35 35 GLY C C 35 177.397 177.397 173.802 3.595 25149
5943 1 16 . 1 1 35 35 GLY CA C 35 44.070 44.070 44.073 -0.003 25149
5944 1 16 . 1 1 35 35 GLY H H 35 8.857 8.857 8.543 0.314 25149
5945 1 16 . 1 1 36 36 GLN N N 36 122.723 122.723 118.241 4.482 25149
5946 1 16 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.044 -0.298 25149
5947 1 16 . 1 1 36 36 GLN C C 36 176.445 176.445 176.049 0.396 25149
5948 1 16 . 1 1 36 36 GLN CA C 36 58.429 58.429 57.872 0.557 25149
5949 1 16 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.325 -0.693 25149
5950 1 16 . 1 1 36 36 GLN H H 36 8.338 8.338 8.610 -0.272 25149
5951 1 16 . 1 1 37 37 CYS N N 37 115.763 115.763 113.775 1.988 25149
5952 1 16 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.889 -0.605 25149
5953 1 16 . 1 1 37 37 CYS C C 37 175.281 175.281 175.438 -0.157 25149
5954 1 16 . 1 1 37 37 CYS CA C 37 58.395 58.395 55.648 2.747 25149
5955 1 16 . 1 1 37 37 CYS CB C 37 31.143 31.143 31.489 -0.346 25149
5956 1 16 . 1 1 37 37 CYS H H 37 7.622 7.622 7.575 0.047 25149
5957 1 16 . 1 1 38 38 SER N N 38 114.540 114.540 113.941 0.599 25149
5958 1 16 . 1 1 38 38 SER HA H 38 4.004 4.004 4.272 -0.268 25149
5959 1 16 . 1 1 38 38 SER C C 38 173.389 173.389 174.286 -0.897 25149
5960 1 16 . 1 1 38 38 SER CA C 38 62.285 62.285 59.897 2.388 25149
5961 1 16 . 1 1 38 38 SER H H 38 7.716 7.716 8.469 -0.753 25149
5962 1 16 . 1 1 39 39 HIS N N 39 121.947 121.947 121.162 0.785 25149
5963 1 16 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.329 0.115 25149
5964 1 16 . 1 1 39 39 HIS C C 39 172.326 172.326 174.007 -1.681 25149
5965 1 16 . 1 1 39 39 HIS CA C 39 61.320 61.320 57.389 3.931 25149
5966 1 16 . 1 1 39 39 HIS CB C 39 31.523 31.523 30.276 1.247 25149
5967 1 16 . 1 1 39 39 HIS H H 39 7.829 7.829 7.437 0.392 25149
5968 1 16 . 1 1 40 40 CYS N N 40 121.859 121.859 126.715 -4.856 25149
5969 1 16 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.448 0.161 25149
5970 1 16 . 1 1 40 40 CYS C C 40 171.900 171.900 171.964 -0.064 25149
5971 1 16 . 1 1 40 40 CYS CA C 40 55.791 55.791 56.595 -0.804 25149
5972 1 16 . 1 1 40 40 CYS CB C 40 28.964 28.964 27.035 1.929 25149
5973 1 16 . 1 1 40 40 CYS H H 40 8.049 8.049 8.834 -0.785 25149
5974 1 16 . 1 1 41 41 PHE N N 41 120.690 120.690 124.767 -4.077 25149
5975 1 16 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.489 0.688 25149
5976 1 16 . 1 1 41 41 PHE C C 41 176.613 176.613 174.650 1.963 25149
5977 1 16 . 1 1 41 41 PHE CA C 41 56.033 56.033 55.098 0.935 25149
5978 1 16 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.145 2.615 25149
5979 1 16 . 1 1 41 41 PHE H H 41 8.368 8.368 8.413 -0.045 25149
5980 1 16 . 1 1 42 42 HIS N N 42 117.057 117.057 122.941 -5.884 25149
5981 1 16 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.406 0.263 25149
5982 1 16 . 1 1 42 42 HIS C C 42 177.464 177.464 176.522 0.942 25149
5983 1 16 . 1 1 42 42 HIS CA C 42 60.425 60.425 57.082 3.343 25149
5984 1 16 . 1 1 42 42 HIS CB C 42 29.740 29.740 30.191 -0.451 25149
5985 1 16 . 1 1 42 42 HIS H H 42 8.384 8.384 8.206 0.178 25149
5986 1 16 . 1 1 43 43 MET N N 43 128.543 128.543 126.080 2.463 25149
5987 1 16 . 1 1 43 43 MET HA H 43 3.965 3.965 4.006 -0.041 25149
5988 1 16 . 1 1 43 43 MET C C 43 177.845 177.845 177.288 0.557 25149
5989 1 16 . 1 1 43 43 MET CA C 43 59.209 59.209 60.156 -0.946 25149
5990 1 16 . 1 1 43 43 MET CB C 43 33.009 33.009 32.493 0.516 25149
5991 1 16 . 1 1 43 43 MET H H 43 9.439 9.439 8.365 1.074 25149
5992 1 16 . 1 1 44 44 HIS N N 44 116.500 116.500 117.449 -0.949 25149
5993 1 16 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.154 0.102 25149
5994 1 16 . 1 1 44 44 HIS C C 44 178.405 178.405 177.664 0.741 25149
5995 1 16 . 1 1 44 44 HIS CA C 44 58.793 58.793 59.074 -0.281 25149
5996 1 16 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.198 3.549 25149
5997 1 16 . 1 1 44 44 HIS H H 44 9.747 9.747 7.864 1.883 25149
5998 1 16 . 1 1 45 45 CYS N N 45 115.950 115.950 117.145 -1.195 25149
5999 1 16 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.186 -0.186 25149
6000 1 16 . 1 1 45 45 CYS C C 45 177.957 177.957 176.743 1.214 25149
6001 1 16 . 1 1 45 45 CYS CA C 45 62.923 62.923 63.247 -0.324 25149
6002 1 16 . 1 1 45 45 CYS CB C 45 29.102 29.102 26.284 2.818 25149
6003 1 16 . 1 1 45 45 CYS H H 45 6.845 6.845 8.305 -1.460 25149
6004 1 16 . 1 1 46 46 ILE N N 46 119.362 119.362 121.327 -1.965 25149
6005 1 16 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.676 -0.011 25149
6006 1 16 . 1 1 46 46 ILE C C 46 176.613 176.613 177.732 -1.119 25149
6007 1 16 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.429 -4.187 25149
6008 1 16 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.710 -0.391 25149
6009 1 16 . 1 1 46 46 ILE H H 46 7.816 7.816 7.838 -0.022 25149
6010 1 16 . 1 1 47 47 LEU N N 47 122.180 122.180 120.276 1.904 25149
6011 1 16 . 1 1 47 47 LEU HA H 47 3.873 3.873 3.931 -0.058 25149
6012 1 16 . 1 1 47 47 LEU C C 47 179.726 179.726 178.593 1.133 25149
6013 1 16 . 1 1 47 47 LEU CA C 47 58.633 58.633 58.901 -0.268 25149
6014 1 16 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.576 -0.453 25149
6015 1 16 . 1 1 47 47 LEU H H 47 8.266 8.266 8.586 -0.320 25149
6016 1 16 . 1 1 48 48 LYS N N 48 118.251 118.251 118.631 -0.380 25149
6017 1 16 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.100 -0.236 25149
6018 1 16 . 1 1 48 48 LYS C C 48 179.423 179.423 178.786 0.637 25149
6019 1 16 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.693 0.294 25149
6020 1 16 . 1 1 48 48 LYS CB C 48 32.765 32.765 32.042 0.723 25149
6021 1 16 . 1 1 48 48 LYS H H 48 7.147 7.147 8.028 -0.881 25149
6022 1 16 . 1 1 49 49 TRP N N 49 120.745 120.745 121.529 -0.784 25149
6023 1 16 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.307 -0.227 25149
6024 1 16 . 1 1 49 49 TRP C C 49 178.147 178.147 178.127 0.020 25149
6025 1 16 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.999 -0.454 25149
6026 1 16 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.258 0.157 25149
6027 1 16 . 1 1 49 49 TRP H H 49 7.709 7.709 8.163 -0.454 25149
6028 1 16 . 1 1 50 50 LEU N N 50 117.236 117.236 117.834 -0.598 25149
6029 1 16 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.557 0.048 25149
6030 1 16 . 1 1 50 50 LEU C C 50 179.658 179.658 177.248 2.410 25149
6031 1 16 . 1 1 50 50 LEU CA C 50 57.330 57.330 55.156 2.174 25149
6032 1 16 . 1 1 50 50 LEU CB C 50 41.416 41.416 41.958 -0.542 25149
6033 1 16 . 1 1 50 50 LEU H H 50 8.512 8.512 7.902 0.610 25149
6034 1 16 . 1 1 51 51 HIS N N 51 115.650 115.650 117.159 -1.509 25149
6035 1 16 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.556 -0.282 25149
6036 1 16 . 1 1 51 51 HIS C C 51 175.942 175.942 176.553 -0.611 25149
6037 1 16 . 1 1 51 51 HIS CA C 51 57.320 57.320 56.881 0.439 25149
6038 1 16 . 1 1 51 51 HIS CB C 51 29.487 29.487 29.686 -0.199 25149
6039 1 16 . 1 1 51 51 HIS H H 51 7.713 7.713 8.359 -0.646 25149
6040 1 16 . 1 1 52 52 ALA N N 52 119.779 119.779 120.867 -1.088 25149
6041 1 16 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.367 -0.344 25149
6042 1 16 . 1 1 52 52 ALA C C 52 177.834 177.834 177.301 0.533 25149
6043 1 16 . 1 1 52 52 ALA CA C 52 52.865 52.865 53.355 -0.490 25149
6044 1 16 . 1 1 52 52 ALA CB C 52 18.951 18.951 19.698 -0.747 25149
6045 1 16 . 1 1 52 52 ALA H H 52 7.191 7.191 8.075 -0.884 25149
6046 1 16 . 1 1 53 53 GLN N N 53 117.047 117.047 116.001 1.046 25149
6047 1 16 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.576 -0.643 25149
6048 1 16 . 1 1 53 53 GLN C C 53 175.998 175.998 174.783 1.215 25149
6049 1 16 . 1 1 53 53 GLN CA C 53 55.482 55.482 54.551 0.931 25149
6050 1 16 . 1 1 53 53 GLN CB C 53 28.887 28.887 30.827 -1.940 25149
6051 1 16 . 1 1 53 53 GLN H H 53 7.317 7.317 7.650 -0.333 25149
6052 1 16 . 1 1 54 54 GLN N N 54 118.463 118.463 117.920 0.543 25149
6053 1 16 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.399 -0.410 25149
6054 1 16 . 1 1 54 54 GLN C C 54 176.300 176.300 177.079 -0.779 25149
6055 1 16 . 1 1 54 54 GLN CA C 54 57.314 57.314 56.313 1.001 25149
6056 1 16 . 1 1 54 54 GLN CB C 54 28.823 28.823 29.042 -0.219 25149
6057 1 16 . 1 1 54 54 GLN H H 54 7.949 7.949 8.342 -0.393 25149
6058 1 16 . 1 1 55 55 VAL N N 55 116.755 116.755 120.664 -3.909 25149
6059 1 16 . 1 1 55 55 VAL HA H 55 3.884 3.884 3.896 -0.012 25149
6060 1 16 . 1 1 55 55 VAL C C 55 175.774 175.774 176.309 -0.535 25149
6061 1 16 . 1 1 55 55 VAL CA C 55 63.210 63.210 64.710 -1.500 25149
6062 1 16 . 1 1 55 55 VAL CB C 55 32.870 32.870 31.820 1.050 25149
6063 1 16 . 1 1 55 55 VAL H H 55 7.801 7.801 7.845 -0.044 25149
6064 1 16 . 1 1 56 56 GLN N N 56 120.192 120.192 118.544 1.648 25149
6065 1 16 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.567 -0.450 25149
6066 1 16 . 1 1 56 56 GLN C C 56 175.236 175.236 175.564 -0.328 25149
6067 1 16 . 1 1 56 56 GLN CA C 56 55.697 55.697 55.400 0.297 25149
6068 1 16 . 1 1 56 56 GLN CB C 56 29.319 29.319 28.252 1.067 25149
6069 1 16 . 1 1 56 56 GLN H H 56 8.018 8.018 8.324 -0.306 25149
6070 1 16 . 1 1 57 57 GLN N N 57 121.276 121.276 121.904 -0.628 25149
6071 1 16 . 1 1 57 57 GLN HA H 57 4.204 4.204 4.232 -0.028 25149
6072 1 16 . 1 1 57 57 GLN C C 57 175.819 175.819 175.495 0.324 25149
6073 1 16 . 1 1 57 57 GLN CA C 57 55.617 55.617 55.562 0.056 25149
6074 1 16 . 1 1 57 57 GLN CB C 57 29.094 29.094 29.564 -0.470 25149
6075 1 16 . 1 1 57 57 GLN H H 57 8.471 8.471 8.681 -0.210 25149
6076 1 16 . 1 1 58 58 HIS N N 58 120.001 120.001 120.059 -0.058 25149
6077 1 16 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.395 0.779 25149
6078 1 16 . 1 1 58 58 HIS C C 58 173.636 173.636 175.913 -2.277 25149
6079 1 16 . 1 1 58 58 HIS CA C 58 54.353 54.353 57.615 -3.262 25149
6080 1 16 . 1 1 58 58 HIS CB C 58 33.057 33.057 29.351 3.706 25149
6081 1 16 . 1 1 58 58 HIS H H 58 8.366 8.366 7.937 0.429 25149
6082 1 16 . 1 1 59 59 CYS N N 59 121.924 121.924 122.450 -0.526 25149
6083 1 16 . 1 1 59 59 CYS HA H 59 4.442 4.442 3.935 0.507 25149
6084 1 16 . 1 1 59 59 CYS C C 59 176.334 176.334 174.658 1.676 25149
6085 1 16 . 1 1 59 59 CYS CA C 59 56.772 56.772 61.388 -4.616 25149
6086 1 16 . 1 1 59 59 CYS CB C 59 32.642 32.642 28.860 3.782 25149
6087 1 16 . 1 1 59 59 CYS H H 59 9.035 9.035 8.243 0.792 25149
6088 1 16 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.246 -0.433 25149
6089 1 16 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.637 0.024 25149
6090 1 16 . 1 1 60 60 PRO CB C 60 30.659 30.659 31.244 -0.585 25149
6091 1 16 . 1 1 61 61 MET N N 61 117.676 117.676 113.257 4.419 25149
6092 1 16 . 1 1 61 61 MET HA H 61 4.317 4.317 4.516 -0.199 25149
6093 1 16 . 1 1 61 61 MET C C 61 177.117 177.117 175.867 1.250 25149
6094 1 16 . 1 1 61 61 MET CA C 61 56.408 56.408 55.537 0.871 25149
6095 1 16 . 1 1 61 61 MET CB C 61 32.551 32.551 33.199 -0.648 25149
6096 1 16 . 1 1 61 61 MET H H 61 9.135 9.135 7.550 1.585 25149
6097 1 16 . 1 1 62 62 CYS N N 62 117.214 117.214 121.471 -4.257 25149
6098 1 16 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.439 0.435 25149
6099 1 16 . 1 1 62 62 CYS C C 62 175.740 175.740 175.392 0.348 25149
6100 1 16 . 1 1 62 62 CYS CA C 62 58.273 58.273 59.550 -1.277 25149
6101 1 16 . 1 1 62 62 CYS CB C 62 32.776 32.776 29.110 3.666 25149
6102 1 16 . 1 1 62 62 CYS H H 62 8.011 8.011 7.629 0.382 25149
6103 1 16 . 1 1 63 63 ARG N N 63 116.555 116.555 118.420 -1.865 25149
6104 1 16 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.423 -0.498 25149
6105 1 16 . 1 1 63 63 ARG C C 63 175.326 175.326 175.224 0.102 25149
6106 1 16 . 1 1 63 63 ARG CA C 63 58.073 58.073 55.789 2.284 25149
6107 1 16 . 1 1 63 63 ARG CB C 63 27.136 27.136 30.626 -3.490 25149
6108 1 16 . 1 1 63 63 ARG H H 63 8.086 8.086 8.423 -0.337 25149
6109 1 16 . 1 1 64 64 GLN N N 64 118.932 118.932 118.216 0.716 25149
6110 1 16 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.520 -0.261 25149
6111 1 16 . 1 1 64 64 GLN C C 64 176.054 176.054 176.049 0.005 25149
6112 1 16 . 1 1 64 64 GLN CA C 64 56.316 56.316 54.122 2.194 25149
6113 1 16 . 1 1 64 64 GLN CB C 64 30.083 30.083 29.039 1.044 25149
6114 1 16 . 1 1 64 64 GLN H H 64 8.003 8.003 7.831 0.172 25149
6115 1 16 . 1 1 65 65 GLU N N 65 122.038 122.038 122.589 -0.551 25149
6116 1 16 . 1 1 65 65 GLU HA H 65 4.003 4.003 4.128 -0.125 25149
6117 1 16 . 1 1 65 65 GLU C C 65 176.781 176.781 176.056 0.725 25149
6118 1 16 . 1 1 65 65 GLU CA C 65 57.682 57.682 56.265 1.417 25149
6119 1 16 . 1 1 65 65 GLU CB C 65 29.900 29.900 28.932 0.968 25149
6120 1 16 . 1 1 65 65 GLU H H 65 8.657 8.657 8.546 0.111 25149
6121 1 16 . 1 1 66 66 TRP N N 66 125.730 125.730 129.206 -3.476 25149
6122 1 16 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.262 0.142 25149
6123 1 16 . 1 1 66 66 TRP C C 66 175.460 175.460 174.942 0.518 25149
6124 1 16 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.825 -0.200 25149
6125 1 16 . 1 1 66 66 TRP CB C 66 29.358 29.358 29.879 -0.521 25149
6126 1 16 . 1 1 66 66 TRP H H 66 8.499 8.499 8.426 0.073 25149
6127 1 16 . 1 1 67 67 LYS N N 67 127.396 127.396 127.576 -0.180 25149
6128 1 16 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.038 -0.020 25149
6129 1 16 . 1 1 67 67 LYS C C 67 175.180 175.180 175.189 -0.009 25149
6130 1 16 . 1 1 67 67 LYS CA C 67 54.514 54.514 54.020 0.494 25149
6131 1 16 . 1 1 67 67 LYS CB C 67 36.231 36.231 34.220 2.011 25149
6132 1 16 . 1 1 67 67 LYS H H 67 6.930 6.930 8.386 -1.456 25149
6133 1 16 . 1 1 68 68 PHE N N 68 121.511 121.511 126.411 -4.900 25149
6134 1 16 . 1 1 68 68 PHE HA H 68 4.108 4.108 4.013 0.095 25149
6135 1 16 . 1 1 68 68 PHE C C 68 176.613 176.613 175.793 0.820 25149
6136 1 16 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.297 2.664 25149
6137 1 16 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.880 1.382 25149
6138 1 16 . 1 1 68 68 PHE H H 68 8.430 8.430 8.437 -0.007 25149
6139 1 16 . 1 1 69 69 LYS N N 69 124.210 124.210 122.010 2.200 25149
6140 1 16 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.076 -0.081 25149
6141 1 16 . 1 1 69 69 LYS C C 69 175.651 175.651 176.073 -0.422 25149
6142 1 16 . 1 1 69 69 LYS CA C 69 57.320 57.320 57.376 -0.056 25149
6143 1 16 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.574 -0.213 25149
6144 1 16 . 1 1 69 69 LYS H H 69 8.738 8.738 8.158 0.580 25149
6145 1 17 . 1 1 2 2 SER HA H 2 4.417 4.417 4.820 -0.403 25149
6146 1 17 . 1 1 2 2 SER CA C 2 58.322 58.322 57.773 0.549 25149
6147 1 17 . 1 1 2 2 SER CB C 2 64.169 64.169 63.985 0.184 25149
6148 1 17 . 1 1 3 3 VAL N N 3 121.214 121.214 125.225 -4.011 25149
6149 1 17 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.301 -0.255 25149
6150 1 17 . 1 1 3 3 VAL C C 3 175.879 175.879 174.915 0.964 25149
6151 1 17 . 1 1 3 3 VAL CA C 3 62.138 62.138 62.171 -0.033 25149
6152 1 17 . 1 1 3 3 VAL CB C 3 32.958 32.958 31.504 1.454 25149
6153 1 17 . 1 1 3 3 VAL H H 3 8.170 8.170 8.573 -0.403 25149
6154 1 17 . 1 1 4 4 ALA N N 4 127.312 127.312 125.222 2.090 25149
6155 1 17 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.544 -0.347 25149
6156 1 17 . 1 1 4 4 ALA C C 4 177.497 177.497 176.343 1.154 25149
6157 1 17 . 1 1 4 4 ALA CA C 4 52.439 52.439 51.920 0.519 25149
6158 1 17 . 1 1 4 4 ALA CB C 4 19.424 19.424 18.971 0.452 25149
6159 1 17 . 1 1 4 4 ALA H H 4 8.294 8.294 7.774 0.520 25149
6160 1 17 . 1 1 5 5 ASN N N 5 117.674 117.674 122.249 -4.575 25149
6161 1 17 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.890 -0.325 25149
6162 1 17 . 1 1 5 5 ASN C C 5 175.048 175.048 174.404 0.644 25149
6163 1 17 . 1 1 5 5 ASN CA C 5 53.725 53.725 53.747 -0.022 25149
6164 1 17 . 1 1 5 5 ASN CB C 5 39.197 39.197 40.963 -1.766 25149
6165 1 17 . 1 1 5 5 ASN H H 5 8.252 8.252 8.414 -0.162 25149
6166 1 17 . 1 1 6 6 ASP N N 6 119.896 119.896 121.814 -1.918 25149
6167 1 17 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.773 -0.253 25149
6168 1 17 . 1 1 6 6 ASP C C 6 176.269 176.269 176.212 0.057 25149
6169 1 17 . 1 1 6 6 ASP CA C 6 54.497 54.497 54.086 0.412 25149
6170 1 17 . 1 1 6 6 ASP CB C 6 41.104 41.104 41.794 -0.690 25149
6171 1 17 . 1 1 6 6 ASP H H 6 8.215 8.215 8.717 -0.502 25149
6172 1 17 . 1 1 7 7 GLU N N 7 119.101 119.101 116.616 2.485 25149
6173 1 17 . 1 1 7 7 GLU HA H 7 4.243 4.243 4.417 -0.174 25149
6174 1 17 . 1 1 7 7 GLU C C 7 175.006 175.006 175.133 -0.127 25149
6175 1 17 . 1 1 7 7 GLU CA C 7 56.689 56.689 56.567 0.122 25149
6176 1 17 . 1 1 7 7 GLU CB C 7 30.379 30.379 29.457 0.922 25149
6177 1 17 . 1 1 7 7 GLU H H 7 8.065 8.065 8.273 -0.208 25149
6178 1 17 . 1 1 8 8 ASN N N 8 116.852 116.852 116.342 0.510 25149
6179 1 17 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.262 -0.104 25149
6180 1 17 . 1 1 8 8 ASN C C 8 172.706 172.706 175.024 -2.318 25149
6181 1 17 . 1 1 8 8 ASN CA C 8 51.165 51.165 51.347 -0.182 25149
6182 1 17 . 1 1 8 8 ASN CB C 8 40.702 40.702 39.375 1.327 25149
6183 1 17 . 1 1 8 8 ASN H H 8 7.505 7.505 7.388 0.117 25149
6184 1 17 . 1 1 9 9 CYS N N 9 122.855 122.855 120.945 1.910 25149
6185 1 17 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.645 0.149 25149
6186 1 17 . 1 1 9 9 CYS C C 9 178.370 178.370 176.523 1.847 25149
6187 1 17 . 1 1 9 9 CYS CA C 9 59.552 59.552 60.750 -1.198 25149
6188 1 17 . 1 1 9 9 CYS CB C 9 31.526 31.526 28.919 2.607 25149
6189 1 17 . 1 1 9 9 CYS H H 9 7.614 7.614 7.455 0.159 25149
6190 1 17 . 1 1 10 10 GLY N N 10 117.295 117.295 111.847 5.448 25149
6191 1 17 . 1 1 10 10 GLY C C 10 174.111 174.111 174.789 -0.678 25149
6192 1 17 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.794 1.173 25149
6193 1 17 . 1 1 10 10 GLY H H 10 9.235 9.235 7.891 1.344 25149
6194 1 17 . 1 1 11 11 ILE N N 11 119.811 119.811 121.916 -2.105 25149
6195 1 17 . 1 1 11 11 ILE HA H 11 3.809 3.809 4.135 -0.326 25149
6196 1 17 . 1 1 11 11 ILE C C 11 176.121 176.121 176.848 -0.727 25149
6197 1 17 . 1 1 11 11 ILE CA C 11 64.041 64.041 63.383 0.659 25149
6198 1 17 . 1 1 11 11 ILE CB C 11 39.411 39.411 39.157 0.254 25149
6199 1 17 . 1 1 11 11 ILE H H 11 8.285 8.285 7.720 0.565 25149
6200 1 17 . 1 1 12 12 CYS N N 12 116.728 116.728 116.873 -0.145 25149
6201 1 17 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.805 -0.229 25149
6202 1 17 . 1 1 12 12 CYS C C 12 175.975 175.975 174.026 1.949 25149
6203 1 17 . 1 1 12 12 CYS CA C 12 59.225 59.225 57.085 2.140 25149
6204 1 17 . 1 1 12 12 CYS CB C 12 32.246 32.246 30.442 1.804 25149
6205 1 17 . 1 1 12 12 CYS H H 12 7.607 7.607 7.572 0.035 25149
6206 1 17 . 1 1 13 13 ARG N N 13 116.073 116.073 116.304 -0.231 25149
6207 1 17 . 1 1 13 13 ARG HA H 13 3.742 3.742 4.021 -0.279 25149
6208 1 17 . 1 1 13 13 ARG C C 13 174.979 174.979 174.859 0.120 25149
6209 1 17 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.548 1.088 25149
6210 1 17 . 1 1 13 13 ARG CB C 13 26.326 26.326 26.918 -0.592 25149
6211 1 17 . 1 1 13 13 ARG H H 13 7.987 7.987 8.318 -0.331 25149
6212 1 17 . 1 1 14 14 MET N N 14 119.313 119.313 118.984 0.329 25149
6213 1 17 . 1 1 14 14 MET HA H 14 4.547 4.547 4.430 0.117 25149
6214 1 17 . 1 1 14 14 MET C C 14 176.143 176.143 175.609 0.534 25149
6215 1 17 . 1 1 14 14 MET CA C 14 54.208 54.208 54.364 -0.156 25149
6216 1 17 . 1 1 14 14 MET CB C 14 33.951 33.951 33.997 -0.046 25149
6217 1 17 . 1 1 14 14 MET H H 14 8.624 8.624 7.531 1.093 25149
6218 1 17 . 1 1 15 15 ALA N N 15 122.683 122.683 128.816 -6.133 25149
6219 1 17 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.022 0.250 25149
6220 1 17 . 1 1 15 15 ALA C C 15 180.117 180.117 178.364 1.753 25149
6221 1 17 . 1 1 15 15 ALA CA C 15 52.346 52.346 51.954 0.392 25149
6222 1 17 . 1 1 15 15 ALA CB C 15 19.487 19.487 18.874 0.613 25149
6223 1 17 . 1 1 15 15 ALA H H 15 7.965 7.965 8.207 -0.242 25149
6224 1 17 . 1 1 16 16 PHE N N 16 119.313 119.313 123.228 -3.915 25149
6225 1 17 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.162 -0.121 25149
6226 1 17 . 1 1 16 16 PHE C C 16 176.423 176.423 176.600 -0.177 25149
6227 1 17 . 1 1 16 16 PHE CA C 16 59.130 59.130 60.014 -0.884 25149
6228 1 17 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.316 0.074 25149
6229 1 17 . 1 1 16 16 PHE H H 16 8.095 8.095 7.875 0.220 25149
6230 1 17 . 1 1 17 17 ASN N N 17 112.313 112.313 115.261 -2.948 25149
6231 1 17 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.806 -0.170 25149
6232 1 17 . 1 1 17 17 ASN C C 17 175.337 175.337 175.878 -0.541 25149
6233 1 17 . 1 1 17 17 ASN CA C 17 52.961 52.961 54.063 -1.102 25149
6234 1 17 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.807 -1.633 25149
6235 1 17 . 1 1 17 17 ASN H H 17 7.823 7.823 8.273 -0.450 25149
6236 1 17 . 1 1 18 18 GLY N N 18 107.742 107.742 108.154 -0.412 25149
6237 1 17 . 1 1 18 18 GLY C C 18 173.759 173.759 172.589 1.170 25149
6238 1 17 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.622 -0.158 25149
6239 1 17 . 1 1 18 18 GLY H H 18 7.579 7.579 8.253 -0.674 25149
6240 1 17 . 1 1 19 19 CYS N N 19 117.050 117.050 117.668 -0.618 25149
6241 1 17 . 1 1 19 19 CYS HA H 19 4.571 4.571 5.031 -0.460 25149
6242 1 17 . 1 1 19 19 CYS C C 19 174.039 174.039 175.104 -1.065 25149
6243 1 17 . 1 1 19 19 CYS CA C 19 58.433 58.433 56.265 2.168 25149
6244 1 17 . 1 1 19 19 CYS CB C 19 30.681 30.681 30.117 0.564 25149
6245 1 17 . 1 1 19 19 CYS H H 19 8.198 8.198 8.264 -0.066 25149
6246 1 17 . 1 1 20 20 CYS N N 20 123.923 123.923 121.978 1.945 25149
6247 1 17 . 1 1 20 20 CYS HA H 20 4.011 4.011 3.991 0.020 25149
6248 1 17 . 1 1 20 20 CYS C C 20 173.736 173.736 174.616 -0.880 25149
6249 1 17 . 1 1 20 20 CYS CA C 20 57.999 57.999 60.772 -2.773 25149
6250 1 17 . 1 1 20 20 CYS CB C 20 28.205 28.205 26.565 1.640 25149
6251 1 17 . 1 1 20 20 CYS H H 20 8.466 8.466 9.067 -0.601 25149
6252 1 17 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.362 -0.333 25149
6253 1 17 . 1 1 21 21 PRO CA C 21 65.426 65.426 64.137 1.289 25149
6254 1 17 . 1 1 21 21 PRO CB C 21 32.801 32.801 32.072 0.729 25149
6255 1 17 . 1 1 22 22 ASP N N 22 117.053 117.053 119.056 -2.003 25149
6256 1 17 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.381 0.124 25149
6257 1 17 . 1 1 22 22 ASP C C 22 176.501 176.501 176.583 -0.082 25149
6258 1 17 . 1 1 22 22 ASP CA C 22 55.017 55.017 54.789 0.228 25149
6259 1 17 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.380 2.142 25149
6260 1 17 . 1 1 22 22 ASP H H 22 8.395 8.395 8.456 -0.061 25149
6261 1 17 . 1 1 23 23 CYS N N 23 123.353 123.353 116.979 6.374 25149
6262 1 17 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.160 0.133 25149
6263 1 17 . 1 1 23 23 CYS C C 23 175.214 175.214 174.862 0.352 25149
6264 1 17 . 1 1 23 23 CYS CA C 23 61.633 61.633 59.807 1.826 25149
6265 1 17 . 1 1 23 23 CYS CB C 23 31.542 31.542 29.242 2.300 25149
6266 1 17 . 1 1 23 23 CYS H H 23 7.246 7.246 7.896 -0.650 25149
6267 1 17 . 1 1 24 24 LYS N N 24 117.539 117.539 125.552 -8.013 25149
6268 1 17 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.084 0.146 25149
6269 1 17 . 1 1 24 24 LYS C C 24 177.106 177.106 176.108 0.998 25149
6270 1 17 . 1 1 24 24 LYS CA C 24 56.921 56.921 56.366 0.555 25149
6271 1 17 . 1 1 24 24 LYS CB C 24 34.615 34.615 31.600 3.015 25149
6272 1 17 . 1 1 24 24 LYS H H 24 8.173 8.173 8.390 -0.217 25149
6273 1 17 . 1 1 25 25 VAL N N 25 120.661 120.661 120.752 -0.091 25149
6274 1 17 . 1 1 25 25 VAL HA H 25 4.429 4.429 3.785 0.644 25149
6275 1 17 . 1 1 25 25 VAL C C 25 174.027 174.027 174.176 -0.149 25149
6276 1 17 . 1 1 25 25 VAL CA C 25 59.934 59.934 62.188 -2.254 25149
6277 1 17 . 1 1 25 25 VAL CB C 25 33.507 33.507 31.886 1.621 25149
6278 1 17 . 1 1 25 25 VAL H H 25 7.787 7.787 7.475 0.312 25149
6279 1 17 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.453 -0.117 25149
6280 1 17 . 1 1 26 26 PRO CA C 26 63.279 63.279 63.544 -0.265 25149
6281 1 17 . 1 1 26 26 PRO CB C 26 32.077 32.077 32.211 -0.134 25149
6282 1 17 . 1 1 27 27 GLY N N 27 109.926 109.926 108.840 1.086 25149
6283 1 17 . 1 1 27 27 GLY C C 27 175.169 175.169 173.071 2.098 25149
6284 1 17 . 1 1 27 27 GLY CA C 27 45.042 45.042 45.303 -0.261 25149
6285 1 17 . 1 1 27 27 GLY H H 27 8.569 8.569 7.565 1.004 25149
6286 1 17 . 1 1 28 28 ASP N N 28 122.592 122.592 120.684 1.908 25149
6287 1 17 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.738 -0.507 25149
6288 1 17 . 1 1 28 28 ASP C C 28 176.602 176.602 175.749 0.853 25149
6289 1 17 . 1 1 28 28 ASP CA C 28 56.402 56.402 54.102 2.300 25149
6290 1 17 . 1 1 28 28 ASP CB C 28 40.912 40.912 41.621 -0.709 25149
6291 1 17 . 1 1 28 28 ASP H H 28 8.214 8.214 8.276 -0.062 25149
6292 1 17 . 1 1 29 29 ASP N N 29 117.500 117.500 123.056 -5.556 25149
6293 1 17 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.698 -0.251 25149
6294 1 17 . 1 1 29 29 ASP C C 29 175.505 175.505 175.399 0.106 25149
6295 1 17 . 1 1 29 29 ASP CA C 29 55.266 55.266 55.163 0.103 25149
6296 1 17 . 1 1 29 29 ASP CB C 29 41.225 41.225 39.675 1.550 25149
6297 1 17 . 1 1 29 29 ASP H H 29 8.271 8.271 8.760 -0.489 25149
6298 1 17 . 1 1 30 30 CYS N N 30 124.470 124.470 118.829 5.641 25149
6299 1 17 . 1 1 30 30 CYS HA H 30 4.390 4.390 5.012 -0.622 25149
6300 1 17 . 1 1 30 30 CYS C C 30 171.755 171.755 172.674 -0.919 25149
6301 1 17 . 1 1 30 30 CYS CA C 30 57.676 57.676 56.035 1.641 25149
6302 1 17 . 1 1 30 30 CYS CB C 30 29.154 29.154 28.950 0.204 25149
6303 1 17 . 1 1 30 30 CYS H H 30 7.912 7.912 8.231 -0.319 25149
6304 1 17 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.595 0.092 25149
6305 1 17 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.635 0.240 25149
6306 1 17 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.351 1.633 25149
6307 1 17 . 1 1 32 32 LEU N N 32 120.023 120.023 118.103 1.920 25149
6308 1 17 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.532 0.184 25149
6309 1 17 . 1 1 32 32 LEU C C 32 176.300 176.300 175.382 0.918 25149
6310 1 17 . 1 1 32 32 LEU CA C 32 53.921 53.921 54.146 -0.225 25149
6311 1 17 . 1 1 32 32 LEU CB C 32 43.336 43.336 43.237 0.099 25149
6312 1 17 . 1 1 32 32 LEU H H 32 8.580 8.580 8.116 0.464 25149
6313 1 17 . 1 1 33 33 VAL N N 33 116.217 116.217 118.710 -2.493 25149
6314 1 17 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.528 0.135 25149
6315 1 17 . 1 1 33 33 VAL C C 33 171.374 171.374 174.266 -2.892 25149
6316 1 17 . 1 1 33 33 VAL CA C 33 60.449 60.449 60.538 -0.089 25149
6317 1 17 . 1 1 33 33 VAL CB C 33 36.448 36.448 35.077 1.371 25149
6318 1 17 . 1 1 33 33 VAL H H 33 8.594 8.594 8.139 0.455 25149
6319 1 17 . 1 1 34 34 TRP N N 34 122.711 122.711 126.233 -3.522 25149
6320 1 17 . 1 1 34 34 TRP HA H 34 5.339 5.339 5.229 0.110 25149
6321 1 17 . 1 1 34 34 TRP C C 34 176.770 176.770 175.722 1.048 25149
6322 1 17 . 1 1 34 34 TRP CA C 34 57.267 57.267 56.048 1.219 25149
6323 1 17 . 1 1 34 34 TRP CB C 34 33.780 33.780 33.474 0.306 25149
6324 1 17 . 1 1 34 34 TRP H H 34 8.756 8.756 8.756 0.000 25149
6325 1 17 . 1 1 35 35 GLY N N 35 107.569 107.569 107.120 0.449 25149
6326 1 17 . 1 1 35 35 GLY C C 35 177.397 177.397 173.770 3.627 25149
6327 1 17 . 1 1 35 35 GLY CA C 35 44.070 44.070 44.154 -0.084 25149
6328 1 17 . 1 1 35 35 GLY H H 35 8.857 8.857 8.446 0.411 25149
6329 1 17 . 1 1 36 36 GLN N N 36 122.723 122.723 117.958 4.765 25149
6330 1 17 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.063 -0.317 25149
6331 1 17 . 1 1 36 36 GLN C C 36 176.445 176.445 176.302 0.143 25149
6332 1 17 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.439 -0.010 25149
6333 1 17 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.549 -0.918 25149
6334 1 17 . 1 1 36 36 GLN H H 36 8.338 8.338 8.498 -0.160 25149
6335 1 17 . 1 1 37 37 CYS N N 37 115.763 115.763 113.787 1.976 25149
6336 1 17 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.933 -0.649 25149
6337 1 17 . 1 1 37 37 CYS C C 37 175.281 175.281 175.929 -0.648 25149
6338 1 17 . 1 1 37 37 CYS CA C 37 58.395 58.395 55.803 2.592 25149
6339 1 17 . 1 1 37 37 CYS CB C 37 31.143 31.143 31.338 -0.195 25149
6340 1 17 . 1 1 37 37 CYS H H 37 7.622 7.622 7.841 -0.219 25149
6341 1 17 . 1 1 38 38 SER N N 38 114.540 114.540 116.227 -1.687 25149
6342 1 17 . 1 1 38 38 SER HA H 38 4.004 4.004 4.189 -0.185 25149
6343 1 17 . 1 1 38 38 SER C C 38 173.389 173.389 174.283 -0.894 25149
6344 1 17 . 1 1 38 38 SER CA C 38 62.285 62.285 60.711 1.574 25149
6345 1 17 . 1 1 38 38 SER H H 38 7.716 7.716 8.475 -0.759 25149
6346 1 17 . 1 1 39 39 HIS N N 39 121.947 121.947 120.076 1.871 25149
6347 1 17 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.333 0.111 25149
6348 1 17 . 1 1 39 39 HIS C C 39 172.326 172.326 173.615 -1.289 25149
6349 1 17 . 1 1 39 39 HIS CA C 39 61.320 61.320 57.149 4.171 25149
6350 1 17 . 1 1 39 39 HIS CB C 39 31.523 31.523 29.221 2.302 25149
6351 1 17 . 1 1 39 39 HIS H H 39 7.829 7.829 8.190 -0.361 25149
6352 1 17 . 1 1 40 40 CYS N N 40 121.859 121.859 123.775 -1.916 25149
6353 1 17 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.331 0.278 25149
6354 1 17 . 1 1 40 40 CYS C C 40 171.900 171.900 172.419 -0.519 25149
6355 1 17 . 1 1 40 40 CYS CA C 40 55.791 55.791 55.907 -0.116 25149
6356 1 17 . 1 1 40 40 CYS CB C 40 28.964 28.964 27.828 1.136 25149
6357 1 17 . 1 1 40 40 CYS H H 40 8.049 8.049 8.546 -0.497 25149
6358 1 17 . 1 1 41 41 PHE N N 41 120.690 120.690 121.899 -1.209 25149
6359 1 17 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.544 0.633 25149
6360 1 17 . 1 1 41 41 PHE C C 41 176.613 176.613 174.663 1.950 25149
6361 1 17 . 1 1 41 41 PHE CA C 41 56.033 56.033 56.135 -0.101 25149
6362 1 17 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.619 2.141 25149
6363 1 17 . 1 1 41 41 PHE H H 41 8.368 8.368 8.444 -0.075 25149
6364 1 17 . 1 1 42 42 HIS N N 42 117.057 117.057 122.315 -5.258 25149
6365 1 17 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.382 0.287 25149
6366 1 17 . 1 1 42 42 HIS C C 42 177.464 177.464 176.355 1.109 25149
6367 1 17 . 1 1 42 42 HIS CA C 42 60.425 60.425 57.484 2.941 25149
6368 1 17 . 1 1 42 42 HIS CB C 42 29.740 29.740 29.167 0.573 25149
6369 1 17 . 1 1 42 42 HIS H H 42 8.384 8.384 8.540 -0.156 25149
6370 1 17 . 1 1 43 43 MET N N 43 128.543 128.543 126.214 2.329 25149
6371 1 17 . 1 1 43 43 MET HA H 43 3.965 3.965 4.029 -0.064 25149
6372 1 17 . 1 1 43 43 MET C C 43 177.845 177.845 177.226 0.619 25149
6373 1 17 . 1 1 43 43 MET CA C 43 59.209 59.209 60.626 -1.417 25149
6374 1 17 . 1 1 43 43 MET CB C 43 33.009 33.009 32.652 0.357 25149
6375 1 17 . 1 1 43 43 MET H H 43 9.439 9.439 8.052 1.387 25149
6376 1 17 . 1 1 44 44 HIS N N 44 116.500 116.500 117.630 -1.130 25149
6377 1 17 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.257 -0.001 25149
6378 1 17 . 1 1 44 44 HIS C C 44 178.405 178.405 177.626 0.779 25149
6379 1 17 . 1 1 44 44 HIS CA C 44 58.793 58.793 59.234 -0.441 25149
6380 1 17 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.175 3.572 25149
6381 1 17 . 1 1 44 44 HIS H H 44 9.747 9.747 7.839 1.908 25149
6382 1 17 . 1 1 45 45 CYS N N 45 115.950 115.950 117.645 -1.695 25149
6383 1 17 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.124 -0.124 25149
6384 1 17 . 1 1 45 45 CYS C C 45 177.957 177.957 177.077 0.880 25149
6385 1 17 . 1 1 45 45 CYS CA C 45 62.923 62.923 63.485 -0.562 25149
6386 1 17 . 1 1 45 45 CYS CB C 45 29.102 29.102 26.776 2.326 25149
6387 1 17 . 1 1 45 45 CYS H H 45 6.845 6.845 8.361 -1.516 25149
6388 1 17 . 1 1 46 46 ILE N N 46 119.362 119.362 121.157 -1.795 25149
6389 1 17 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.747 -0.082 25149
6390 1 17 . 1 1 46 46 ILE C C 46 176.613 176.613 177.454 -0.841 25149
6391 1 17 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.525 -4.283 25149
6392 1 17 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.802 -0.483 25149
6393 1 17 . 1 1 46 46 ILE H H 46 7.816 7.816 7.988 -0.172 25149
6394 1 17 . 1 1 47 47 LEU N N 47 122.180 122.180 120.835 1.345 25149
6395 1 17 . 1 1 47 47 LEU HA H 47 3.873 3.873 4.264 -0.391 25149
6396 1 17 . 1 1 47 47 LEU C C 47 179.726 179.726 179.081 0.645 25149
6397 1 17 . 1 1 47 47 LEU CA C 47 58.633 58.633 59.053 -0.420 25149
6398 1 17 . 1 1 47 47 LEU CB C 47 41.123 41.123 42.029 -0.906 25149
6399 1 17 . 1 1 47 47 LEU H H 47 8.266 8.266 8.680 -0.414 25149
6400 1 17 . 1 1 48 48 LYS N N 48 118.251 118.251 118.439 -0.188 25149
6401 1 17 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.258 -0.394 25149
6402 1 17 . 1 1 48 48 LYS C C 48 179.423 179.423 179.048 0.375 25149
6403 1 17 . 1 1 48 48 LYS CA C 48 59.987 59.987 58.050 1.937 25149
6404 1 17 . 1 1 48 48 LYS CB C 48 32.765 32.765 31.753 1.012 25149
6405 1 17 . 1 1 48 48 LYS H H 48 7.147 7.147 8.569 -1.422 25149
6406 1 17 . 1 1 49 49 TRP N N 49 120.745 120.745 121.405 -0.660 25149
6407 1 17 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.334 -0.254 25149
6408 1 17 . 1 1 49 49 TRP C C 49 178.147 178.147 177.426 0.721 25149
6409 1 17 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.603 -0.058 25149
6410 1 17 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.272 0.143 25149
6411 1 17 . 1 1 49 49 TRP H H 49 7.709 7.709 8.057 -0.348 25149
6412 1 17 . 1 1 50 50 LEU N N 50 117.236 117.236 116.182 1.054 25149
6413 1 17 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.779 -0.174 25149
6414 1 17 . 1 1 50 50 LEU C C 50 179.658 179.658 176.968 2.690 25149
6415 1 17 . 1 1 50 50 LEU CA C 50 57.330 57.330 54.565 2.765 25149
6416 1 17 . 1 1 50 50 LEU CB C 50 41.416 41.416 42.493 -1.077 25149
6417 1 17 . 1 1 50 50 LEU H H 50 8.512 8.512 7.793 0.719 25149
6418 1 17 . 1 1 51 51 HIS N N 51 115.650 115.650 118.438 -2.788 25149
6419 1 17 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.597 -0.323 25149
6420 1 17 . 1 1 51 51 HIS C C 51 175.942 175.942 176.009 -0.067 25149
6421 1 17 . 1 1 51 51 HIS CA C 51 57.320 57.320 56.892 0.428 25149
6422 1 17 . 1 1 51 51 HIS CB C 51 29.487 29.487 30.077 -0.590 25149
6423 1 17 . 1 1 51 51 HIS H H 51 7.713 7.713 8.455 -0.742 25149
6424 1 17 . 1 1 52 52 ALA N N 52 119.779 119.779 121.181 -1.402 25149
6425 1 17 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.306 -0.283 25149
6426 1 17 . 1 1 52 52 ALA C C 52 177.834 177.834 176.323 1.511 25149
6427 1 17 . 1 1 52 52 ALA CA C 52 52.865 52.865 53.074 -0.209 25149
6428 1 17 . 1 1 52 52 ALA CB C 52 18.951 18.951 19.993 -1.042 25149
6429 1 17 . 1 1 52 52 ALA H H 52 7.191 7.191 7.790 -0.599 25149
6430 1 17 . 1 1 53 53 GLN N N 53 117.047 117.047 116.249 0.798 25149
6431 1 17 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.442 -0.509 25149
6432 1 17 . 1 1 53 53 GLN C C 53 175.998 175.998 175.143 0.855 25149
6433 1 17 . 1 1 53 53 GLN CA C 53 55.482 55.482 54.816 0.666 25149
6434 1 17 . 1 1 53 53 GLN CB C 53 28.887 28.887 30.746 -1.859 25149
6435 1 17 . 1 1 53 53 GLN H H 53 7.317 7.317 7.306 0.011 25149
6436 1 17 . 1 1 54 54 GLN N N 54 118.463 118.463 121.115 -2.652 25149
6437 1 17 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.230 -0.241 25149
6438 1 17 . 1 1 54 54 GLN C C 54 176.300 176.300 176.659 -0.359 25149
6439 1 17 . 1 1 54 54 GLN CA C 54 57.314 57.314 56.694 0.620 25149
6440 1 17 . 1 1 54 54 GLN CB C 54 28.823 28.823 28.873 -0.050 25149
6441 1 17 . 1 1 54 54 GLN H H 54 7.949 7.949 8.611 -0.662 25149
6442 1 17 . 1 1 55 55 VAL N N 55 116.755 116.755 116.314 0.441 25149
6443 1 17 . 1 1 55 55 VAL HA H 55 3.884 3.884 3.770 0.114 25149
6444 1 17 . 1 1 55 55 VAL C C 55 175.774 175.774 176.095 -0.321 25149
6445 1 17 . 1 1 55 55 VAL CA C 55 63.210 63.210 63.583 -0.373 25149
6446 1 17 . 1 1 55 55 VAL CB C 55 32.870 32.870 31.415 1.455 25149
6447 1 17 . 1 1 55 55 VAL H H 55 7.801 7.801 7.689 0.112 25149
6448 1 17 . 1 1 56 56 GLN N N 56 120.192 120.192 118.001 2.191 25149
6449 1 17 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.651 -0.534 25149
6450 1 17 . 1 1 56 56 GLN C C 56 175.236 175.236 174.957 0.279 25149
6451 1 17 . 1 1 56 56 GLN CA C 56 55.697 55.697 55.322 0.375 25149
6452 1 17 . 1 1 56 56 GLN CB C 56 29.319 29.319 30.371 -1.052 25149
6453 1 17 . 1 1 56 56 GLN H H 56 8.018 8.018 7.864 0.154 25149
6454 1 17 . 1 1 57 57 GLN N N 57 121.276 121.276 121.479 -0.203 25149
6455 1 17 . 1 1 57 57 GLN HA H 57 4.204 4.204 4.240 -0.036 25149
6456 1 17 . 1 1 57 57 GLN C C 57 175.819 175.819 175.550 0.269 25149
6457 1 17 . 1 1 57 57 GLN CA C 57 55.617 55.617 55.597 0.020 25149
6458 1 17 . 1 1 57 57 GLN CB C 57 29.094 29.094 29.296 -0.202 25149
6459 1 17 . 1 1 57 57 GLN H H 57 8.471 8.471 8.640 -0.169 25149
6460 1 17 . 1 1 58 58 HIS N N 58 120.001 120.001 119.914 0.087 25149
6461 1 17 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.335 0.839 25149
6462 1 17 . 1 1 58 58 HIS C C 58 173.636 173.636 176.028 -2.392 25149
6463 1 17 . 1 1 58 58 HIS CA C 58 54.353 54.353 57.639 -3.286 25149
6464 1 17 . 1 1 58 58 HIS CB C 58 33.057 33.057 29.337 3.720 25149
6465 1 17 . 1 1 58 58 HIS H H 58 8.366 8.366 7.814 0.552 25149
6466 1 17 . 1 1 59 59 CYS N N 59 121.924 121.924 122.305 -0.381 25149
6467 1 17 . 1 1 59 59 CYS HA H 59 4.442 4.442 4.068 0.374 25149
6468 1 17 . 1 1 59 59 CYS C C 59 176.334 176.334 174.944 1.390 25149
6469 1 17 . 1 1 59 59 CYS CA C 59 56.772 56.772 61.667 -4.895 25149
6470 1 17 . 1 1 59 59 CYS CB C 59 32.642 32.642 28.501 4.141 25149
6471 1 17 . 1 1 59 59 CYS H H 59 9.035 9.035 8.298 0.737 25149
6472 1 17 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.334 -0.521 25149
6473 1 17 . 1 1 60 60 PRO CA C 60 64.661 64.661 65.061 -0.400 25149
6474 1 17 . 1 1 60 60 PRO CB C 60 30.659 30.659 31.201 -0.542 25149
6475 1 17 . 1 1 61 61 MET N N 61 117.676 117.676 115.554 2.122 25149
6476 1 17 . 1 1 61 61 MET HA H 61 4.317 4.317 4.418 -0.101 25149
6477 1 17 . 1 1 61 61 MET C C 61 177.117 177.117 176.088 1.029 25149
6478 1 17 . 1 1 61 61 MET CA C 61 56.408 56.408 55.993 0.415 25149
6479 1 17 . 1 1 61 61 MET CB C 61 32.551 32.551 32.557 -0.006 25149
6480 1 17 . 1 1 61 61 MET H H 61 9.135 9.135 7.446 1.689 25149
6481 1 17 . 1 1 62 62 CYS N N 62 117.214 117.214 120.677 -3.463 25149
6482 1 17 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.385 0.489 25149
6483 1 17 . 1 1 62 62 CYS C C 62 175.740 175.740 175.263 0.477 25149
6484 1 17 . 1 1 62 62 CYS CA C 62 58.273 58.273 58.992 -0.719 25149
6485 1 17 . 1 1 62 62 CYS CB C 62 32.776 32.776 28.213 4.563 25149
6486 1 17 . 1 1 62 62 CYS H H 62 8.011 8.011 7.900 0.111 25149
6487 1 17 . 1 1 63 63 ARG N N 63 116.555 116.555 119.963 -3.408 25149
6488 1 17 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.427 -0.502 25149
6489 1 17 . 1 1 63 63 ARG C C 63 175.326 175.326 175.183 0.143 25149
6490 1 17 . 1 1 63 63 ARG CA C 63 58.073 58.073 55.685 2.388 25149
6491 1 17 . 1 1 63 63 ARG CB C 63 27.136 27.136 30.070 -2.934 25149
6492 1 17 . 1 1 63 63 ARG H H 63 8.086 8.086 8.364 -0.278 25149
6493 1 17 . 1 1 64 64 GLN N N 64 118.932 118.932 117.602 1.330 25149
6494 1 17 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.658 -0.399 25149
6495 1 17 . 1 1 64 64 GLN C C 64 176.054 176.054 175.253 0.801 25149
6496 1 17 . 1 1 64 64 GLN CA C 64 56.316 56.316 54.467 1.849 25149
6497 1 17 . 1 1 64 64 GLN CB C 64 30.083 30.083 31.677 -1.594 25149
6498 1 17 . 1 1 64 64 GLN H H 64 8.003 8.003 7.877 0.126 25149
6499 1 17 . 1 1 65 65 GLU N N 65 122.038 122.038 122.568 -0.530 25149
6500 1 17 . 1 1 65 65 GLU HA H 65 4.003 4.003 4.209 -0.206 25149
6501 1 17 . 1 1 65 65 GLU C C 65 176.781 176.781 176.522 0.259 25149
6502 1 17 . 1 1 65 65 GLU CA C 65 57.682 57.682 56.701 0.981 25149
6503 1 17 . 1 1 65 65 GLU CB C 65 29.900 29.900 29.424 0.476 25149
6504 1 17 . 1 1 65 65 GLU H H 65 8.657 8.657 8.776 -0.119 25149
6505 1 17 . 1 1 66 66 TRP N N 66 125.730 125.730 127.948 -2.218 25149
6506 1 17 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.227 0.177 25149
6507 1 17 . 1 1 66 66 TRP C C 66 175.460 175.460 175.133 0.327 25149
6508 1 17 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.660 -0.035 25149
6509 1 17 . 1 1 66 66 TRP CB C 66 29.358 29.358 29.900 -0.542 25149
6510 1 17 . 1 1 66 66 TRP H H 66 8.499 8.499 8.276 0.223 25149
6511 1 17 . 1 1 67 67 LYS N N 67 127.396 127.396 127.008 0.388 25149
6512 1 17 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.021 -0.003 25149
6513 1 17 . 1 1 67 67 LYS C C 67 175.180 175.180 175.468 -0.288 25149
6514 1 17 . 1 1 67 67 LYS CA C 67 54.514 54.514 53.670 0.844 25149
6515 1 17 . 1 1 67 67 LYS CB C 67 36.231 36.231 34.454 1.777 25149
6516 1 17 . 1 1 67 67 LYS H H 67 6.930 6.930 8.664 -1.734 25149
6517 1 17 . 1 1 68 68 PHE N N 68 121.511 121.511 123.982 -2.471 25149
6518 1 17 . 1 1 68 68 PHE HA H 68 4.108 4.108 3.950 0.158 25149
6519 1 17 . 1 1 68 68 PHE C C 68 176.613 176.613 175.677 0.936 25149
6520 1 17 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.255 2.706 25149
6521 1 17 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.951 1.311 25149
6522 1 17 . 1 1 68 68 PHE H H 68 8.430 8.430 8.442 -0.012 25149
6523 1 17 . 1 1 69 69 LYS N N 69 124.210 124.210 122.734 1.476 25149
6524 1 17 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.012 -0.017 25149
6525 1 17 . 1 1 69 69 LYS C C 69 175.651 175.651 176.590 -0.939 25149
6526 1 17 . 1 1 69 69 LYS CA C 69 57.320 57.320 57.816 -0.496 25149
6527 1 17 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.031 0.330 25149
6528 1 17 . 1 1 69 69 LYS H H 69 8.738 8.738 8.053 0.685 25149
6529 1 18 . 1 1 2 2 SER HA H 2 4.417 4.417 4.637 -0.220 25149
6530 1 18 . 1 1 2 2 SER CA C 2 58.322 58.322 57.925 0.397 25149
6531 1 18 . 1 1 2 2 SER CB C 2 64.169 64.169 63.466 0.703 25149
6532 1 18 . 1 1 3 3 VAL N N 3 121.214 121.214 123.406 -2.192 25149
6533 1 18 . 1 1 3 3 VAL HA H 3 4.046 4.046 3.984 0.062 25149
6534 1 18 . 1 1 3 3 VAL C C 3 175.879 175.879 175.270 0.609 25149
6535 1 18 . 1 1 3 3 VAL CA C 3 62.138 62.138 62.037 0.101 25149
6536 1 18 . 1 1 3 3 VAL CB C 3 32.958 32.958 31.453 1.505 25149
6537 1 18 . 1 1 3 3 VAL H H 3 8.170 8.170 7.692 0.478 25149
6538 1 18 . 1 1 4 4 ALA N N 4 127.312 127.312 131.648 -4.336 25149
6539 1 18 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.424 -0.227 25149
6540 1 18 . 1 1 4 4 ALA C C 4 177.497 177.497 176.846 0.651 25149
6541 1 18 . 1 1 4 4 ALA CA C 4 52.439 52.439 52.138 0.301 25149
6542 1 18 . 1 1 4 4 ALA CB C 4 19.424 19.424 19.365 0.059 25149
6543 1 18 . 1 1 4 4 ALA H H 4 8.294 8.294 8.405 -0.111 25149
6544 1 18 . 1 1 5 5 ASN N N 5 117.674 117.674 122.607 -4.933 25149
6545 1 18 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.805 -0.240 25149
6546 1 18 . 1 1 5 5 ASN C C 5 175.048 175.048 173.990 1.058 25149
6547 1 18 . 1 1 5 5 ASN CA C 5 53.725 53.725 53.317 0.408 25149
6548 1 18 . 1 1 5 5 ASN CB C 5 39.197 39.197 39.925 -0.728 25149
6549 1 18 . 1 1 5 5 ASN H H 5 8.252 8.252 8.701 -0.449 25149
6550 1 18 . 1 1 6 6 ASP N N 6 119.896 119.896 121.721 -1.825 25149
6551 1 18 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.705 -0.185 25149
6552 1 18 . 1 1 6 6 ASP C C 6 176.269 176.269 175.722 0.547 25149
6553 1 18 . 1 1 6 6 ASP CA C 6 54.497 54.497 52.989 1.508 25149
6554 1 18 . 1 1 6 6 ASP CB C 6 41.104 41.104 41.224 -0.120 25149
6555 1 18 . 1 1 6 6 ASP H H 6 8.215 8.215 8.714 -0.499 25149
6556 1 18 . 1 1 7 7 GLU N N 7 119.101 119.101 117.921 1.180 25149
6557 1 18 . 1 1 7 7 GLU HA H 7 4.243 4.243 4.519 -0.276 25149
6558 1 18 . 1 1 7 7 GLU C C 7 175.006 175.006 175.114 -0.108 25149
6559 1 18 . 1 1 7 7 GLU CA C 7 56.689 56.689 55.283 1.406 25149
6560 1 18 . 1 1 7 7 GLU CB C 7 30.379 30.379 27.910 2.469 25149
6561 1 18 . 1 1 7 7 GLU H H 7 8.065 8.065 8.285 -0.220 25149
6562 1 18 . 1 1 8 8 ASN N N 8 116.852 116.852 114.634 2.218 25149
6563 1 18 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.252 -0.094 25149
6564 1 18 . 1 1 8 8 ASN C C 8 172.706 172.706 174.385 -1.679 25149
6565 1 18 . 1 1 8 8 ASN CA C 8 51.165 51.165 51.130 0.035 25149
6566 1 18 . 1 1 8 8 ASN CB C 8 40.702 40.702 40.565 0.137 25149
6567 1 18 . 1 1 8 8 ASN H H 8 7.505 7.505 7.278 0.227 25149
6568 1 18 . 1 1 9 9 CYS N N 9 122.855 122.855 120.100 2.755 25149
6569 1 18 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.715 0.079 25149
6570 1 18 . 1 1 9 9 CYS C C 9 178.370 178.370 176.424 1.946 25149
6571 1 18 . 1 1 9 9 CYS CA C 9 59.552 59.552 60.841 -1.289 25149
6572 1 18 . 1 1 9 9 CYS CB C 9 31.526 31.526 29.084 2.442 25149
6573 1 18 . 1 1 9 9 CYS H H 9 7.614 7.614 7.597 0.017 25149
6574 1 18 . 1 1 10 10 GLY N N 10 117.295 117.295 111.312 5.983 25149
6575 1 18 . 1 1 10 10 GLY C C 10 174.111 174.111 174.634 -0.523 25149
6576 1 18 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.711 1.256 25149
6577 1 18 . 1 1 10 10 GLY H H 10 9.235 9.235 7.832 1.403 25149
6578 1 18 . 1 1 11 11 ILE N N 11 119.811 119.811 120.887 -1.076 25149
6579 1 18 . 1 1 11 11 ILE HA H 11 3.809 3.809 4.050 -0.241 25149
6580 1 18 . 1 1 11 11 ILE C C 11 176.121 176.121 176.574 -0.453 25149
6581 1 18 . 1 1 11 11 ILE CA C 11 64.041 64.041 63.812 0.229 25149
6582 1 18 . 1 1 11 11 ILE CB C 11 39.411 39.411 38.955 0.456 25149
6583 1 18 . 1 1 11 11 ILE H H 11 8.285 8.285 7.547 0.738 25149
6584 1 18 . 1 1 12 12 CYS N N 12 116.728 116.728 116.323 0.405 25149
6585 1 18 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.760 -0.184 25149
6586 1 18 . 1 1 12 12 CYS C C 12 175.975 175.975 174.007 1.968 25149
6587 1 18 . 1 1 12 12 CYS CA C 12 59.225 59.225 57.100 2.125 25149
6588 1 18 . 1 1 12 12 CYS CB C 12 32.246 32.246 30.381 1.865 25149
6589 1 18 . 1 1 12 12 CYS H H 12 7.607 7.607 7.617 -0.010 25149
6590 1 18 . 1 1 13 13 ARG N N 13 116.073 116.073 116.356 -0.283 25149
6591 1 18 . 1 1 13 13 ARG HA H 13 3.742 3.742 4.007 -0.265 25149
6592 1 18 . 1 1 13 13 ARG C C 13 174.979 174.979 174.797 0.182 25149
6593 1 18 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.502 1.134 25149
6594 1 18 . 1 1 13 13 ARG CB C 13 26.326 26.326 26.873 -0.547 25149
6595 1 18 . 1 1 13 13 ARG H H 13 7.987 7.987 8.298 -0.311 25149
6596 1 18 . 1 1 14 14 MET N N 14 119.313 119.313 119.115 0.198 25149
6597 1 18 . 1 1 14 14 MET HA H 14 4.547 4.547 4.452 0.095 25149
6598 1 18 . 1 1 14 14 MET C C 14 176.143 176.143 175.762 0.381 25149
6599 1 18 . 1 1 14 14 MET CA C 14 54.208 54.208 54.227 -0.019 25149
6600 1 18 . 1 1 14 14 MET CB C 14 33.951 33.951 33.909 0.042 25149
6601 1 18 . 1 1 14 14 MET H H 14 8.624 8.624 7.532 1.092 25149
6602 1 18 . 1 1 15 15 ALA N N 15 122.683 122.683 129.173 -6.490 25149
6603 1 18 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.092 0.180 25149
6604 1 18 . 1 1 15 15 ALA C C 15 180.117 180.117 178.245 1.872 25149
6605 1 18 . 1 1 15 15 ALA CA C 15 52.346 52.346 51.938 0.409 25149
6606 1 18 . 1 1 15 15 ALA CB C 15 19.487 19.487 19.171 0.316 25149
6607 1 18 . 1 1 15 15 ALA H H 15 7.965 7.965 8.299 -0.334 25149
6608 1 18 . 1 1 16 16 PHE N N 16 119.313 119.313 121.113 -1.800 25149
6609 1 18 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.098 -0.057 25149
6610 1 18 . 1 1 16 16 PHE C C 16 176.423 176.423 176.568 -0.145 25149
6611 1 18 . 1 1 16 16 PHE CA C 16 59.130 59.130 59.614 -0.484 25149
6612 1 18 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.486 -0.096 25149
6613 1 18 . 1 1 16 16 PHE H H 16 8.095 8.095 8.154 -0.059 25149
6614 1 18 . 1 1 17 17 ASN N N 17 112.313 112.313 116.557 -4.244 25149
6615 1 18 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.865 -0.229 25149
6616 1 18 . 1 1 17 17 ASN C C 17 175.337 175.337 174.901 0.436 25149
6617 1 18 . 1 1 17 17 ASN CA C 17 52.961 52.961 53.439 -0.478 25149
6618 1 18 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.617 -1.443 25149
6619 1 18 . 1 1 17 17 ASN H H 17 7.823 7.823 8.033 -0.210 25149
6620 1 18 . 1 1 18 18 GLY N N 18 107.742 107.742 107.239 0.503 25149
6621 1 18 . 1 1 18 18 GLY C C 18 173.759 173.759 173.284 0.475 25149
6622 1 18 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.781 -0.317 25149
6623 1 18 . 1 1 18 18 GLY H H 18 7.579 7.579 7.932 -0.353 25149
6624 1 18 . 1 1 19 19 CYS N N 19 117.050 117.050 118.471 -1.421 25149
6625 1 18 . 1 1 19 19 CYS HA H 19 4.571 4.571 4.688 -0.117 25149
6626 1 18 . 1 1 19 19 CYS C C 19 174.039 174.039 174.808 -0.769 25149
6627 1 18 . 1 1 19 19 CYS CA C 19 58.433 58.433 58.527 -0.094 25149
6628 1 18 . 1 1 19 19 CYS CB C 19 30.681 30.681 30.496 0.185 25149
6629 1 18 . 1 1 19 19 CYS H H 19 8.198 8.198 8.278 -0.080 25149
6630 1 18 . 1 1 20 20 CYS N N 20 123.923 123.923 121.005 2.918 25149
6631 1 18 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.422 -0.411 25149
6632 1 18 . 1 1 20 20 CYS C C 20 173.736 173.736 174.219 -0.483 25149
6633 1 18 . 1 1 20 20 CYS CA C 20 57.999 57.999 57.845 0.154 25149
6634 1 18 . 1 1 20 20 CYS CB C 20 28.205 28.205 27.781 0.424 25149
6635 1 18 . 1 1 20 20 CYS H H 20 8.466 8.466 8.609 -0.143 25149
6636 1 18 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.343 -0.314 25149
6637 1 18 . 1 1 21 21 PRO CA C 21 65.426 65.426 64.340 1.086 25149
6638 1 18 . 1 1 21 21 PRO CB C 21 32.801 32.801 32.070 0.731 25149
6639 1 18 . 1 1 22 22 ASP N N 22 117.053 117.053 119.258 -2.205 25149
6640 1 18 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.386 0.119 25149
6641 1 18 . 1 1 22 22 ASP C C 22 176.501 176.501 176.469 0.032 25149
6642 1 18 . 1 1 22 22 ASP CA C 22 55.017 55.017 55.677 -0.660 25149
6643 1 18 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.709 1.813 25149
6644 1 18 . 1 1 22 22 ASP H H 22 8.395 8.395 8.339 0.056 25149
6645 1 18 . 1 1 23 23 CYS N N 23 123.353 123.353 118.400 4.953 25149
6646 1 18 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.290 0.003 25149
6647 1 18 . 1 1 23 23 CYS C C 23 175.214 175.214 174.561 0.653 25149
6648 1 18 . 1 1 23 23 CYS CA C 23 61.633 61.633 60.031 1.602 25149
6649 1 18 . 1 1 23 23 CYS CB C 23 31.542 31.542 27.923 3.619 25149
6650 1 18 . 1 1 23 23 CYS H H 23 7.246 7.246 8.100 -0.854 25149
6651 1 18 . 1 1 24 24 LYS N N 24 117.539 117.539 127.712 -10.173 25149
6652 1 18 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.347 -0.117 25149
6653 1 18 . 1 1 24 24 LYS C C 24 177.106 177.106 176.035 1.071 25149
6654 1 18 . 1 1 24 24 LYS CA C 24 56.921 56.921 55.428 1.493 25149
6655 1 18 . 1 1 24 24 LYS CB C 24 34.615 34.615 32.378 2.237 25149
6656 1 18 . 1 1 24 24 LYS H H 24 8.173 8.173 8.310 -0.137 25149
6657 1 18 . 1 1 25 25 VAL N N 25 120.661 120.661 117.510 3.151 25149
6658 1 18 . 1 1 25 25 VAL HA H 25 4.429 4.429 3.973 0.456 25149
6659 1 18 . 1 1 25 25 VAL C C 25 174.027 174.027 175.365 -1.338 25149
6660 1 18 . 1 1 25 25 VAL CA C 25 59.934 59.934 62.502 -2.568 25149
6661 1 18 . 1 1 25 25 VAL CB C 25 33.507 33.507 31.010 2.497 25149
6662 1 18 . 1 1 25 25 VAL H H 25 7.787 7.787 7.548 0.239 25149
6663 1 18 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.413 -0.077 25149
6664 1 18 . 1 1 26 26 PRO CA C 26 63.279 63.279 63.439 -0.160 25149
6665 1 18 . 1 1 26 26 PRO CB C 26 32.077 32.077 32.231 -0.154 25149
6666 1 18 . 1 1 27 27 GLY N N 27 109.926 109.926 107.012 2.914 25149
6667 1 18 . 1 1 27 27 GLY C C 27 175.169 175.169 173.262 1.907 25149
6668 1 18 . 1 1 27 27 GLY CA C 27 45.042 45.042 44.979 0.063 25149
6669 1 18 . 1 1 27 27 GLY H H 27 8.569 8.569 7.676 0.893 25149
6670 1 18 . 1 1 28 28 ASP N N 28 122.592 122.592 118.563 4.029 25149
6671 1 18 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.743 -0.512 25149
6672 1 18 . 1 1 28 28 ASP C C 28 176.602 176.602 175.301 1.301 25149
6673 1 18 . 1 1 28 28 ASP CA C 28 56.402 56.402 54.037 2.365 25149
6674 1 18 . 1 1 28 28 ASP CB C 28 40.912 40.912 41.956 -1.044 25149
6675 1 18 . 1 1 28 28 ASP H H 28 8.214 8.214 8.370 -0.156 25149
6676 1 18 . 1 1 29 29 ASP N N 29 117.500 117.500 122.329 -4.829 25149
6677 1 18 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.599 -0.152 25149
6678 1 18 . 1 1 29 29 ASP C C 29 175.505 175.505 175.708 -0.203 25149
6679 1 18 . 1 1 29 29 ASP CA C 29 55.266 55.266 54.585 0.681 25149
6680 1 18 . 1 1 29 29 ASP CB C 29 41.225 41.225 39.380 1.845 25149
6681 1 18 . 1 1 29 29 ASP H H 29 8.271 8.271 8.484 -0.213 25149
6682 1 18 . 1 1 30 30 CYS N N 30 124.470 124.470 121.781 2.689 25149
6683 1 18 . 1 1 30 30 CYS HA H 30 4.390 4.390 4.840 -0.450 25149
6684 1 18 . 1 1 30 30 CYS C C 30 171.755 171.755 173.036 -1.281 25149
6685 1 18 . 1 1 30 30 CYS CA C 30 57.676 57.676 55.011 2.666 25149
6686 1 18 . 1 1 30 30 CYS CB C 30 29.154 29.154 28.660 0.494 25149
6687 1 18 . 1 1 30 30 CYS H H 30 7.912 7.912 8.138 -0.226 25149
6688 1 18 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.608 0.079 25149
6689 1 18 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.763 0.112 25149
6690 1 18 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.508 1.476 25149
6691 1 18 . 1 1 32 32 LEU N N 32 120.023 120.023 117.975 2.048 25149
6692 1 18 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.453 0.263 25149
6693 1 18 . 1 1 32 32 LEU C C 32 176.300 176.300 175.262 1.038 25149
6694 1 18 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.955 -0.033 25149
6695 1 18 . 1 1 32 32 LEU CB C 32 43.336 43.336 43.191 0.145 25149
6696 1 18 . 1 1 32 32 LEU H H 32 8.580 8.580 8.030 0.550 25149
6697 1 18 . 1 1 33 33 VAL N N 33 116.217 116.217 118.372 -2.155 25149
6698 1 18 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.498 0.165 25149
6699 1 18 . 1 1 33 33 VAL C C 33 171.374 171.374 174.163 -2.789 25149
6700 1 18 . 1 1 33 33 VAL CA C 33 60.449 60.449 60.192 0.257 25149
6701 1 18 . 1 1 33 33 VAL CB C 33 36.448 36.448 34.958 1.490 25149
6702 1 18 . 1 1 33 33 VAL H H 33 8.594 8.594 8.004 0.590 25149
6703 1 18 . 1 1 34 34 TRP N N 34 122.711 122.711 125.664 -2.953 25149
6704 1 18 . 1 1 34 34 TRP HA H 34 5.339 5.339 5.294 0.045 25149
6705 1 18 . 1 1 34 34 TRP C C 34 176.770 176.770 175.804 0.966 25149
6706 1 18 . 1 1 34 34 TRP CA C 34 57.267 57.267 56.060 1.207 25149
6707 1 18 . 1 1 34 34 TRP CB C 34 33.780 33.780 33.642 0.138 25149
6708 1 18 . 1 1 34 34 TRP H H 34 8.756 8.756 8.780 -0.024 25149
6709 1 18 . 1 1 35 35 GLY N N 35 107.569 107.569 107.437 0.132 25149
6710 1 18 . 1 1 35 35 GLY C C 35 177.397 177.397 173.921 3.476 25149
6711 1 18 . 1 1 35 35 GLY CA C 35 44.070 44.070 44.101 -0.031 25149
6712 1 18 . 1 1 35 35 GLY H H 35 8.857 8.857 8.487 0.370 25149
6713 1 18 . 1 1 36 36 GLN N N 36 122.723 122.723 118.144 4.579 25149
6714 1 18 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.043 -0.297 25149
6715 1 18 . 1 1 36 36 GLN C C 36 176.445 176.445 175.876 0.569 25149
6716 1 18 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.065 0.364 25149
6717 1 18 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.330 -0.699 25149
6718 1 18 . 1 1 36 36 GLN H H 36 8.338 8.338 8.508 -0.170 25149
6719 1 18 . 1 1 37 37 CYS N N 37 115.763 115.763 114.063 1.700 25149
6720 1 18 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.960 -0.676 25149
6721 1 18 . 1 1 37 37 CYS C C 37 175.281 175.281 175.897 -0.616 25149
6722 1 18 . 1 1 37 37 CYS CA C 37 58.395 58.395 55.602 2.793 25149
6723 1 18 . 1 1 37 37 CYS CB C 37 31.143 31.143 31.430 -0.287 25149
6724 1 18 . 1 1 37 37 CYS H H 37 7.622 7.622 7.404 0.218 25149
6725 1 18 . 1 1 38 38 SER N N 38 114.540 114.540 114.139 0.401 25149
6726 1 18 . 1 1 38 38 SER HA H 38 4.004 4.004 4.241 -0.237 25149
6727 1 18 . 1 1 38 38 SER C C 38 173.389 173.389 174.195 -0.806 25149
6728 1 18 . 1 1 38 38 SER CA C 38 62.285 62.285 59.986 2.299 25149
6729 1 18 . 1 1 38 38 SER H H 38 7.716 7.716 8.442 -0.726 25149
6730 1 18 . 1 1 39 39 HIS N N 39 121.947 121.947 121.876 0.071 25149
6731 1 18 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.371 0.073 25149
6732 1 18 . 1 1 39 39 HIS C C 39 172.326 172.326 174.020 -1.694 25149
6733 1 18 . 1 1 39 39 HIS CA C 39 61.320 61.320 56.879 4.441 25149
6734 1 18 . 1 1 39 39 HIS CB C 39 31.523 31.523 30.096 1.427 25149
6735 1 18 . 1 1 39 39 HIS H H 39 7.829 7.829 7.615 0.214 25149
6736 1 18 . 1 1 40 40 CYS N N 40 121.859 121.859 123.453 -1.594 25149
6737 1 18 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.501 0.108 25149
6738 1 18 . 1 1 40 40 CYS C C 40 171.900 171.900 172.423 -0.523 25149
6739 1 18 . 1 1 40 40 CYS CA C 40 55.791 55.791 55.524 0.267 25149
6740 1 18 . 1 1 40 40 CYS CB C 40 28.964 28.964 28.038 0.926 25149
6741 1 18 . 1 1 40 40 CYS H H 40 8.049 8.049 8.403 -0.354 25149
6742 1 18 . 1 1 41 41 PHE N N 41 120.690 120.690 120.848 -0.158 25149
6743 1 18 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.703 0.474 25149
6744 1 18 . 1 1 41 41 PHE C C 41 176.613 176.613 174.832 1.781 25149
6745 1 18 . 1 1 41 41 PHE CA C 41 56.033 56.033 56.026 0.007 25149
6746 1 18 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.664 2.096 25149
6747 1 18 . 1 1 41 41 PHE H H 41 8.368 8.368 8.358 0.010 25149
6748 1 18 . 1 1 42 42 HIS N N 42 117.057 117.057 122.384 -5.327 25149
6749 1 18 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.394 0.275 25149
6750 1 18 . 1 1 42 42 HIS C C 42 177.464 177.464 176.117 1.347 25149
6751 1 18 . 1 1 42 42 HIS CA C 42 60.425 60.425 58.079 2.346 25149
6752 1 18 . 1 1 42 42 HIS CB C 42 29.740 29.740 29.746 -0.006 25149
6753 1 18 . 1 1 42 42 HIS H H 42 8.384 8.384 8.970 -0.586 25149
6754 1 18 . 1 1 43 43 MET N N 43 128.543 128.543 126.055 2.488 25149
6755 1 18 . 1 1 43 43 MET HA H 43 3.965 3.965 4.065 -0.100 25149
6756 1 18 . 1 1 43 43 MET C C 43 177.845 177.845 177.412 0.433 25149
6757 1 18 . 1 1 43 43 MET CA C 43 59.209 59.209 60.593 -1.384 25149
6758 1 18 . 1 1 43 43 MET CB C 43 33.009 33.009 32.702 0.307 25149
6759 1 18 . 1 1 43 43 MET H H 43 9.439 9.439 8.044 1.395 25149
6760 1 18 . 1 1 44 44 HIS N N 44 116.500 116.500 117.270 -0.770 25149
6761 1 18 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.180 0.076 25149
6762 1 18 . 1 1 44 44 HIS C C 44 178.405 178.405 177.680 0.725 25149
6763 1 18 . 1 1 44 44 HIS CA C 44 58.793 58.793 58.962 -0.170 25149
6764 1 18 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.201 3.546 25149
6765 1 18 . 1 1 44 44 HIS H H 44 9.747 9.747 8.054 1.693 25149
6766 1 18 . 1 1 45 45 CYS N N 45 115.950 115.950 117.247 -1.297 25149
6767 1 18 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.088 -0.088 25149
6768 1 18 . 1 1 45 45 CYS C C 45 177.957 177.957 176.924 1.033 25149
6769 1 18 . 1 1 45 45 CYS CA C 45 62.923 62.923 64.085 -1.162 25149
6770 1 18 . 1 1 45 45 CYS CB C 45 29.102 29.102 27.305 1.797 25149
6771 1 18 . 1 1 45 45 CYS H H 45 6.845 6.845 8.129 -1.284 25149
6772 1 18 . 1 1 46 46 ILE N N 46 119.362 119.362 120.760 -1.398 25149
6773 1 18 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.714 -0.049 25149
6774 1 18 . 1 1 46 46 ILE C C 46 176.613 176.613 177.447 -0.834 25149
6775 1 18 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.561 -4.319 25149
6776 1 18 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.774 -0.455 25149
6777 1 18 . 1 1 46 46 ILE H H 46 7.816 7.816 7.935 -0.119 25149
6778 1 18 . 1 1 47 47 LEU N N 47 122.180 122.180 121.287 0.893 25149
6779 1 18 . 1 1 47 47 LEU HA H 47 3.873 3.873 4.362 -0.489 25149
6780 1 18 . 1 1 47 47 LEU C C 47 179.726 179.726 179.048 0.678 25149
6781 1 18 . 1 1 47 47 LEU CA C 47 58.633 58.633 59.264 -0.631 25149
6782 1 18 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.985 -0.862 25149
6783 1 18 . 1 1 47 47 LEU H H 47 8.266 8.266 8.766 -0.500 25149
6784 1 18 . 1 1 48 48 LYS N N 48 118.251 118.251 118.644 -0.393 25149
6785 1 18 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.171 -0.307 25149
6786 1 18 . 1 1 48 48 LYS C C 48 179.423 179.423 178.736 0.687 25149
6787 1 18 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.653 0.334 25149
6788 1 18 . 1 1 48 48 LYS CB C 48 32.765 32.765 32.054 0.711 25149
6789 1 18 . 1 1 48 48 LYS H H 48 7.147 7.147 8.567 -1.420 25149
6790 1 18 . 1 1 49 49 TRP N N 49 120.745 120.745 120.831 -0.086 25149
6791 1 18 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.330 -0.250 25149
6792 1 18 . 1 1 49 49 TRP C C 49 178.147 178.147 178.156 -0.009 25149
6793 1 18 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.633 -0.088 25149
6794 1 18 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.344 0.071 25149
6795 1 18 . 1 1 49 49 TRP H H 49 7.709 7.709 8.083 -0.374 25149
6796 1 18 . 1 1 50 50 LEU N N 50 117.236 117.236 117.047 0.189 25149
6797 1 18 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.557 0.048 25149
6798 1 18 . 1 1 50 50 LEU C C 50 179.658 179.658 176.744 2.914 25149
6799 1 18 . 1 1 50 50 LEU CA C 50 57.330 57.330 55.157 2.173 25149
6800 1 18 . 1 1 50 50 LEU CB C 50 41.416 41.416 42.259 -0.843 25149
6801 1 18 . 1 1 50 50 LEU H H 50 8.512 8.512 7.697 0.815 25149
6802 1 18 . 1 1 51 51 HIS N N 51 115.650 115.650 117.129 -1.479 25149
6803 1 18 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.536 -0.262 25149
6804 1 18 . 1 1 51 51 HIS C C 51 175.942 175.942 175.991 -0.049 25149
6805 1 18 . 1 1 51 51 HIS CA C 51 57.320 57.320 57.788 -0.468 25149
6806 1 18 . 1 1 51 51 HIS CB C 51 29.487 29.487 30.626 -1.139 25149
6807 1 18 . 1 1 51 51 HIS H H 51 7.713 7.713 8.210 -0.497 25149
6808 1 18 . 1 1 52 52 ALA N N 52 119.779 119.779 123.251 -3.472 25149
6809 1 18 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.238 -0.215 25149
6810 1 18 . 1 1 52 52 ALA C C 52 177.834 177.834 177.614 0.220 25149
6811 1 18 . 1 1 52 52 ALA CA C 52 52.865 52.865 53.785 -0.920 25149
6812 1 18 . 1 1 52 52 ALA CB C 52 18.951 18.951 19.512 -0.562 25149
6813 1 18 . 1 1 52 52 ALA H H 52 7.191 7.191 7.981 -0.790 25149
6814 1 18 . 1 1 53 53 GLN N N 53 117.047 117.047 117.922 -0.875 25149
6815 1 18 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.542 -0.609 25149
6816 1 18 . 1 1 53 53 GLN C C 53 175.998 175.998 175.679 0.319 25149
6817 1 18 . 1 1 53 53 GLN CA C 53 55.482 55.482 54.355 1.127 25149
6818 1 18 . 1 1 53 53 GLN CB C 53 28.887 28.887 30.063 -1.176 25149
6819 1 18 . 1 1 53 53 GLN H H 53 7.317 7.317 8.300 -0.983 25149
6820 1 18 . 1 1 54 54 GLN N N 54 118.463 118.463 120.133 -1.670 25149
6821 1 18 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.105 -0.116 25149
6822 1 18 . 1 1 54 54 GLN C C 54 176.300 176.300 176.288 0.012 25149
6823 1 18 . 1 1 54 54 GLN CA C 54 57.314 57.314 55.751 1.563 25149
6824 1 18 . 1 1 54 54 GLN CB C 54 28.823 28.823 28.330 0.493 25149
6825 1 18 . 1 1 54 54 GLN H H 54 7.949 7.949 8.536 -0.587 25149
6826 1 18 . 1 1 55 55 VAL N N 55 116.755 116.755 114.243 2.512 25149
6827 1 18 . 1 1 55 55 VAL HA H 55 3.884 3.884 3.891 -0.007 25149
6828 1 18 . 1 1 55 55 VAL C C 55 175.774 175.774 175.556 0.218 25149
6829 1 18 . 1 1 55 55 VAL CA C 55 63.210 63.210 62.162 1.048 25149
6830 1 18 . 1 1 55 55 VAL CB C 55 32.870 32.870 32.023 0.848 25149
6831 1 18 . 1 1 55 55 VAL H H 55 7.801 7.801 7.344 0.457 25149
6832 1 18 . 1 1 56 56 GLN N N 56 120.192 120.192 120.028 0.164 25149
6833 1 18 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.271 -0.154 25149
6834 1 18 . 1 1 56 56 GLN C C 56 175.236 175.236 176.523 -1.287 25149
6835 1 18 . 1 1 56 56 GLN CA C 56 55.697 55.697 56.587 -0.890 25149
6836 1 18 . 1 1 56 56 GLN CB C 56 29.319 29.319 28.642 0.676 25149
6837 1 18 . 1 1 56 56 GLN H H 56 8.018 8.018 8.422 -0.404 25149
6838 1 18 . 1 1 57 57 GLN N N 57 121.276 121.276 121.085 0.191 25149
6839 1 18 . 1 1 57 57 GLN HA H 57 4.204 4.204 4.002 0.202 25149
6840 1 18 . 1 1 57 57 GLN C C 57 175.819 175.819 175.737 0.082 25149
6841 1 18 . 1 1 57 57 GLN CA C 57 55.617 55.617 56.264 -0.647 25149
6842 1 18 . 1 1 57 57 GLN CB C 57 29.094 29.094 28.364 0.730 25149
6843 1 18 . 1 1 57 57 GLN H H 57 8.471 8.471 8.572 -0.101 25149
6844 1 18 . 1 1 58 58 HIS N N 58 120.001 120.001 118.270 1.731 25149
6845 1 18 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.479 0.695 25149
6846 1 18 . 1 1 58 58 HIS C C 58 173.636 173.636 176.206 -2.570 25149
6847 1 18 . 1 1 58 58 HIS CA C 58 54.353 54.353 57.749 -3.396 25149
6848 1 18 . 1 1 58 58 HIS CB C 58 33.057 33.057 30.248 2.809 25149
6849 1 18 . 1 1 58 58 HIS H H 58 8.366 8.366 7.887 0.479 25149
6850 1 18 . 1 1 59 59 CYS N N 59 121.924 121.924 118.734 3.190 25149
6851 1 18 . 1 1 59 59 CYS HA H 59 4.442 4.442 4.478 -0.036 25149
6852 1 18 . 1 1 59 59 CYS C C 59 176.334 176.334 174.880 1.454 25149
6853 1 18 . 1 1 59 59 CYS CA C 59 56.772 56.772 58.270 -1.498 25149
6854 1 18 . 1 1 59 59 CYS CB C 59 32.642 32.642 27.741 4.902 25149
6855 1 18 . 1 1 59 59 CYS H H 59 9.035 9.035 8.302 0.733 25149
6856 1 18 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.490 -0.677 25149
6857 1 18 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.708 -0.047 25149
6858 1 18 . 1 1 60 60 PRO CB C 60 30.659 30.659 31.138 -0.479 25149
6859 1 18 . 1 1 61 61 MET N N 61 117.676 117.676 116.692 0.984 25149
6860 1 18 . 1 1 61 61 MET HA H 61 4.317 4.317 4.468 -0.151 25149
6861 1 18 . 1 1 61 61 MET C C 61 177.117 177.117 175.564 1.553 25149
6862 1 18 . 1 1 61 61 MET CA C 61 56.408 56.408 56.672 -0.264 25149
6863 1 18 . 1 1 61 61 MET CB C 61 32.551 32.551 33.311 -0.760 25149
6864 1 18 . 1 1 61 61 MET H H 61 9.135 9.135 7.594 1.541 25149
6865 1 18 . 1 1 62 62 CYS N N 62 117.214 117.214 119.546 -2.332 25149
6866 1 18 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.544 0.330 25149
6867 1 18 . 1 1 62 62 CYS C C 62 175.740 175.740 176.029 -0.289 25149
6868 1 18 . 1 1 62 62 CYS CA C 62 58.273 58.273 58.220 0.053 25149
6869 1 18 . 1 1 62 62 CYS CB C 62 32.776 32.776 29.387 3.389 25149
6870 1 18 . 1 1 62 62 CYS H H 62 8.011 8.011 7.768 0.243 25149
6871 1 18 . 1 1 63 63 ARG N N 63 116.555 116.555 119.830 -3.275 25149
6872 1 18 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.171 -0.246 25149
6873 1 18 . 1 1 63 63 ARG C C 63 175.326 175.326 175.835 -0.509 25149
6874 1 18 . 1 1 63 63 ARG CA C 63 58.073 58.073 56.718 1.355 25149
6875 1 18 . 1 1 63 63 ARG CB C 63 27.136 27.136 29.982 -2.846 25149
6876 1 18 . 1 1 63 63 ARG H H 63 8.086 8.086 8.412 -0.326 25149
6877 1 18 . 1 1 64 64 GLN N N 64 118.932 118.932 119.369 -0.437 25149
6878 1 18 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.362 -0.103 25149
6879 1 18 . 1 1 64 64 GLN C C 64 176.054 176.054 175.943 0.111 25149
6880 1 18 . 1 1 64 64 GLN CA C 64 56.316 56.316 55.048 1.268 25149
6881 1 18 . 1 1 64 64 GLN CB C 64 30.083 30.083 28.893 1.190 25149
6882 1 18 . 1 1 64 64 GLN H H 64 8.003 8.003 7.964 0.039 25149
6883 1 18 . 1 1 65 65 GLU N N 65 122.038 122.038 122.692 -0.654 25149
6884 1 18 . 1 1 65 65 GLU HA H 65 4.003 4.003 3.960 0.043 25149
6885 1 18 . 1 1 65 65 GLU C C 65 176.781 176.781 176.599 0.182 25149
6886 1 18 . 1 1 65 65 GLU CA C 65 57.682 57.682 57.023 0.659 25149
6887 1 18 . 1 1 65 65 GLU CB C 65 29.900 29.900 29.782 0.118 25149
6888 1 18 . 1 1 65 65 GLU H H 65 8.657 8.657 8.764 -0.107 25149
6889 1 18 . 1 1 66 66 TRP N N 66 125.730 125.730 127.519 -1.789 25149
6890 1 18 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.312 0.092 25149
6891 1 18 . 1 1 66 66 TRP C C 66 175.460 175.460 175.071 0.389 25149
6892 1 18 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.594 0.030 25149
6893 1 18 . 1 1 66 66 TRP CB C 66 29.358 29.358 30.033 -0.675 25149
6894 1 18 . 1 1 66 66 TRP H H 66 8.499 8.499 8.070 0.429 25149
6895 1 18 . 1 1 67 67 LYS N N 67 127.396 127.396 127.307 0.089 25149
6896 1 18 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.032 -0.014 25149
6897 1 18 . 1 1 67 67 LYS C C 67 175.180 175.180 175.130 0.050 25149
6898 1 18 . 1 1 67 67 LYS CA C 67 54.514 54.514 53.570 0.944 25149
6899 1 18 . 1 1 67 67 LYS CB C 67 36.231 36.231 35.064 1.167 25149
6900 1 18 . 1 1 67 67 LYS H H 67 6.930 6.930 8.480 -1.550 25149
6901 1 18 . 1 1 68 68 PHE N N 68 121.511 121.511 125.402 -3.891 25149
6902 1 18 . 1 1 68 68 PHE HA H 68 4.108 4.108 3.986 0.122 25149
6903 1 18 . 1 1 68 68 PHE C C 68 176.613 176.613 175.368 1.245 25149
6904 1 18 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.829 2.132 25149
6905 1 18 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.474 1.788 25149
6906 1 18 . 1 1 68 68 PHE H H 68 8.430 8.430 8.475 -0.045 25149
6907 1 18 . 1 1 69 69 LYS N N 69 124.210 124.210 121.874 2.336 25149
6908 1 18 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.028 -0.033 25149
6909 1 18 . 1 1 69 69 LYS C C 69 175.651 175.651 176.034 -0.383 25149
6910 1 18 . 1 1 69 69 LYS CA C 69 57.320 57.320 57.516 -0.196 25149
6911 1 18 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.588 -0.227 25149
6912 1 18 . 1 1 69 69 LYS H H 69 8.738 8.738 8.104 0.634 25149
6913 1 19 . 1 1 2 2 SER HA H 2 4.417 4.417 4.740 -0.323 25149
6914 1 19 . 1 1 2 2 SER CA C 2 58.322 58.322 58.564 -0.242 25149
6915 1 19 . 1 1 2 2 SER CB C 2 64.169 64.169 63.243 0.925 25149
6916 1 19 . 1 1 3 3 VAL N N 3 121.214 121.214 125.189 -3.975 25149
6917 1 19 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.212 -0.166 25149
6918 1 19 . 1 1 3 3 VAL C C 3 175.879 175.879 175.285 0.594 25149
6919 1 19 . 1 1 3 3 VAL CA C 3 62.138 62.138 61.860 0.278 25149
6920 1 19 . 1 1 3 3 VAL CB C 3 32.958 32.958 30.496 2.462 25149
6921 1 19 . 1 1 3 3 VAL H H 3 8.170 8.170 8.222 -0.052 25149
6922 1 19 . 1 1 4 4 ALA N N 4 127.312 127.312 129.175 -1.863 25149
6923 1 19 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.354 -0.157 25149
6924 1 19 . 1 1 4 4 ALA C C 4 177.497 177.497 176.783 0.714 25149
6925 1 19 . 1 1 4 4 ALA CA C 4 52.439 52.439 51.936 0.503 25149
6926 1 19 . 1 1 4 4 ALA CB C 4 19.424 19.424 18.273 1.151 25149
6927 1 19 . 1 1 4 4 ALA H H 4 8.294 8.294 8.360 -0.066 25149
6928 1 19 . 1 1 5 5 ASN N N 5 117.674 117.674 123.135 -5.461 25149
6929 1 19 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.752 -0.187 25149
6930 1 19 . 1 1 5 5 ASN C C 5 175.048 175.048 174.766 0.282 25149
6931 1 19 . 1 1 5 5 ASN CA C 5 53.725 53.725 53.170 0.555 25149
6932 1 19 . 1 1 5 5 ASN CB C 5 39.197 39.197 39.087 0.109 25149
6933 1 19 . 1 1 5 5 ASN H H 5 8.252 8.252 8.119 0.133 25149
6934 1 19 . 1 1 6 6 ASP N N 6 119.896 119.896 123.972 -4.076 25149
6935 1 19 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.696 -0.176 25149
6936 1 19 . 1 1 6 6 ASP C C 6 176.269 176.269 175.908 0.361 25149
6937 1 19 . 1 1 6 6 ASP CA C 6 54.497 54.497 53.579 0.918 25149
6938 1 19 . 1 1 6 6 ASP CB C 6 41.104 41.104 41.349 -0.245 25149
6939 1 19 . 1 1 6 6 ASP H H 6 8.215 8.215 8.553 -0.338 25149
6940 1 19 . 1 1 7 7 GLU N N 7 119.101 119.101 116.983 2.118 25149
6941 1 19 . 1 1 7 7 GLU HA H 7 4.243 4.243 4.512 -0.269 25149
6942 1 19 . 1 1 7 7 GLU C C 7 175.006 175.006 175.080 -0.074 25149
6943 1 19 . 1 1 7 7 GLU CA C 7 56.689 56.689 55.864 0.825 25149
6944 1 19 . 1 1 7 7 GLU CB C 7 30.379 30.379 29.217 1.162 25149
6945 1 19 . 1 1 7 7 GLU H H 7 8.065 8.065 8.364 -0.299 25149
6946 1 19 . 1 1 8 8 ASN N N 8 116.852 116.852 115.148 1.704 25149
6947 1 19 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.342 -0.184 25149
6948 1 19 . 1 1 8 8 ASN C C 8 172.706 172.706 174.142 -1.436 25149
6949 1 19 . 1 1 8 8 ASN CA C 8 51.165 51.165 51.830 -0.665 25149
6950 1 19 . 1 1 8 8 ASN CB C 8 40.702 40.702 41.019 -0.317 25149
6951 1 19 . 1 1 8 8 ASN H H 8 7.505 7.505 7.492 0.013 25149
6952 1 19 . 1 1 9 9 CYS N N 9 122.855 122.855 120.032 2.823 25149
6953 1 19 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.701 0.093 25149
6954 1 19 . 1 1 9 9 CYS C C 9 178.370 178.370 176.484 1.886 25149
6955 1 19 . 1 1 9 9 CYS CA C 9 59.552 59.552 60.603 -1.051 25149
6956 1 19 . 1 1 9 9 CYS CB C 9 31.526 31.526 28.855 2.671 25149
6957 1 19 . 1 1 9 9 CYS H H 9 7.614 7.614 7.641 -0.027 25149
6958 1 19 . 1 1 10 10 GLY N N 10 117.295 117.295 109.545 7.750 25149
6959 1 19 . 1 1 10 10 GLY C C 10 174.111 174.111 174.927 -0.816 25149
6960 1 19 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.720 1.247 25149
6961 1 19 . 1 1 10 10 GLY H H 10 9.235 9.235 7.923 1.312 25149
6962 1 19 . 1 1 11 11 ILE N N 11 119.811 119.811 121.131 -1.320 25149
6963 1 19 . 1 1 11 11 ILE HA H 11 3.809 3.809 3.997 -0.188 25149
6964 1 19 . 1 1 11 11 ILE C C 11 176.121 176.121 176.626 -0.505 25149
6965 1 19 . 1 1 11 11 ILE CA C 11 64.041 64.041 64.030 0.011 25149
6966 1 19 . 1 1 11 11 ILE CB C 11 39.411 39.411 38.778 0.633 25149
6967 1 19 . 1 1 11 11 ILE H H 11 8.285 8.285 8.013 0.272 25149
6968 1 19 . 1 1 12 12 CYS N N 12 116.728 116.728 115.509 1.219 25149
6969 1 19 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.746 -0.170 25149
6970 1 19 . 1 1 12 12 CYS C C 12 175.975 175.975 174.002 1.973 25149
6971 1 19 . 1 1 12 12 CYS CA C 12 59.225 59.225 56.857 2.368 25149
6972 1 19 . 1 1 12 12 CYS CB C 12 32.246 32.246 30.450 1.796 25149
6973 1 19 . 1 1 12 12 CYS H H 12 7.607 7.607 7.535 0.072 25149
6974 1 19 . 1 1 13 13 ARG N N 13 116.073 116.073 116.524 -0.451 25149
6975 1 19 . 1 1 13 13 ARG HA H 13 3.742 3.742 3.926 -0.184 25149
6976 1 19 . 1 1 13 13 ARG C C 13 174.979 174.979 174.831 0.148 25149
6977 1 19 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.741 0.895 25149
6978 1 19 . 1 1 13 13 ARG CB C 13 26.326 26.326 26.961 -0.635 25149
6979 1 19 . 1 1 13 13 ARG H H 13 7.987 7.987 8.294 -0.307 25149
6980 1 19 . 1 1 14 14 MET N N 14 119.313 119.313 119.215 0.098 25149
6981 1 19 . 1 1 14 14 MET HA H 14 4.547 4.547 4.399 0.148 25149
6982 1 19 . 1 1 14 14 MET C C 14 176.143 176.143 175.797 0.346 25149
6983 1 19 . 1 1 14 14 MET CA C 14 54.208 54.208 54.652 -0.444 25149
6984 1 19 . 1 1 14 14 MET CB C 14 33.951 33.951 33.935 0.015 25149
6985 1 19 . 1 1 14 14 MET H H 14 8.624 8.624 7.487 1.137 25149
6986 1 19 . 1 1 15 15 ALA N N 15 122.683 122.683 128.457 -5.774 25149
6987 1 19 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.070 0.202 25149
6988 1 19 . 1 1 15 15 ALA C C 15 180.117 180.117 178.164 1.953 25149
6989 1 19 . 1 1 15 15 ALA CA C 15 52.346 52.346 51.884 0.462 25149
6990 1 19 . 1 1 15 15 ALA CB C 15 19.487 19.487 19.168 0.319 25149
6991 1 19 . 1 1 15 15 ALA H H 15 7.965 7.965 8.229 -0.264 25149
6992 1 19 . 1 1 16 16 PHE N N 16 119.313 119.313 121.511 -2.198 25149
6993 1 19 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.065 -0.024 25149
6994 1 19 . 1 1 16 16 PHE C C 16 176.423 176.423 176.456 -0.033 25149
6995 1 19 . 1 1 16 16 PHE CA C 16 59.130 59.130 59.584 -0.454 25149
6996 1 19 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.519 -0.129 25149
6997 1 19 . 1 1 16 16 PHE H H 16 8.095 8.095 8.136 -0.041 25149
6998 1 19 . 1 1 17 17 ASN N N 17 112.313 112.313 115.718 -3.405 25149
6999 1 19 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.928 -0.292 25149
7000 1 19 . 1 1 17 17 ASN C C 17 175.337 175.337 175.261 0.076 25149
7001 1 19 . 1 1 17 17 ASN CA C 17 52.961 52.961 53.207 -0.246 25149
7002 1 19 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.531 -1.357 25149
7003 1 19 . 1 1 17 17 ASN H H 17 7.823 7.823 8.181 -0.358 25149
7004 1 19 . 1 1 18 18 GLY N N 18 107.742 107.742 107.887 -0.145 25149
7005 1 19 . 1 1 18 18 GLY C C 18 173.759 173.759 173.198 0.561 25149
7006 1 19 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.455 0.009 25149
7007 1 19 . 1 1 18 18 GLY H H 18 7.579 7.579 8.003 -0.424 25149
7008 1 19 . 1 1 19 19 CYS N N 19 117.050 117.050 118.129 -1.079 25149
7009 1 19 . 1 1 19 19 CYS HA H 19 4.571 4.571 4.765 -0.194 25149
7010 1 19 . 1 1 19 19 CYS C C 19 174.039 174.039 174.544 -0.505 25149
7011 1 19 . 1 1 19 19 CYS CA C 19 58.433 58.433 57.152 1.281 25149
7012 1 19 . 1 1 19 19 CYS CB C 19 30.681 30.681 29.448 1.233 25149
7013 1 19 . 1 1 19 19 CYS H H 19 8.198 8.198 8.284 -0.086 25149
7014 1 19 . 1 1 20 20 CYS N N 20 123.923 123.923 117.747 6.176 25149
7015 1 19 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.718 -0.707 25149
7016 1 19 . 1 1 20 20 CYS C C 20 173.736 173.736 172.938 0.798 25149
7017 1 19 . 1 1 20 20 CYS CA C 20 57.999 57.999 55.135 2.864 25149
7018 1 19 . 1 1 20 20 CYS CB C 20 28.205 28.205 27.805 0.400 25149
7019 1 19 . 1 1 20 20 CYS H H 20 8.466 8.466 8.209 0.257 25149
7020 1 19 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.223 -0.194 25149
7021 1 19 . 1 1 21 21 PRO CA C 21 65.426 65.426 64.258 1.168 25149
7022 1 19 . 1 1 21 21 PRO CB C 21 32.801 32.801 31.754 1.047 25149
7023 1 19 . 1 1 22 22 ASP N N 22 117.053 117.053 119.541 -2.488 25149
7024 1 19 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.368 0.137 25149
7025 1 19 . 1 1 22 22 ASP C C 22 176.501 176.501 175.966 0.535 25149
7026 1 19 . 1 1 22 22 ASP CA C 22 55.017 55.017 56.601 -1.584 25149
7027 1 19 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.429 2.093 25149
7028 1 19 . 1 1 22 22 ASP H H 22 8.395 8.395 8.677 -0.282 25149
7029 1 19 . 1 1 23 23 CYS N N 23 123.353 123.353 118.185 5.168 25149
7030 1 19 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.574 -0.281 25149
7031 1 19 . 1 1 23 23 CYS C C 23 175.214 175.214 173.342 1.872 25149
7032 1 19 . 1 1 23 23 CYS CA C 23 61.633 61.633 58.697 2.936 25149
7033 1 19 . 1 1 23 23 CYS CB C 23 31.542 31.542 29.009 2.533 25149
7034 1 19 . 1 1 23 23 CYS H H 23 7.246 7.246 7.842 -0.596 25149
7035 1 19 . 1 1 24 24 LYS N N 24 117.539 117.539 127.964 -10.425 25149
7036 1 19 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.593 -0.363 25149
7037 1 19 . 1 1 24 24 LYS C C 24 177.106 177.106 174.886 2.220 25149
7038 1 19 . 1 1 24 24 LYS CA C 24 56.921 56.921 55.680 1.241 25149
7039 1 19 . 1 1 24 24 LYS CB C 24 34.615 34.615 33.220 1.395 25149
7040 1 19 . 1 1 24 24 LYS H H 24 8.173 8.173 8.598 -0.425 25149
7041 1 19 . 1 1 25 25 VAL N N 25 120.661 120.661 125.460 -4.799 25149
7042 1 19 . 1 1 25 25 VAL HA H 25 4.429 4.429 4.399 0.030 25149
7043 1 19 . 1 1 25 25 VAL C C 25 174.027 174.027 174.980 -0.953 25149
7044 1 19 . 1 1 25 25 VAL CA C 25 59.934 59.934 60.139 -0.205 25149
7045 1 19 . 1 1 25 25 VAL CB C 25 33.507 33.507 34.964 -1.457 25149
7046 1 19 . 1 1 25 25 VAL H H 25 7.787 7.787 8.245 -0.458 25149
7047 1 19 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.561 -0.225 25149
7048 1 19 . 1 1 26 26 PRO CA C 26 63.279 63.279 64.179 -0.900 25149
7049 1 19 . 1 1 26 26 PRO CB C 26 32.077 32.077 32.280 -0.203 25149
7050 1 19 . 1 1 27 27 GLY N N 27 109.926 109.926 106.618 3.308 25149
7051 1 19 . 1 1 27 27 GLY C C 27 175.169 175.169 173.910 1.259 25149
7052 1 19 . 1 1 27 27 GLY CA C 27 45.042 45.042 45.037 0.005 25149
7053 1 19 . 1 1 27 27 GLY H H 27 8.569 8.569 8.239 0.330 25149
7054 1 19 . 1 1 28 28 ASP N N 28 122.592 122.592 121.377 1.215 25149
7055 1 19 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.739 -0.508 25149
7056 1 19 . 1 1 28 28 ASP C C 28 176.602 176.602 175.932 0.670 25149
7057 1 19 . 1 1 28 28 ASP CA C 28 56.402 56.402 53.957 2.445 25149
7058 1 19 . 1 1 28 28 ASP CB C 28 40.912 40.912 42.161 -1.249 25149
7059 1 19 . 1 1 28 28 ASP H H 28 8.214 8.214 7.642 0.572 25149
7060 1 19 . 1 1 29 29 ASP N N 29 117.500 117.500 119.160 -1.660 25149
7061 1 19 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.274 0.173 25149
7062 1 19 . 1 1 29 29 ASP C C 29 175.505 175.505 175.621 -0.116 25149
7063 1 19 . 1 1 29 29 ASP CA C 29 55.266 55.266 55.004 0.262 25149
7064 1 19 . 1 1 29 29 ASP CB C 29 41.225 41.225 38.686 2.539 25149
7065 1 19 . 1 1 29 29 ASP H H 29 8.271 8.271 8.394 -0.123 25149
7066 1 19 . 1 1 30 30 CYS N N 30 124.470 124.470 117.935 6.535 25149
7067 1 19 . 1 1 30 30 CYS HA H 30 4.390 4.390 4.347 0.043 25149
7068 1 19 . 1 1 30 30 CYS C C 30 171.755 171.755 174.416 -2.661 25149
7069 1 19 . 1 1 30 30 CYS CA C 30 57.676 57.676 59.336 -1.660 25149
7070 1 19 . 1 1 30 30 CYS CB C 30 29.154 29.154 26.721 2.433 25149
7071 1 19 . 1 1 30 30 CYS H H 30 7.912 7.912 8.252 -0.340 25149
7072 1 19 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.429 0.258 25149
7073 1 19 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.901 -0.026 25149
7074 1 19 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.437 1.547 25149
7075 1 19 . 1 1 32 32 LEU N N 32 120.023 120.023 114.343 5.680 25149
7076 1 19 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.615 0.101 25149
7077 1 19 . 1 1 32 32 LEU C C 32 176.300 176.300 174.606 1.694 25149
7078 1 19 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.389 0.532 25149
7079 1 19 . 1 1 32 32 LEU CB C 32 43.336 43.336 44.818 -1.482 25149
7080 1 19 . 1 1 32 32 LEU H H 32 8.580 8.580 7.868 0.712 25149
7081 1 19 . 1 1 33 33 VAL N N 33 116.217 116.217 118.429 -2.212 25149
7082 1 19 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.524 0.139 25149
7083 1 19 . 1 1 33 33 VAL C C 33 171.374 171.374 173.921 -2.547 25149
7084 1 19 . 1 1 33 33 VAL CA C 33 60.449 60.449 60.237 0.212 25149
7085 1 19 . 1 1 33 33 VAL CB C 33 36.448 36.448 35.569 0.879 25149
7086 1 19 . 1 1 33 33 VAL H H 33 8.594 8.594 7.988 0.606 25149
7087 1 19 . 1 1 34 34 TRP N N 34 122.711 122.711 125.985 -3.274 25149
7088 1 19 . 1 1 34 34 TRP HA H 34 5.339 5.339 5.081 0.258 25149
7089 1 19 . 1 1 34 34 TRP C C 34 176.770 176.770 175.586 1.184 25149
7090 1 19 . 1 1 34 34 TRP CA C 34 57.267 57.267 55.989 1.278 25149
7091 1 19 . 1 1 34 34 TRP CB C 34 33.780 33.780 33.453 0.327 25149
7092 1 19 . 1 1 34 34 TRP H H 34 8.756 8.756 8.837 -0.081 25149
7093 1 19 . 1 1 35 35 GLY N N 35 107.569 107.569 107.763 -0.194 25149
7094 1 19 . 1 1 35 35 GLY C C 35 177.397 177.397 173.916 3.481 25149
7095 1 19 . 1 1 35 35 GLY CA C 35 44.070 44.070 44.197 -0.127 25149
7096 1 19 . 1 1 35 35 GLY H H 35 8.857 8.857 8.492 0.365 25149
7097 1 19 . 1 1 36 36 GLN N N 36 122.723 122.723 118.457 4.266 25149
7098 1 19 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.118 -0.372 25149
7099 1 19 . 1 1 36 36 GLN C C 36 176.445 176.445 176.153 0.292 25149
7100 1 19 . 1 1 36 36 GLN CA C 36 58.429 58.429 57.951 0.478 25149
7101 1 19 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.195 -0.563 25149
7102 1 19 . 1 1 36 36 GLN H H 36 8.338 8.338 8.580 -0.242 25149
7103 1 19 . 1 1 37 37 CYS N N 37 115.763 115.763 114.372 1.391 25149
7104 1 19 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.928 -0.644 25149
7105 1 19 . 1 1 37 37 CYS C C 37 175.281 175.281 175.632 -0.351 25149
7106 1 19 . 1 1 37 37 CYS CA C 37 58.395 58.395 54.788 3.607 25149
7107 1 19 . 1 1 37 37 CYS CB C 37 31.143 31.143 31.077 0.066 25149
7108 1 19 . 1 1 37 37 CYS H H 37 7.622 7.622 7.726 -0.104 25149
7109 1 19 . 1 1 38 38 SER N N 38 114.540 114.540 114.729 -0.189 25149
7110 1 19 . 1 1 38 38 SER HA H 38 4.004 4.004 4.198 -0.194 25149
7111 1 19 . 1 1 38 38 SER C C 38 173.389 173.389 174.511 -1.122 25149
7112 1 19 . 1 1 38 38 SER CA C 38 62.285 62.285 60.235 2.050 25149
7113 1 19 . 1 1 38 38 SER H H 38 7.716 7.716 8.525 -0.809 25149
7114 1 19 . 1 1 39 39 HIS N N 39 121.947 121.947 122.637 -0.690 25149
7115 1 19 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.399 0.045 25149
7116 1 19 . 1 1 39 39 HIS C C 39 172.326 172.326 173.852 -1.526 25149
7117 1 19 . 1 1 39 39 HIS CA C 39 61.320 61.320 56.642 4.678 25149
7118 1 19 . 1 1 39 39 HIS CB C 39 31.523 31.523 29.581 1.942 25149
7119 1 19 . 1 1 39 39 HIS H H 39 7.829 7.829 7.574 0.255 25149
7120 1 19 . 1 1 40 40 CYS N N 40 121.859 121.859 123.941 -2.082 25149
7121 1 19 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.405 0.204 25149
7122 1 19 . 1 1 40 40 CYS C C 40 171.900 171.900 172.251 -0.351 25149
7123 1 19 . 1 1 40 40 CYS CA C 40 55.791 55.791 55.362 0.429 25149
7124 1 19 . 1 1 40 40 CYS CB C 40 28.964 28.964 27.125 1.839 25149
7125 1 19 . 1 1 40 40 CYS H H 40 8.049 8.049 8.675 -0.626 25149
7126 1 19 . 1 1 41 41 PHE N N 41 120.690 120.690 120.762 -0.072 25149
7127 1 19 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.721 0.456 25149
7128 1 19 . 1 1 41 41 PHE C C 41 176.613 176.613 174.961 1.652 25149
7129 1 19 . 1 1 41 41 PHE CA C 41 56.033 56.033 56.168 -0.135 25149
7130 1 19 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.507 2.253 25149
7131 1 19 . 1 1 41 41 PHE H H 41 8.368 8.368 8.381 -0.013 25149
7132 1 19 . 1 1 42 42 HIS N N 42 117.057 117.057 122.781 -5.724 25149
7133 1 19 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.384 0.285 25149
7134 1 19 . 1 1 42 42 HIS C C 42 177.464 177.464 176.579 0.885 25149
7135 1 19 . 1 1 42 42 HIS CA C 42 60.425 60.425 58.063 2.362 25149
7136 1 19 . 1 1 42 42 HIS CB C 42 29.740 29.740 29.787 -0.047 25149
7137 1 19 . 1 1 42 42 HIS H H 42 8.384 8.384 8.779 -0.395 25149
7138 1 19 . 1 1 43 43 MET N N 43 128.543 128.543 125.569 2.974 25149
7139 1 19 . 1 1 43 43 MET HA H 43 3.965 3.965 4.009 -0.044 25149
7140 1 19 . 1 1 43 43 MET C C 43 177.845 177.845 177.573 0.272 25149
7141 1 19 . 1 1 43 43 MET CA C 43 59.209 59.209 60.618 -1.409 25149
7142 1 19 . 1 1 43 43 MET CB C 43 33.009 33.009 32.758 0.251 25149
7143 1 19 . 1 1 43 43 MET H H 43 9.439 9.439 8.516 0.923 25149
7144 1 19 . 1 1 44 44 HIS N N 44 116.500 116.500 117.574 -1.074 25149
7145 1 19 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.196 0.060 25149
7146 1 19 . 1 1 44 44 HIS C C 44 178.405 178.405 177.935 0.470 25149
7147 1 19 . 1 1 44 44 HIS CA C 44 58.793 58.793 59.230 -0.437 25149
7148 1 19 . 1 1 44 44 HIS CB C 44 32.747 32.747 28.878 3.869 25149
7149 1 19 . 1 1 44 44 HIS H H 44 9.747 9.747 7.895 1.852 25149
7150 1 19 . 1 1 45 45 CYS N N 45 115.950 115.950 117.612 -1.662 25149
7151 1 19 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.125 -0.125 25149
7152 1 19 . 1 1 45 45 CYS C C 45 177.957 177.957 176.997 0.960 25149
7153 1 19 . 1 1 45 45 CYS CA C 45 62.923 62.923 63.810 -0.887 25149
7154 1 19 . 1 1 45 45 CYS CB C 45 29.102 29.102 26.830 2.272 25149
7155 1 19 . 1 1 45 45 CYS H H 45 6.845 6.845 8.111 -1.266 25149
7156 1 19 . 1 1 46 46 ILE N N 46 119.362 119.362 121.515 -2.153 25149
7157 1 19 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.712 -0.047 25149
7158 1 19 . 1 1 46 46 ILE C C 46 176.613 176.613 177.532 -0.919 25149
7159 1 19 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.444 -4.202 25149
7160 1 19 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.695 -0.376 25149
7161 1 19 . 1 1 46 46 ILE H H 46 7.816 7.816 8.005 -0.189 25149
7162 1 19 . 1 1 47 47 LEU N N 47 122.180 122.180 120.650 1.530 25149
7163 1 19 . 1 1 47 47 LEU HA H 47 3.873 3.873 4.116 -0.243 25149
7164 1 19 . 1 1 47 47 LEU C C 47 179.726 179.726 178.946 0.780 25149
7165 1 19 . 1 1 47 47 LEU CA C 47 58.633 58.633 59.141 -0.508 25149
7166 1 19 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.901 -0.778 25149
7167 1 19 . 1 1 47 47 LEU H H 47 8.266 8.266 8.625 -0.359 25149
7168 1 19 . 1 1 48 48 LYS N N 48 118.251 118.251 118.609 -0.358 25149
7169 1 19 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.229 -0.365 25149
7170 1 19 . 1 1 48 48 LYS C C 48 179.423 179.423 178.643 0.780 25149
7171 1 19 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.711 0.276 25149
7172 1 19 . 1 1 48 48 LYS CB C 48 32.765 32.765 31.951 0.814 25149
7173 1 19 . 1 1 48 48 LYS H H 48 7.147 7.147 8.601 -1.454 25149
7174 1 19 . 1 1 49 49 TRP N N 49 120.745 120.745 119.924 0.821 25149
7175 1 19 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.333 -0.253 25149
7176 1 19 . 1 1 49 49 TRP C C 49 178.147 178.147 176.805 1.342 25149
7177 1 19 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.324 0.221 25149
7178 1 19 . 1 1 49 49 TRP CB C 49 29.415 29.415 28.868 0.547 25149
7179 1 19 . 1 1 49 49 TRP H H 49 7.709 7.709 7.501 0.208 25149
7180 1 19 . 1 1 50 50 LEU N N 50 117.236 117.236 116.483 0.753 25149
7181 1 19 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.640 -0.035 25149
7182 1 19 . 1 1 50 50 LEU C C 50 179.658 179.658 176.687 2.971 25149
7183 1 19 . 1 1 50 50 LEU CA C 50 57.330 57.330 54.784 2.546 25149
7184 1 19 . 1 1 50 50 LEU CB C 50 41.416 41.416 42.521 -1.105 25149
7185 1 19 . 1 1 50 50 LEU H H 50 8.512 8.512 7.812 0.700 25149
7186 1 19 . 1 1 51 51 HIS N N 51 115.650 115.650 117.669 -2.019 25149
7187 1 19 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.477 -0.203 25149
7188 1 19 . 1 1 51 51 HIS C C 51 175.942 175.942 176.119 -0.177 25149
7189 1 19 . 1 1 51 51 HIS CA C 51 57.320 57.320 57.563 -0.243 25149
7190 1 19 . 1 1 51 51 HIS CB C 51 29.487 29.487 30.393 -0.906 25149
7191 1 19 . 1 1 51 51 HIS H H 51 7.713 7.713 8.302 -0.589 25149
7192 1 19 . 1 1 52 52 ALA N N 52 119.779 119.779 120.606 -0.827 25149
7193 1 19 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.441 -0.418 25149
7194 1 19 . 1 1 52 52 ALA C C 52 177.834 177.834 176.341 1.493 25149
7195 1 19 . 1 1 52 52 ALA CA C 52 52.865 52.865 52.650 0.215 25149
7196 1 19 . 1 1 52 52 ALA CB C 52 18.951 18.951 19.892 -0.941 25149
7197 1 19 . 1 1 52 52 ALA H H 52 7.191 7.191 7.834 -0.643 25149
7198 1 19 . 1 1 53 53 GLN N N 53 117.047 117.047 118.487 -1.440 25149
7199 1 19 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.423 -0.490 25149
7200 1 19 . 1 1 53 53 GLN C C 53 175.998 175.998 175.122 0.876 25149
7201 1 19 . 1 1 53 53 GLN CA C 53 55.482 55.482 54.908 0.574 25149
7202 1 19 . 1 1 53 53 GLN CB C 53 28.887 28.887 30.474 -1.587 25149
7203 1 19 . 1 1 53 53 GLN H H 53 7.317 7.317 7.129 0.188 25149
7204 1 19 . 1 1 54 54 GLN N N 54 118.463 118.463 122.725 -4.262 25149
7205 1 19 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.443 -0.454 25149
7206 1 19 . 1 1 54 54 GLN C C 54 176.300 176.300 175.105 1.195 25149
7207 1 19 . 1 1 54 54 GLN CA C 54 57.314 57.314 55.708 1.606 25149
7208 1 19 . 1 1 54 54 GLN CB C 54 28.823 28.823 28.588 0.235 25149
7209 1 19 . 1 1 54 54 GLN H H 54 7.949 7.949 8.675 -0.726 25149
7210 1 19 . 1 1 55 55 VAL N N 55 116.755 116.755 119.163 -2.408 25149
7211 1 19 . 1 1 55 55 VAL HA H 55 3.884 3.884 4.104 -0.220 25149
7212 1 19 . 1 1 55 55 VAL C C 55 175.774 175.774 176.010 -0.236 25149
7213 1 19 . 1 1 55 55 VAL CA C 55 63.210 63.210 62.599 0.611 25149
7214 1 19 . 1 1 55 55 VAL CB C 55 32.870 32.870 32.731 0.139 25149
7215 1 19 . 1 1 55 55 VAL H H 55 7.801 7.801 7.595 0.206 25149
7216 1 19 . 1 1 56 56 GLN N N 56 120.192 120.192 119.859 0.333 25149
7217 1 19 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.639 -0.522 25149
7218 1 19 . 1 1 56 56 GLN C C 56 175.236 175.236 175.771 -0.535 25149
7219 1 19 . 1 1 56 56 GLN CA C 56 55.697 55.697 55.127 0.570 25149
7220 1 19 . 1 1 56 56 GLN CB C 56 29.319 29.319 29.332 -0.013 25149
7221 1 19 . 1 1 56 56 GLN H H 56 8.018 8.018 8.435 -0.417 25149
7222 1 19 . 1 1 57 57 GLN N N 57 121.276 121.276 120.466 0.810 25149
7223 1 19 . 1 1 57 57 GLN HA H 57 4.204 4.204 4.213 -0.009 25149
7224 1 19 . 1 1 57 57 GLN C C 57 175.819 175.819 175.472 0.347 25149
7225 1 19 . 1 1 57 57 GLN CA C 57 55.617 55.617 55.688 -0.071 25149
7226 1 19 . 1 1 57 57 GLN CB C 57 29.094 29.094 29.384 -0.290 25149
7227 1 19 . 1 1 57 57 GLN H H 57 8.471 8.471 8.697 -0.226 25149
7228 1 19 . 1 1 58 58 HIS N N 58 120.001 120.001 119.882 0.119 25149
7229 1 19 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.328 0.846 25149
7230 1 19 . 1 1 58 58 HIS C C 58 173.636 173.636 175.979 -2.343 25149
7231 1 19 . 1 1 58 58 HIS CA C 58 54.353 54.353 57.488 -3.135 25149
7232 1 19 . 1 1 58 58 HIS CB C 58 33.057 33.057 29.415 3.642 25149
7233 1 19 . 1 1 58 58 HIS H H 58 8.366 8.366 7.883 0.483 25149
7234 1 19 . 1 1 59 59 CYS N N 59 121.924 121.924 122.534 -0.610 25149
7235 1 19 . 1 1 59 59 CYS HA H 59 4.442 4.442 3.986 0.456 25149
7236 1 19 . 1 1 59 59 CYS C C 59 176.334 176.334 174.890 1.444 25149
7237 1 19 . 1 1 59 59 CYS CA C 59 56.772 56.772 60.213 -3.441 25149
7238 1 19 . 1 1 59 59 CYS CB C 59 32.642 32.642 27.463 5.179 25149
7239 1 19 . 1 1 59 59 CYS H H 59 9.035 9.035 8.379 0.656 25149
7240 1 19 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.244 -0.431 25149
7241 1 19 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.796 -0.135 25149
7242 1 19 . 1 1 60 60 PRO CB C 60 30.659 30.659 31.279 -0.620 25149
7243 1 19 . 1 1 61 61 MET N N 61 117.676 117.676 116.879 0.797 25149
7244 1 19 . 1 1 61 61 MET HA H 61 4.317 4.317 4.336 -0.019 25149
7245 1 19 . 1 1 61 61 MET C C 61 177.117 177.117 175.748 1.369 25149
7246 1 19 . 1 1 61 61 MET CA C 61 56.408 56.408 56.739 -0.331 25149
7247 1 19 . 1 1 61 61 MET CB C 61 32.551 32.551 33.096 -0.545 25149
7248 1 19 . 1 1 61 61 MET H H 61 9.135 9.135 7.452 1.683 25149
7249 1 19 . 1 1 62 62 CYS N N 62 117.214 117.214 117.117 0.097 25149
7250 1 19 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.478 0.396 25149
7251 1 19 . 1 1 62 62 CYS C C 62 175.740 175.740 175.072 0.668 25149
7252 1 19 . 1 1 62 62 CYS CA C 62 58.273 58.273 58.849 -0.576 25149
7253 1 19 . 1 1 62 62 CYS CB C 62 32.776 32.776 28.756 4.020 25149
7254 1 19 . 1 1 62 62 CYS H H 62 8.011 8.011 7.941 0.070 25149
7255 1 19 . 1 1 63 63 ARG N N 63 116.555 116.555 119.473 -2.918 25149
7256 1 19 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.467 -0.542 25149
7257 1 19 . 1 1 63 63 ARG C C 63 175.326 175.326 174.877 0.449 25149
7258 1 19 . 1 1 63 63 ARG CA C 63 58.073 58.073 55.294 2.779 25149
7259 1 19 . 1 1 63 63 ARG CB C 63 27.136 27.136 30.414 -3.278 25149
7260 1 19 . 1 1 63 63 ARG H H 63 8.086 8.086 8.344 -0.258 25149
7261 1 19 . 1 1 64 64 GLN N N 64 118.932 118.932 117.749 1.183 25149
7262 1 19 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.639 -0.380 25149
7263 1 19 . 1 1 64 64 GLN C C 64 176.054 176.054 175.545 0.509 25149
7264 1 19 . 1 1 64 64 GLN CA C 64 56.316 56.316 54.416 1.900 25149
7265 1 19 . 1 1 64 64 GLN CB C 64 30.083 30.083 31.421 -1.337 25149
7266 1 19 . 1 1 64 64 GLN H H 64 8.003 8.003 7.881 0.122 25149
7267 1 19 . 1 1 65 65 GLU N N 65 122.038 122.038 121.958 0.080 25149
7268 1 19 . 1 1 65 65 GLU HA H 65 4.003 4.003 4.155 -0.152 25149
7269 1 19 . 1 1 65 65 GLU C C 65 176.781 176.781 175.941 0.840 25149
7270 1 19 . 1 1 65 65 GLU CA C 65 57.682 57.682 56.528 1.154 25149
7271 1 19 . 1 1 65 65 GLU CB C 65 29.900 29.900 28.852 1.048 25149
7272 1 19 . 1 1 65 65 GLU H H 65 8.657 8.657 8.704 -0.047 25149
7273 1 19 . 1 1 66 66 TRP N N 66 125.730 125.730 127.265 -1.535 25149
7274 1 19 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.221 0.183 25149
7275 1 19 . 1 1 66 66 TRP C C 66 175.460 175.460 175.320 0.140 25149
7276 1 19 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.558 0.067 25149
7277 1 19 . 1 1 66 66 TRP CB C 66 29.358 29.358 29.874 -0.516 25149
7278 1 19 . 1 1 66 66 TRP H H 66 8.499 8.499 8.128 0.371 25149
7279 1 19 . 1 1 67 67 LYS N N 67 127.396 127.396 127.252 0.144 25149
7280 1 19 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.075 -0.057 25149
7281 1 19 . 1 1 67 67 LYS C C 67 175.180 175.180 174.807 0.373 25149
7282 1 19 . 1 1 67 67 LYS CA C 67 54.514 54.514 54.165 0.349 25149
7283 1 19 . 1 1 67 67 LYS CB C 67 36.231 36.231 35.043 1.188 25149
7284 1 19 . 1 1 67 67 LYS H H 67 6.930 6.930 8.597 -1.667 25149
7285 1 19 . 1 1 68 68 PHE N N 68 121.511 121.511 125.393 -3.882 25149
7286 1 19 . 1 1 68 68 PHE HA H 68 4.108 4.108 4.014 0.094 25149
7287 1 19 . 1 1 68 68 PHE C C 68 176.613 176.613 175.483 1.130 25149
7288 1 19 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.861 2.100 25149
7289 1 19 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.456 1.806 25149
7290 1 19 . 1 1 68 68 PHE H H 68 8.430 8.430 8.494 -0.064 25149
7291 1 19 . 1 1 69 69 LYS N N 69 124.210 124.210 122.172 2.038 25149
7292 1 19 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.075 -0.080 25149
7293 1 19 . 1 1 69 69 LYS C C 69 175.651 175.651 176.194 -0.543 25149
7294 1 19 . 1 1 69 69 LYS CA C 69 57.320 57.320 57.137 0.183 25149
7295 1 19 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.472 -0.111 25149
7296 1 19 . 1 1 69 69 LYS H H 69 8.738 8.738 8.069 0.669 25149
7297 1 20 . 1 1 2 2 SER HA H 2 4.417 4.417 4.317 0.100 25149
7298 1 20 . 1 1 2 2 SER CA C 2 58.322 58.322 57.970 0.352 25149
7299 1 20 . 1 1 2 2 SER CB C 2 64.169 64.169 63.272 0.897 25149
7300 1 20 . 1 1 3 3 VAL N N 3 121.214 121.214 121.162 0.052 25149
7301 1 20 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.088 -0.042 25149
7302 1 20 . 1 1 3 3 VAL C C 3 175.879 175.879 175.640 0.239 25149
7303 1 20 . 1 1 3 3 VAL CA C 3 62.138 62.138 62.472 -0.334 25149
7304 1 20 . 1 1 3 3 VAL CB C 3 32.958 32.958 31.584 1.374 25149
7305 1 20 . 1 1 3 3 VAL H H 3 8.170 8.170 7.949 0.221 25149
7306 1 20 . 1 1 4 4 ALA N N 4 127.312 127.312 130.762 -3.450 25149
7307 1 20 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.563 -0.366 25149
7308 1 20 . 1 1 4 4 ALA C C 4 177.497 177.497 176.505 0.992 25149
7309 1 20 . 1 1 4 4 ALA CA C 4 52.439 52.439 51.174 1.265 25149
7310 1 20 . 1 1 4 4 ALA CB C 4 19.424 19.424 20.046 -0.622 25149
7311 1 20 . 1 1 4 4 ALA H H 4 8.294 8.294 8.406 -0.112 25149
7312 1 20 . 1 1 5 5 ASN N N 5 117.674 117.674 122.390 -4.716 25149
7313 1 20 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.728 -0.163 25149
7314 1 20 . 1 1 5 5 ASN C C 5 175.048 175.048 174.723 0.325 25149
7315 1 20 . 1 1 5 5 ASN CA C 5 53.725 53.725 53.395 0.330 25149
7316 1 20 . 1 1 5 5 ASN CB C 5 39.197 39.197 39.135 0.062 25149
7317 1 20 . 1 1 5 5 ASN H H 5 8.252 8.252 8.692 -0.440 25149
7318 1 20 . 1 1 6 6 ASP N N 6 119.896 119.896 122.815 -2.919 25149
7319 1 20 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.775 -0.255 25149
7320 1 20 . 1 1 6 6 ASP C C 6 176.269 176.269 175.140 1.129 25149
7321 1 20 . 1 1 6 6 ASP CA C 6 54.497 54.497 54.653 -0.156 25149
7322 1 20 . 1 1 6 6 ASP CB C 6 41.104 41.104 41.531 -0.427 25149
7323 1 20 . 1 1 6 6 ASP H H 6 8.215 8.215 8.631 -0.416 25149
7324 1 20 . 1 1 7 7 GLU N N 7 119.101 119.101 117.956 1.145 25149
7325 1 20 . 1 1 7 7 GLU HA H 7 4.243 4.243 4.303 -0.060 25149
7326 1 20 . 1 1 7 7 GLU C C 7 175.006 175.006 174.427 0.579 25149
7327 1 20 . 1 1 7 7 GLU CA C 7 56.689 56.689 55.910 0.779 25149
7328 1 20 . 1 1 7 7 GLU CB C 7 30.379 30.379 29.555 0.824 25149
7329 1 20 . 1 1 7 7 GLU H H 7 8.065 8.065 8.067 -0.002 25149
7330 1 20 . 1 1 8 8 ASN N N 8 116.852 116.852 114.190 2.662 25149
7331 1 20 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.512 -0.354 25149
7332 1 20 . 1 1 8 8 ASN C C 8 172.706 172.706 174.013 -1.307 25149
7333 1 20 . 1 1 8 8 ASN CA C 8 51.165 51.165 51.722 -0.557 25149
7334 1 20 . 1 1 8 8 ASN CB C 8 40.702 40.702 38.716 1.986 25149
7335 1 20 . 1 1 8 8 ASN H H 8 7.505 7.505 7.293 0.212 25149
7336 1 20 . 1 1 9 9 CYS N N 9 122.855 122.855 120.630 2.225 25149
7337 1 20 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.669 0.125 25149
7338 1 20 . 1 1 9 9 CYS C C 9 178.370 178.370 176.310 2.060 25149
7339 1 20 . 1 1 9 9 CYS CA C 9 59.552 59.552 60.415 -0.863 25149
7340 1 20 . 1 1 9 9 CYS CB C 9 31.526 31.526 28.569 2.957 25149
7341 1 20 . 1 1 9 9 CYS H H 9 7.614 7.614 7.946 -0.332 25149
7342 1 20 . 1 1 10 10 GLY N N 10 117.295 117.295 108.028 9.267 25149
7343 1 20 . 1 1 10 10 GLY C C 10 174.111 174.111 174.414 -0.303 25149
7344 1 20 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.567 1.400 25149
7345 1 20 . 1 1 10 10 GLY H H 10 9.235 9.235 7.837 1.398 25149
7346 1 20 . 1 1 11 11 ILE N N 11 119.811 119.811 119.556 0.255 25149
7347 1 20 . 1 1 11 11 ILE HA H 11 3.809 3.809 4.114 -0.305 25149
7348 1 20 . 1 1 11 11 ILE C C 11 176.121 176.121 176.295 -0.174 25149
7349 1 20 . 1 1 11 11 ILE CA C 11 64.041 64.041 63.375 0.666 25149
7350 1 20 . 1 1 11 11 ILE CB C 11 39.411 39.411 39.075 0.336 25149
7351 1 20 . 1 1 11 11 ILE H H 11 8.285 8.285 7.792 0.493 25149
7352 1 20 . 1 1 12 12 CYS N N 12 116.728 116.728 114.970 1.758 25149
7353 1 20 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.647 -0.071 25149
7354 1 20 . 1 1 12 12 CYS C C 12 175.975 175.975 174.039 1.936 25149
7355 1 20 . 1 1 12 12 CYS CA C 12 59.225 59.225 57.451 1.774 25149
7356 1 20 . 1 1 12 12 CYS CB C 12 32.246 32.246 29.679 2.567 25149
7357 1 20 . 1 1 12 12 CYS H H 12 7.607 7.607 7.916 -0.309 25149
7358 1 20 . 1 1 13 13 ARG N N 13 116.073 116.073 117.564 -1.491 25149
7359 1 20 . 1 1 13 13 ARG HA H 13 3.742 3.742 4.054 -0.312 25149
7360 1 20 . 1 1 13 13 ARG C C 13 174.979 174.979 174.875 0.104 25149
7361 1 20 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.833 0.803 25149
7362 1 20 . 1 1 13 13 ARG CB C 13 26.326 26.326 27.186 -0.860 25149
7363 1 20 . 1 1 13 13 ARG H H 13 7.987 7.987 8.248 -0.261 25149
7364 1 20 . 1 1 14 14 MET N N 14 119.313 119.313 118.462 0.851 25149
7365 1 20 . 1 1 14 14 MET HA H 14 4.547 4.547 4.537 0.010 25149
7366 1 20 . 1 1 14 14 MET C C 14 176.143 176.143 175.564 0.579 25149
7367 1 20 . 1 1 14 14 MET CA C 14 54.208 54.208 53.898 0.311 25149
7368 1 20 . 1 1 14 14 MET CB C 14 33.951 33.951 34.357 -0.406 25149
7369 1 20 . 1 1 14 14 MET H H 14 8.624 8.624 7.343 1.281 25149
7370 1 20 . 1 1 15 15 ALA N N 15 122.683 122.683 129.507 -6.824 25149
7371 1 20 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.336 -0.064 25149
7372 1 20 . 1 1 15 15 ALA C C 15 180.117 180.117 178.068 2.049 25149
7373 1 20 . 1 1 15 15 ALA CA C 15 52.346 52.346 52.196 0.150 25149
7374 1 20 . 1 1 15 15 ALA CB C 15 19.487 19.487 19.058 0.429 25149
7375 1 20 . 1 1 15 15 ALA H H 15 7.965 7.965 8.331 -0.366 25149
7376 1 20 . 1 1 16 16 PHE N N 16 119.313 119.313 121.040 -1.727 25149
7377 1 20 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.254 -0.213 25149
7378 1 20 . 1 1 16 16 PHE C C 16 176.423 176.423 176.988 -0.565 25149
7379 1 20 . 1 1 16 16 PHE CA C 16 59.130 59.130 59.957 -0.827 25149
7380 1 20 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.542 -0.152 25149
7381 1 20 . 1 1 16 16 PHE H H 16 8.095 8.095 8.075 0.020 25149
7382 1 20 . 1 1 17 17 ASN N N 17 112.313 112.313 117.380 -5.067 25149
7383 1 20 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.856 -0.220 25149
7384 1 20 . 1 1 17 17 ASN C C 17 175.337 175.337 174.834 0.503 25149
7385 1 20 . 1 1 17 17 ASN CA C 17 52.961 52.961 52.914 0.047 25149
7386 1 20 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.977 -1.803 25149
7387 1 20 . 1 1 17 17 ASN H H 17 7.823 7.823 8.071 -0.248 25149
7388 1 20 . 1 1 18 18 GLY N N 18 107.742 107.742 107.519 0.223 25149
7389 1 20 . 1 1 18 18 GLY C C 18 173.759 173.759 173.867 -0.108 25149
7390 1 20 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.416 0.048 25149
7391 1 20 . 1 1 18 18 GLY H H 18 7.579 7.579 8.120 -0.541 25149
7392 1 20 . 1 1 19 19 CYS N N 19 117.050 117.050 117.955 -0.905 25149
7393 1 20 . 1 1 19 19 CYS HA H 19 4.571 4.571 4.408 0.163 25149
7394 1 20 . 1 1 19 19 CYS C C 19 174.039 174.039 174.164 -0.125 25149
7395 1 20 . 1 1 19 19 CYS CA C 19 58.433 58.433 58.303 0.130 25149
7396 1 20 . 1 1 19 19 CYS CB C 19 30.681 30.681 28.570 2.111 25149
7397 1 20 . 1 1 19 19 CYS H H 19 8.198 8.198 8.233 -0.035 25149
7398 1 20 . 1 1 20 20 CYS N N 20 123.923 123.923 117.879 6.044 25149
7399 1 20 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.665 -0.654 25149
7400 1 20 . 1 1 20 20 CYS C C 20 173.736 173.736 174.163 -0.427 25149
7401 1 20 . 1 1 20 20 CYS CA C 20 57.999 57.999 55.403 2.596 25149
7402 1 20 . 1 1 20 20 CYS CB C 20 28.205 28.205 28.706 -0.501 25149
7403 1 20 . 1 1 20 20 CYS H H 20 8.466 8.466 8.236 0.230 25149
7404 1 20 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.284 -0.255 25149
7405 1 20 . 1 1 21 21 PRO CA C 21 65.426 65.426 64.090 1.336 25149
7406 1 20 . 1 1 21 21 PRO CB C 21 32.801 32.801 31.940 0.861 25149
7407 1 20 . 1 1 22 22 ASP N N 22 117.053 117.053 119.531 -2.478 25149
7408 1 20 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.345 0.160 25149
7409 1 20 . 1 1 22 22 ASP C C 22 176.501 176.501 177.558 -1.057 25149
7410 1 20 . 1 1 22 22 ASP CA C 22 55.017 55.017 56.365 -1.348 25149
7411 1 20 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.341 2.181 25149
7412 1 20 . 1 1 22 22 ASP H H 22 8.395 8.395 8.778 -0.383 25149
7413 1 20 . 1 1 23 23 CYS N N 23 123.353 123.353 117.994 5.359 25149
7414 1 20 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.300 -0.007 25149
7415 1 20 . 1 1 23 23 CYS C C 23 175.214 175.214 175.128 0.086 25149
7416 1 20 . 1 1 23 23 CYS CA C 23 61.633 61.633 60.471 1.162 25149
7417 1 20 . 1 1 23 23 CYS CB C 23 31.542 31.542 28.640 2.902 25149
7418 1 20 . 1 1 23 23 CYS H H 23 7.246 7.246 7.752 -0.506 25149
7419 1 20 . 1 1 24 24 LYS N N 24 117.539 117.539 117.906 -0.367 25149
7420 1 20 . 1 1 24 24 LYS HA H 24 4.230 4.230 3.990 0.240 25149
7421 1 20 . 1 1 24 24 LYS C C 24 177.106 177.106 175.141 1.965 25149
7422 1 20 . 1 1 24 24 LYS CA C 24 56.921 56.921 56.788 0.133 25149
7423 1 20 . 1 1 24 24 LYS CB C 24 34.615 34.615 30.154 4.460 25149
7424 1 20 . 1 1 24 24 LYS H H 24 8.173 8.173 8.192 -0.019 25149
7425 1 20 . 1 1 25 25 VAL N N 25 120.661 120.661 121.337 -0.676 25149
7426 1 20 . 1 1 25 25 VAL HA H 25 4.429 4.429 4.334 0.095 25149
7427 1 20 . 1 1 25 25 VAL C C 25 174.027 174.027 175.414 -1.387 25149
7428 1 20 . 1 1 25 25 VAL CA C 25 59.934 59.934 59.708 0.226 25149
7429 1 20 . 1 1 25 25 VAL CB C 25 33.507 33.507 33.016 0.491 25149
7430 1 20 . 1 1 25 25 VAL H H 25 7.787 7.787 8.099 -0.312 25149
7431 1 20 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.523 -0.187 25149
7432 1 20 . 1 1 26 26 PRO CA C 26 63.279 63.279 62.878 0.401 25149
7433 1 20 . 1 1 26 26 PRO CB C 26 32.077 32.077 29.686 2.391 25149
7434 1 20 . 1 1 27 27 GLY N N 27 109.926 109.926 110.002 -0.076 25149
7435 1 20 . 1 1 27 27 GLY C C 27 175.169 175.169 173.073 2.096 25149
7436 1 20 . 1 1 27 27 GLY CA C 27 45.042 45.042 45.458 -0.416 25149
7437 1 20 . 1 1 27 27 GLY H H 27 8.569 8.569 7.705 0.864 25149
7438 1 20 . 1 1 28 28 ASP N N 28 122.592 122.592 120.165 2.427 25149
7439 1 20 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.452 -0.221 25149
7440 1 20 . 1 1 28 28 ASP C C 28 176.602 176.602 176.514 0.088 25149
7441 1 20 . 1 1 28 28 ASP CA C 28 56.402 56.402 55.018 1.384 25149
7442 1 20 . 1 1 28 28 ASP CB C 28 40.912 40.912 41.215 -0.303 25149
7443 1 20 . 1 1 28 28 ASP H H 28 8.214 8.214 8.389 -0.175 25149
7444 1 20 . 1 1 29 29 ASP N N 29 117.500 117.500 120.461 -2.961 25149
7445 1 20 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.489 -0.042 25149
7446 1 20 . 1 1 29 29 ASP C C 29 175.505 175.505 175.888 -0.383 25149
7447 1 20 . 1 1 29 29 ASP CA C 29 55.266 55.266 55.081 0.185 25149
7448 1 20 . 1 1 29 29 ASP CB C 29 41.225 41.225 39.954 1.271 25149
7449 1 20 . 1 1 29 29 ASP H H 29 8.271 8.271 8.372 -0.101 25149
7450 1 20 . 1 1 30 30 CYS N N 30 124.470 124.470 124.273 0.197 25149
7451 1 20 . 1 1 30 30 CYS HA H 30 4.390 4.390 4.794 -0.404 25149
7452 1 20 . 1 1 30 30 CYS C C 30 171.755 171.755 172.675 -0.920 25149
7453 1 20 . 1 1 30 30 CYS CA C 30 57.676 57.676 55.954 1.722 25149
7454 1 20 . 1 1 30 30 CYS CB C 30 29.154 29.154 28.769 0.385 25149
7455 1 20 . 1 1 30 30 CYS H H 30 7.912 7.912 8.124 -0.212 25149
7456 1 20 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.626 0.061 25149
7457 1 20 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.520 0.355 25149
7458 1 20 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.421 1.563 25149
7459 1 20 . 1 1 32 32 LEU N N 32 120.023 120.023 116.946 3.077 25149
7460 1 20 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.532 0.184 25149
7461 1 20 . 1 1 32 32 LEU C C 32 176.300 176.300 175.178 1.122 25149
7462 1 20 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.920 0.001 25149
7463 1 20 . 1 1 32 32 LEU CB C 32 43.336 43.336 43.583 -0.247 25149
7464 1 20 . 1 1 32 32 LEU H H 32 8.580 8.580 7.990 0.590 25149
7465 1 20 . 1 1 33 33 VAL N N 33 116.217 116.217 118.596 -2.379 25149
7466 1 20 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.529 0.134 25149
7467 1 20 . 1 1 33 33 VAL C C 33 171.374 171.374 174.279 -2.905 25149
7468 1 20 . 1 1 33 33 VAL CA C 33 60.449 60.449 60.512 -0.063 25149
7469 1 20 . 1 1 33 33 VAL CB C 33 36.448 36.448 36.027 0.421 25149
7470 1 20 . 1 1 33 33 VAL H H 33 8.594 8.594 8.457 0.137 25149
7471 1 20 . 1 1 34 34 TRP N N 34 122.711 122.711 125.922 -3.211 25149
7472 1 20 . 1 1 34 34 TRP HA H 34 5.339 5.339 5.006 0.333 25149
7473 1 20 . 1 1 34 34 TRP C C 34 176.770 176.770 175.566 1.204 25149
7474 1 20 . 1 1 34 34 TRP CA C 34 57.267 57.267 56.013 1.254 25149
7475 1 20 . 1 1 34 34 TRP CB C 34 33.780 33.780 33.395 0.385 25149
7476 1 20 . 1 1 34 34 TRP H H 34 8.756 8.756 8.801 -0.045 25149
7477 1 20 . 1 1 35 35 GLY N N 35 107.569 107.569 107.069 0.500 25149
7478 1 20 . 1 1 35 35 GLY C C 35 177.397 177.397 173.783 3.614 25149
7479 1 20 . 1 1 35 35 GLY CA C 35 44.070 44.070 44.069 0.001 25149
7480 1 20 . 1 1 35 35 GLY H H 35 8.857 8.857 8.599 0.258 25149
7481 1 20 . 1 1 36 36 GLN N N 36 122.723 122.723 118.988 3.735 25149
7482 1 20 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.051 -0.305 25149
7483 1 20 . 1 1 36 36 GLN C C 36 176.445 176.445 176.005 0.440 25149
7484 1 20 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.143 0.286 25149
7485 1 20 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.418 -0.787 25149
7486 1 20 . 1 1 36 36 GLN H H 36 8.338 8.338 8.518 -0.180 25149
7487 1 20 . 1 1 37 37 CYS N N 37 115.763 115.763 114.225 1.538 25149
7488 1 20 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.900 -0.616 25149
7489 1 20 . 1 1 37 37 CYS C C 37 175.281 175.281 175.866 -0.585 25149
7490 1 20 . 1 1 37 37 CYS CA C 37 58.395 58.395 56.071 2.325 25149
7491 1 20 . 1 1 37 37 CYS CB C 37 31.143 31.143 31.389 -0.246 25149
7492 1 20 . 1 1 37 37 CYS H H 37 7.622 7.622 7.673 -0.051 25149
7493 1 20 . 1 1 38 38 SER N N 38 114.540 114.540 115.146 -0.606 25149
7494 1 20 . 1 1 38 38 SER HA H 38 4.004 4.004 4.243 -0.239 25149
7495 1 20 . 1 1 38 38 SER C C 38 173.389 173.389 174.650 -1.261 25149
7496 1 20 . 1 1 38 38 SER CA C 38 62.285 62.285 60.889 1.396 25149
7497 1 20 . 1 1 38 38 SER H H 38 7.716 7.716 8.553 -0.837 25149
7498 1 20 . 1 1 39 39 HIS N N 39 121.947 121.947 120.932 1.015 25149
7499 1 20 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.340 0.104 25149
7500 1 20 . 1 1 39 39 HIS C C 39 172.326 172.326 173.894 -1.568 25149
7501 1 20 . 1 1 39 39 HIS CA C 39 61.320 61.320 57.087 4.233 25149
7502 1 20 . 1 1 39 39 HIS CB C 39 31.523 31.523 29.852 1.671 25149
7503 1 20 . 1 1 39 39 HIS H H 39 7.829 7.829 7.510 0.319 25149
7504 1 20 . 1 1 40 40 CYS N N 40 121.859 121.859 122.808 -0.949 25149
7505 1 20 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.553 0.056 25149
7506 1 20 . 1 1 40 40 CYS C C 40 171.900 171.900 172.113 -0.213 25149
7507 1 20 . 1 1 40 40 CYS CA C 40 55.791 55.791 55.851 -0.060 25149
7508 1 20 . 1 1 40 40 CYS CB C 40 28.964 28.964 29.039 -0.075 25149
7509 1 20 . 1 1 40 40 CYS H H 40 8.049 8.049 8.749 -0.700 25149
7510 1 20 . 1 1 41 41 PHE N N 41 120.690 120.690 121.006 -0.316 25149
7511 1 20 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.783 0.394 25149
7512 1 20 . 1 1 41 41 PHE C C 41 176.613 176.613 174.881 1.732 25149
7513 1 20 . 1 1 41 41 PHE CA C 41 56.033 56.033 55.266 0.767 25149
7514 1 20 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.657 2.103 25149
7515 1 20 . 1 1 41 41 PHE H H 41 8.368 8.368 8.468 -0.100 25149
7516 1 20 . 1 1 42 42 HIS N N 42 117.057 117.057 120.538 -3.481 25149
7517 1 20 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.429 0.240 25149
7518 1 20 . 1 1 42 42 HIS C C 42 177.464 177.464 176.109 1.355 25149
7519 1 20 . 1 1 42 42 HIS CA C 42 60.425 60.425 56.655 3.770 25149
7520 1 20 . 1 1 42 42 HIS CB C 42 29.740 29.740 29.576 0.164 25149
7521 1 20 . 1 1 42 42 HIS H H 42 8.384 8.384 8.027 0.357 25149
7522 1 20 . 1 1 43 43 MET N N 43 128.543 128.543 126.229 2.314 25149
7523 1 20 . 1 1 43 43 MET HA H 43 3.965 3.965 4.049 -0.084 25149
7524 1 20 . 1 1 43 43 MET C C 43 177.845 177.845 177.322 0.523 25149
7525 1 20 . 1 1 43 43 MET CA C 43 59.209 59.209 60.524 -1.315 25149
7526 1 20 . 1 1 43 43 MET CB C 43 33.009 33.009 32.721 0.288 25149
7527 1 20 . 1 1 43 43 MET H H 43 9.439 9.439 8.286 1.153 25149
7528 1 20 . 1 1 44 44 HIS N N 44 116.500 116.500 117.640 -1.140 25149
7529 1 20 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.201 0.055 25149
7530 1 20 . 1 1 44 44 HIS C C 44 178.405 178.405 178.021 0.384 25149
7531 1 20 . 1 1 44 44 HIS CA C 44 58.793 58.793 58.982 -0.189 25149
7532 1 20 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.117 3.630 25149
7533 1 20 . 1 1 44 44 HIS H H 44 9.747 9.747 8.150 1.597 25149
7534 1 20 . 1 1 45 45 CYS N N 45 115.950 115.950 117.676 -1.726 25149
7535 1 20 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.199 -0.199 25149
7536 1 20 . 1 1 45 45 CYS C C 45 177.957 177.957 177.318 0.639 25149
7537 1 20 . 1 1 45 45 CYS CA C 45 62.923 62.923 63.687 -0.764 25149
7538 1 20 . 1 1 45 45 CYS CB C 45 29.102 29.102 27.191 1.911 25149
7539 1 20 . 1 1 45 45 CYS H H 45 6.845 6.845 8.057 -1.212 25149
7540 1 20 . 1 1 46 46 ILE N N 46 119.362 119.362 121.347 -1.985 25149
7541 1 20 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.644 0.021 25149
7542 1 20 . 1 1 46 46 ILE C C 46 176.613 176.613 177.781 -1.168 25149
7543 1 20 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.555 -4.314 25149
7544 1 20 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.766 -0.447 25149
7545 1 20 . 1 1 46 46 ILE H H 46 7.816 7.816 7.973 -0.157 25149
7546 1 20 . 1 1 47 47 LEU N N 47 122.180 122.180 120.532 1.648 25149
7547 1 20 . 1 1 47 47 LEU HA H 47 3.873 3.873 4.228 -0.355 25149
7548 1 20 . 1 1 47 47 LEU C C 47 179.726 179.726 178.982 0.744 25149
7549 1 20 . 1 1 47 47 LEU CA C 47 58.633 58.633 59.238 -0.605 25149
7550 1 20 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.973 -0.850 25149
7551 1 20 . 1 1 47 47 LEU H H 47 8.266 8.266 8.679 -0.413 25149
7552 1 20 . 1 1 48 48 LYS N N 48 118.251 118.251 118.647 -0.396 25149
7553 1 20 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.192 -0.328 25149
7554 1 20 . 1 1 48 48 LYS C C 48 179.423 179.423 178.765 0.658 25149
7555 1 20 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.700 0.287 25149
7556 1 20 . 1 1 48 48 LYS CB C 48 32.765 32.765 32.038 0.727 25149
7557 1 20 . 1 1 48 48 LYS H H 48 7.147 7.147 8.312 -1.165 25149
7558 1 20 . 1 1 49 49 TRP N N 49 120.745 120.745 120.994 -0.249 25149
7559 1 20 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.323 -0.243 25149
7560 1 20 . 1 1 49 49 TRP C C 49 178.147 178.147 178.108 0.039 25149
7561 1 20 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.686 -0.141 25149
7562 1 20 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.356 0.059 25149
7563 1 20 . 1 1 49 49 TRP H H 49 7.709 7.709 8.085 -0.376 25149
7564 1 20 . 1 1 50 50 LEU N N 50 117.236 117.236 117.270 -0.034 25149
7565 1 20 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.675 -0.070 25149
7566 1 20 . 1 1 50 50 LEU C C 50 179.658 179.658 176.826 2.832 25149
7567 1 20 . 1 1 50 50 LEU CA C 50 57.330 57.330 54.855 2.474 25149
7568 1 20 . 1 1 50 50 LEU CB C 50 41.416 41.416 42.126 -0.710 25149
7569 1 20 . 1 1 50 50 LEU H H 50 8.512 8.512 7.750 0.762 25149
7570 1 20 . 1 1 51 51 HIS N N 51 115.650 115.650 118.290 -2.640 25149
7571 1 20 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.508 -0.234 25149
7572 1 20 . 1 1 51 51 HIS C C 51 175.942 175.942 175.833 0.109 25149
7573 1 20 . 1 1 51 51 HIS CA C 51 57.320 57.320 56.444 0.876 25149
7574 1 20 . 1 1 51 51 HIS CB C 51 29.487 29.487 30.241 -0.754 25149
7575 1 20 . 1 1 51 51 HIS H H 51 7.713 7.713 8.308 -0.595 25149
7576 1 20 . 1 1 52 52 ALA N N 52 119.779 119.779 122.837 -3.058 25149
7577 1 20 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.283 -0.260 25149
7578 1 20 . 1 1 52 52 ALA C C 52 177.834 177.834 177.479 0.355 25149
7579 1 20 . 1 1 52 52 ALA CA C 52 52.865 52.865 53.171 -0.306 25149
7580 1 20 . 1 1 52 52 ALA CB C 52 18.951 18.951 19.357 -0.406 25149
7581 1 20 . 1 1 52 52 ALA H H 52 7.191 7.191 8.186 -0.995 25149
7582 1 20 . 1 1 53 53 GLN N N 53 117.047 117.047 118.080 -1.033 25149
7583 1 20 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.303 -0.370 25149
7584 1 20 . 1 1 53 53 GLN C C 53 175.998 175.998 174.920 1.078 25149
7585 1 20 . 1 1 53 53 GLN CA C 53 55.482 55.482 55.117 0.365 25149
7586 1 20 . 1 1 53 53 GLN CB C 53 28.887 28.887 29.708 -0.821 25149
7587 1 20 . 1 1 53 53 GLN H H 53 7.317 7.317 8.153 -0.836 25149
7588 1 20 . 1 1 54 54 GLN N N 54 118.463 118.463 118.172 0.291 25149
7589 1 20 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.502 -0.513 25149
7590 1 20 . 1 1 54 54 GLN C C 54 176.300 176.300 175.531 0.769 25149
7591 1 20 . 1 1 54 54 GLN CA C 54 57.314 57.314 56.095 1.219 25149
7592 1 20 . 1 1 54 54 GLN CB C 54 28.823 28.823 28.692 0.131 25149
7593 1 20 . 1 1 54 54 GLN H H 54 7.949 7.949 8.363 -0.414 25149
7594 1 20 . 1 1 55 55 VAL N N 55 116.755 116.755 117.911 -1.156 25149
7595 1 20 . 1 1 55 55 VAL HA H 55 3.884 3.884 4.165 -0.281 25149
7596 1 20 . 1 1 55 55 VAL C C 55 175.774 175.774 176.224 -0.450 25149
7597 1 20 . 1 1 55 55 VAL CA C 55 63.210 63.210 62.093 1.117 25149
7598 1 20 . 1 1 55 55 VAL CB C 55 32.870 32.870 31.571 1.299 25149
7599 1 20 . 1 1 55 55 VAL H H 55 7.801 7.801 7.803 -0.002 25149
7600 1 20 . 1 1 56 56 GLN N N 56 120.192 120.192 119.946 0.246 25149
7601 1 20 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.723 -0.606 25149
7602 1 20 . 1 1 56 56 GLN C C 56 175.236 175.236 175.710 -0.474 25149
7603 1 20 . 1 1 56 56 GLN CA C 56 55.697 55.697 55.178 0.519 25149
7604 1 20 . 1 1 56 56 GLN CB C 56 29.319 29.319 27.482 1.837 25149
7605 1 20 . 1 1 56 56 GLN H H 56 8.018 8.018 8.069 -0.051 25149
7606 1 20 . 1 1 57 57 GLN N N 57 121.276 121.276 120.766 0.510 25149
7607 1 20 . 1 1 57 57 GLN HA H 57 4.204 4.204 4.051 0.153 25149
7608 1 20 . 1 1 57 57 GLN C C 57 175.819 175.819 175.419 0.400 25149
7609 1 20 . 1 1 57 57 GLN CA C 57 55.617 55.617 55.986 -0.369 25149
7610 1 20 . 1 1 57 57 GLN CB C 57 29.094 29.094 29.258 -0.164 25149
7611 1 20 . 1 1 57 57 GLN H H 57 8.471 8.471 8.486 -0.015 25149
7612 1 20 . 1 1 58 58 HIS N N 58 120.001 120.001 119.630 0.371 25149
7613 1 20 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.394 0.780 25149
7614 1 20 . 1 1 58 58 HIS C C 58 173.636 173.636 175.695 -2.059 25149
7615 1 20 . 1 1 58 58 HIS CA C 58 54.353 54.353 57.299 -2.946 25149
7616 1 20 . 1 1 58 58 HIS CB C 58 33.057 33.057 29.513 3.544 25149
7617 1 20 . 1 1 58 58 HIS H H 58 8.366 8.366 7.791 0.575 25149
7618 1 20 . 1 1 59 59 CYS N N 59 121.924 121.924 122.803 -0.879 25149
7619 1 20 . 1 1 59 59 CYS HA H 59 4.442 4.442 3.928 0.514 25149
7620 1 20 . 1 1 59 59 CYS C C 59 176.334 176.334 174.867 1.467 25149
7621 1 20 . 1 1 59 59 CYS CA C 59 56.772 56.772 60.688 -3.916 25149
7622 1 20 . 1 1 59 59 CYS CB C 59 32.642 32.642 28.629 4.013 25149
7623 1 20 . 1 1 59 59 CYS H H 59 9.035 9.035 8.371 0.664 25149
7624 1 20 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.206 -0.393 25149
7625 1 20 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.762 -0.101 25149
7626 1 20 . 1 1 60 60 PRO CB C 60 30.659 30.659 31.346 -0.687 25149
7627 1 20 . 1 1 61 61 MET N N 61 117.676 117.676 115.926 1.750 25149
7628 1 20 . 1 1 61 61 MET HA H 61 4.317 4.317 4.315 0.002 25149
7629 1 20 . 1 1 61 61 MET C C 61 177.117 177.117 176.005 1.112 25149
7630 1 20 . 1 1 61 61 MET CA C 61 56.408 56.408 56.427 -0.019 25149
7631 1 20 . 1 1 61 61 MET CB C 61 32.551 32.551 33.184 -0.633 25149
7632 1 20 . 1 1 61 61 MET H H 61 9.135 9.135 7.515 1.620 25149
7633 1 20 . 1 1 62 62 CYS N N 62 117.214 117.214 117.050 0.164 25149
7634 1 20 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.505 0.369 25149
7635 1 20 . 1 1 62 62 CYS C C 62 175.740 175.740 174.917 0.823 25149
7636 1 20 . 1 1 62 62 CYS CA C 62 58.273 58.273 57.831 0.442 25149
7637 1 20 . 1 1 62 62 CYS CB C 62 32.776 32.776 30.309 2.467 25149
7638 1 20 . 1 1 62 62 CYS H H 62 8.011 8.011 7.462 0.549 25149
7639 1 20 . 1 1 63 63 ARG N N 63 116.555 116.555 117.954 -1.399 25149
7640 1 20 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.399 -0.474 25149
7641 1 20 . 1 1 63 63 ARG C C 63 175.326 175.326 175.340 -0.014 25149
7642 1 20 . 1 1 63 63 ARG CA C 63 58.073 58.073 56.014 2.059 25149
7643 1 20 . 1 1 63 63 ARG CB C 63 27.136 27.136 30.801 -3.665 25149
7644 1 20 . 1 1 63 63 ARG H H 63 8.086 8.086 8.278 -0.192 25149
7645 1 20 . 1 1 64 64 GLN N N 64 118.932 118.932 119.719 -0.787 25149
7646 1 20 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.446 -0.187 25149
7647 1 20 . 1 1 64 64 GLN C C 64 176.054 176.054 175.948 0.106 25149
7648 1 20 . 1 1 64 64 GLN CA C 64 56.316 56.316 54.988 1.328 25149
7649 1 20 . 1 1 64 64 GLN CB C 64 30.083 30.083 29.183 0.900 25149
7650 1 20 . 1 1 64 64 GLN H H 64 8.003 8.003 7.783 0.220 25149
7651 1 20 . 1 1 65 65 GLU N N 65 122.038 122.038 124.314 -2.276 25149
7652 1 20 . 1 1 65 65 GLU HA H 65 4.003 4.003 4.090 -0.087 25149
7653 1 20 . 1 1 65 65 GLU C C 65 176.781 176.781 176.141 0.640 25149
7654 1 20 . 1 1 65 65 GLU CA C 65 57.682 57.682 56.779 0.903 25149
7655 1 20 . 1 1 65 65 GLU CB C 65 29.900 29.900 29.978 -0.078 25149
7656 1 20 . 1 1 65 65 GLU H H 65 8.657 8.657 8.660 -0.003 25149
7657 1 20 . 1 1 66 66 TRP N N 66 125.730 125.730 129.464 -3.734 25149
7658 1 20 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.309 0.095 25149
7659 1 20 . 1 1 66 66 TRP C C 66 175.460 175.460 174.957 0.503 25149
7660 1 20 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.573 0.052 25149
7661 1 20 . 1 1 66 66 TRP CB C 66 29.358 29.358 29.760 -0.402 25149
7662 1 20 . 1 1 66 66 TRP H H 66 8.499 8.499 8.355 0.144 25149
7663 1 20 . 1 1 67 67 LYS N N 67 127.396 127.396 127.400 -0.004 25149
7664 1 20 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.050 -0.032 25149
7665 1 20 . 1 1 67 67 LYS C C 67 175.180 175.180 175.241 -0.061 25149
7666 1 20 . 1 1 67 67 LYS CA C 67 54.514 54.514 53.884 0.630 25149
7667 1 20 . 1 1 67 67 LYS CB C 67 36.231 36.231 34.314 1.917 25149
7668 1 20 . 1 1 67 67 LYS H H 67 6.930 6.930 8.480 -1.550 25149
7669 1 20 . 1 1 68 68 PHE N N 68 121.511 121.511 127.265 -5.754 25149
7670 1 20 . 1 1 68 68 PHE HA H 68 4.108 4.108 3.961 0.147 25149
7671 1 20 . 1 1 68 68 PHE C C 68 176.613 176.613 175.408 1.205 25149
7672 1 20 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.718 2.243 25149
7673 1 20 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.382 1.880 25149
7674 1 20 . 1 1 68 68 PHE H H 68 8.430 8.430 8.516 -0.086 25149
7675 1 20 . 1 1 69 69 LYS N N 69 124.210 124.210 122.139 2.071 25149
7676 1 20 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.004 -0.009 25149
7677 1 20 . 1 1 69 69 LYS C C 69 175.651 175.651 176.217 -0.566 25149
7678 1 20 . 1 1 69 69 LYS CA C 69 57.320 57.320 57.156 0.164 25149
7679 1 20 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.581 -0.220 25149
7680 1 20 . 1 1 69 69 LYS H H 69 8.738 8.738 7.937 0.801 25149
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 63 3.067 0.333 3.073 25149
2 1 1 "Average Difference" HA 72 0.391 0.139 0.368 25149
3 1 1 "Average Difference" C 63 1.193 -0.281 1.168 25149
4 1 1 "Average Difference" CA 68 1.467 -0.397 1.422 25149
5 1 1 "Average Difference" CB 63 1.512 -0.579 1.407 25149
6 1 1 "Average Difference" HN 63 0.645 -0.029 0.649 25149
7 1 2 "Average Difference" N 63 2.794 0.393 2.788 25149
8 1 2 "Average Difference" HA 72 0.373 0.132 0.351 25149
9 1 2 "Average Difference" C 63 1.229 -0.319 1.197 25149
10 1 2 "Average Difference" CA 68 1.463 -0.362 1.428 25149
11 1 2 "Average Difference" CB 63 1.590 -0.625 1.473 25149
12 1 2 "Average Difference" HN 63 0.655 -0.029 0.660 25149
13 1 3 "Average Difference" N 63 2.856 0.321 2.861 25149
14 1 3 "Average Difference" HA 72 0.361 0.127 0.340 25149
15 1 3 "Average Difference" C 63 1.323 -0.366 1.282 25149
16 1 3 "Average Difference" CA 68 1.519 -0.327 1.495 25149
17 1 3 "Average Difference" CB 63 1.651 -0.604 1.549 25149
18 1 3 "Average Difference" HN 63 0.660 0.026 0.665 25149
19 1 4 "Average Difference" N 63 2.841 0.457 2.826 25149
20 1 4 "Average Difference" HA 72 0.394 0.126 0.376 25149
21 1 4 "Average Difference" C 63 1.173 -0.310 1.140 25149
22 1 4 "Average Difference" CA 68 1.515 -0.391 1.475 25149
23 1 4 "Average Difference" CB 63 1.658 -0.604 1.556 25149
24 1 4 "Average Difference" HN 63 0.628 0.010 0.633 25149
25 1 5 "Average Difference" N 63 2.929 0.422 2.922 25149
26 1 5 "Average Difference" HA 72 0.366 0.117 0.350 25149
27 1 5 "Average Difference" C 63 1.183 -0.336 1.144 25149
28 1 5 "Average Difference" CA 68 1.365 -0.345 1.331 25149
29 1 5 "Average Difference" CB 63 1.523 -0.616 1.404 25149
30 1 5 "Average Difference" HN 63 0.632 0.029 0.637 25149
31 1 6 "Average Difference" N 63 2.678 0.369 2.674 25149
32 1 6 "Average Difference" HA 72 0.387 0.145 0.361 25149
33 1 6 "Average Difference" C 63 1.072 -0.351 1.021 25149
34 1 6 "Average Difference" CA 68 1.525 -0.489 1.455 25149
35 1 6 "Average Difference" CB 63 1.495 -0.587 1.386 25149
36 1 6 "Average Difference" HN 63 0.591 -0.030 0.595 25149
37 1 7 "Average Difference" N 63 2.750 0.398 2.742 25149
38 1 7 "Average Difference" HA 72 0.391 0.129 0.372 25149
39 1 7 "Average Difference" C 63 1.223 -0.283 1.199 25149
40 1 7 "Average Difference" CA 68 1.435 -0.362 1.399 25149
41 1 7 "Average Difference" CB 63 1.585 -0.670 1.448 25149
42 1 7 "Average Difference" HN 63 0.657 0.020 0.662 25149
43 1 8 "Average Difference" N 63 2.868 0.344 2.870 25149
44 1 8 "Average Difference" HA 72 0.382 0.124 0.363 25149
45 1 8 "Average Difference" C 63 1.278 -0.316 1.248 25149
46 1 8 "Average Difference" CA 68 1.477 -0.410 1.429 25149
47 1 8 "Average Difference" CB 63 1.684 -0.584 1.592 25149
48 1 8 "Average Difference" HN 63 0.652 -0.014 0.657 25149
49 1 9 "Average Difference" N 63 2.833 0.143 2.852 25149
50 1 9 "Average Difference" HA 72 0.390 0.121 0.374 25149
51 1 9 "Average Difference" C 63 1.240 -0.379 1.190 25149
52 1 9 "Average Difference" CA 68 1.581 -0.422 1.535 25149
53 1 9 "Average Difference" CB 63 1.649 -0.675 1.517 25149
54 1 9 "Average Difference" HN 63 0.621 0.012 0.626 25149
55 1 10 "Average Difference" N 63 2.767 0.216 2.781 25149
56 1 10 "Average Difference" HA 72 0.368 0.129 0.347 25149
57 1 10 "Average Difference" C 63 1.189 -0.260 1.170 25149
58 1 10 "Average Difference" CA 68 1.458 -0.263 1.445 25149
59 1 10 "Average Difference" CB 63 1.694 -0.715 1.548 25149
60 1 10 "Average Difference" HN 63 0.654 -0.003 0.659 25149
61 1 11 "Average Difference" N 63 3.092 0.072 3.116 25149
62 1 11 "Average Difference" HA 72 0.394 0.145 0.368 25149
63 1 11 "Average Difference" C 63 1.154 -0.296 1.125 25149
64 1 11 "Average Difference" CA 68 1.508 -0.281 1.492 25149
65 1 11 "Average Difference" CB 63 1.672 -0.586 1.578 25149
66 1 11 "Average Difference" HN 63 0.623 0.015 0.628 25149
67 1 12 "Average Difference" N 63 2.947 0.279 2.958 25149
68 1 12 "Average Difference" HA 72 0.383 0.127 0.364 25149
69 1 12 "Average Difference" C 63 1.160 -0.353 1.114 25149
70 1 12 "Average Difference" CA 68 1.551 -0.314 1.531 25149
71 1 12 "Average Difference" CB 63 1.542 -0.613 1.426 25149
72 1 12 "Average Difference" HN 63 0.619 -0.012 0.624 25149
73 1 13 "Average Difference" N 63 2.825 0.240 2.838 25149
74 1 13 "Average Difference" HA 72 0.357 0.138 0.331 25149
75 1 13 "Average Difference" C 63 1.159 -0.358 1.111 25149
76 1 13 "Average Difference" CA 68 1.386 -0.411 1.333 25149
77 1 13 "Average Difference" CB 63 1.599 -0.635 1.480 25149
78 1 13 "Average Difference" HN 63 0.621 0.009 0.626 25149
79 1 14 "Average Difference" N 63 2.834 0.099 2.855 25149
80 1 14 "Average Difference" HA 72 0.379 0.153 0.349 25149
81 1 14 "Average Difference" C 63 1.150 -0.328 1.111 25149
82 1 14 "Average Difference" CA 68 1.433 -0.396 1.387 25149
83 1 14 "Average Difference" CB 63 1.621 -0.614 1.512 25149
84 1 14 "Average Difference" HN 63 0.636 0.019 0.641 25149
85 1 15 "Average Difference" N 63 3.041 0.184 3.059 25149
86 1 15 "Average Difference" HA 72 0.395 0.127 0.377 25149
87 1 15 "Average Difference" C 63 1.182 -0.313 1.149 25149
88 1 15 "Average Difference" CA 68 1.611 -0.368 1.580 25149
89 1 15 "Average Difference" CB 63 1.639 -0.669 1.508 25149
90 1 15 "Average Difference" HN 63 0.634 0.038 0.638 25149
91 1 16 "Average Difference" N 63 2.874 0.564 2.841 25149
92 1 16 "Average Difference" HA 72 0.367 0.119 0.349 25149
93 1 16 "Average Difference" C 63 1.177 -0.296 1.149 25149
94 1 16 "Average Difference" CA 68 1.564 -0.288 1.549 25149
95 1 16 "Average Difference" CB 63 1.738 -0.718 1.596 25149
96 1 16 "Average Difference" HN 63 0.637 0.011 0.642 25149
97 1 17 "Average Difference" N 63 2.824 0.468 2.807 25149
98 1 17 "Average Difference" HA 72 0.401 0.136 0.380 25149
99 1 17 "Average Difference" C 63 1.181 -0.306 1.150 25149
100 1 17 "Average Difference" CA 68 1.570 -0.270 1.558 25149
101 1 17 "Average Difference" CB 63 1.622 -0.613 1.513 25149
102 1 17 "Average Difference" HN 63 0.672 0.012 0.677 25149
103 1 18 "Average Difference" N 63 2.921 0.384 2.919 25149
104 1 18 "Average Difference" HA 72 0.357 0.127 0.336 25149
105 1 18 "Average Difference" C 63 1.175 -0.274 1.152 25149
106 1 18 "Average Difference" CA 68 1.426 -0.353 1.392 25149
107 1 18 "Average Difference" CB 63 1.537 -0.650 1.404 25149
108 1 18 "Average Difference" HN 63 0.654 -0.004 0.659 25149
109 1 19 "Average Difference" N 63 3.205 0.438 3.200 25149
110 1 19 "Average Difference" HA 72 0.384 0.145 0.358 25149
111 1 19 "Average Difference" C 63 1.243 -0.414 1.182 25149
112 1 19 "Average Difference" CA 68 1.551 -0.411 1.507 25149
113 1 19 "Average Difference" CB 63 1.669 -0.614 1.565 25149
114 1 19 "Average Difference" HN 63 0.628 0.008 0.633 25149
115 1 20 "Average Difference" N 63 2.720 0.336 2.721 25149
116 1 20 "Average Difference" HA 72 0.365 0.123 0.346 25149
117 1 20 "Average Difference" C 63 1.184 -0.325 1.148 25149
118 1 20 "Average Difference" CA 68 1.423 -0.392 1.378 25149
119 1 20 "Average Difference" CB 63 1.630 -0.685 1.492 25149
120 1 20 "Average Difference" HN 63 0.631 0.004 0.636 25149
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 25149
_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 SER HA H 2 4.417 4.417 4.642 -0.225 25149
2 1 . 1 1 2 2 SER CA C 2 58.322 58.322 58.215 0.107 25149
3 1 . 1 1 2 2 SER CB C 2 64.169 64.169 63.817 0.351 25149
4 1 . 1 1 3 3 VAL N N 3 121.214 121.214 122.711 -1.497 25149
5 1 . 1 1 3 3 VAL HA H 3 4.046 4.046 4.222 -0.176 25149
6 1 . 1 1 3 3 VAL C C 3 175.879 175.879 175.176 0.703 25149
7 1 . 1 1 3 3 VAL CA C 3 62.138 62.138 62.192 -0.054 25149
8 1 . 1 1 3 3 VAL CB C 3 32.958 32.958 32.571 0.387 25149
9 1 . 1 1 3 3 VAL H H 3 8.170 8.170 8.065 0.105 25149
10 1 . 1 1 4 4 ALA N N 4 127.312 127.312 128.607 -1.295 25149
11 1 . 1 1 4 4 ALA HA H 4 4.197 4.197 4.527 -0.330 25149
12 1 . 1 1 4 4 ALA C C 4 177.497 177.497 176.320 1.177 25149
13 1 . 1 1 4 4 ALA CA C 4 52.439 52.439 51.766 0.673 25149
14 1 . 1 1 4 4 ALA CB C 4 19.424 19.424 19.657 -0.233 25149
15 1 . 1 1 4 4 ALA H H 4 8.294 8.294 8.323 -0.029 25149
16 1 . 1 1 5 5 ASN N N 5 117.674 117.674 120.716 -3.042 25149
17 1 . 1 1 5 5 ASN HA H 5 4.565 4.565 4.771 -0.206 25149
18 1 . 1 1 5 5 ASN C C 5 175.048 175.048 174.505 0.543 25149
19 1 . 1 1 5 5 ASN CA C 5 53.725 53.725 53.358 0.367 25149
20 1 . 1 1 5 5 ASN CB C 5 39.197 39.197 39.588 -0.391 25149
21 1 . 1 1 5 5 ASN H H 5 8.252 8.252 8.346 -0.094 25149
22 1 . 1 1 6 6 ASP N N 6 119.896 119.896 121.475 -1.579 25149
23 1 . 1 1 6 6 ASP HA H 6 4.520 4.520 4.664 -0.144 25149
24 1 . 1 1 6 6 ASP C C 6 176.269 176.269 175.866 0.403 25149
25 1 . 1 1 6 6 ASP CA C 6 54.497 54.497 54.148 0.349 25149
26 1 . 1 1 6 6 ASP CB C 6 41.104 41.104 41.207 -0.103 25149
27 1 . 1 1 6 6 ASP H H 6 8.215 8.215 8.646 -0.431 25149
28 1 . 1 1 7 7 GLU N N 7 119.101 119.101 117.309 1.792 25149
29 1 . 1 1 7 7 GLU HA H 7 4.243 4.243 4.277 -0.034 25149
30 1 . 1 1 7 7 GLU C C 7 175.006 175.006 174.777 0.229 25149
31 1 . 1 1 7 7 GLU CA C 7 56.689 56.689 56.461 0.229 25149
32 1 . 1 1 7 7 GLU CB C 7 30.379 30.379 29.321 1.058 25149
33 1 . 1 1 7 7 GLU H H 7 8.065 8.065 8.283 -0.218 25149
34 1 . 1 1 8 8 ASN N N 8 116.852 116.852 115.611 1.241 25149
35 1 . 1 1 8 8 ASN HA H 8 4.158 4.158 4.422 -0.264 25149
36 1 . 1 1 8 8 ASN C C 8 172.706 172.706 174.762 -2.056 25149
37 1 . 1 1 8 8 ASN CA C 8 51.165 51.165 51.274 -0.109 25149
38 1 . 1 1 8 8 ASN CB C 8 40.702 40.702 39.924 0.778 25149
39 1 . 1 1 8 8 ASN H H 8 7.505 7.505 7.503 0.002 25149
40 1 . 1 1 9 9 CYS N N 9 122.855 122.855 120.582 2.273 25149
41 1 . 1 1 9 9 CYS HA H 9 3.794 3.794 3.797 -0.003 25149
42 1 . 1 1 9 9 CYS C C 9 178.370 178.370 176.436 1.934 25149
43 1 . 1 1 9 9 CYS CA C 9 59.552 59.552 60.773 -1.221 25149
44 1 . 1 1 9 9 CYS CB C 9 31.526 31.526 28.746 2.780 25149
45 1 . 1 1 9 9 CYS H H 9 7.614 7.614 7.770 -0.156 25149
46 1 . 1 1 10 10 GLY N N 10 117.295 117.295 109.687 7.608 25149
47 1 . 1 1 10 10 GLY C C 10 174.111 174.111 174.647 -0.536 25149
48 1 . 1 1 10 10 GLY CA C 10 46.967 46.967 45.622 1.345 25149
49 1 . 1 1 10 10 GLY H H 10 9.235 9.235 7.871 1.364 25149
50 1 . 1 1 11 11 ILE N N 11 119.811 119.811 120.339 -0.528 25149
51 1 . 1 1 11 11 ILE HA H 11 3.809 3.809 4.095 -0.286 25149
52 1 . 1 1 11 11 ILE C C 11 176.121 176.121 176.404 -0.283 25149
53 1 . 1 1 11 11 ILE CA C 11 64.041 64.041 63.605 0.436 25149
54 1 . 1 1 11 11 ILE CB C 11 39.411 39.411 38.908 0.503 25149
55 1 . 1 1 11 11 ILE H H 11 8.285 8.285 7.550 0.735 25149
56 1 . 1 1 12 12 CYS N N 12 116.728 116.728 116.248 0.479 25149
57 1 . 1 1 12 12 CYS HA H 12 4.576 4.576 4.683 -0.107 25149
58 1 . 1 1 12 12 CYS C C 12 175.975 175.975 173.903 2.072 25149
59 1 . 1 1 12 12 CYS CA C 12 59.225 59.225 57.362 1.863 25149
60 1 . 1 1 12 12 CYS CB C 12 32.246 32.246 29.662 2.584 25149
61 1 . 1 1 12 12 CYS H H 12 7.607 7.607 7.705 -0.098 25149
62 1 . 1 1 13 13 ARG N N 13 116.073 116.073 117.229 -1.156 25149
63 1 . 1 1 13 13 ARG HA H 13 3.742 3.742 4.022 -0.280 25149
64 1 . 1 1 13 13 ARG C C 13 174.979 174.979 174.622 0.357 25149
65 1 . 1 1 13 13 ARG CA C 13 57.636 57.636 56.776 0.860 25149
66 1 . 1 1 13 13 ARG CB C 13 26.326 26.326 27.031 -0.705 25149
67 1 . 1 1 13 13 ARG H H 13 7.987 7.987 8.179 -0.192 25149
68 1 . 1 1 14 14 MET N N 14 119.313 119.313 118.539 0.774 25149
69 1 . 1 1 14 14 MET HA H 14 4.547 4.547 4.521 0.026 25149
70 1 . 1 1 14 14 MET C C 14 176.143 176.143 175.408 0.735 25149
71 1 . 1 1 14 14 MET CA C 14 54.208 54.208 54.073 0.135 25149
72 1 . 1 1 14 14 MET CB C 14 33.951 33.951 34.647 -0.696 25149
73 1 . 1 1 14 14 MET H H 14 8.624 8.624 7.589 1.035 25149
74 1 . 1 1 15 15 ALA N N 15 122.683 122.683 128.009 -5.326 25149
75 1 . 1 1 15 15 ALA HA H 15 4.272 4.272 4.173 0.099 25149
76 1 . 1 1 15 15 ALA C C 15 180.117 180.117 178.339 1.778 25149
77 1 . 1 1 15 15 ALA CA C 15 52.346 52.346 51.890 0.456 25149
78 1 . 1 1 15 15 ALA CB C 15 19.487 19.487 19.190 0.297 25149
79 1 . 1 1 15 15 ALA H H 15 7.965 7.965 8.368 -0.403 25149
80 1 . 1 1 16 16 PHE N N 16 119.313 119.313 121.629 -2.316 25149
81 1 . 1 1 16 16 PHE HA H 16 4.041 4.041 4.210 -0.169 25149
82 1 . 1 1 16 16 PHE C C 16 176.423 176.423 176.641 -0.218 25149
83 1 . 1 1 16 16 PHE CA C 16 59.130 59.130 59.541 -0.411 25149
84 1 . 1 1 16 16 PHE CB C 16 38.390 38.390 38.433 -0.044 25149
85 1 . 1 1 16 16 PHE H H 16 8.095 8.095 8.032 0.063 25149
86 1 . 1 1 17 17 ASN N N 17 112.313 112.313 116.324 -4.011 25149
87 1 . 1 1 17 17 ASN HA H 17 4.636 4.636 4.834 -0.198 25149
88 1 . 1 1 17 17 ASN C C 17 175.337 175.337 175.176 0.161 25149
89 1 . 1 1 17 17 ASN CA C 17 52.961 52.961 53.487 -0.526 25149
90 1 . 1 1 17 17 ASN CB C 17 37.174 37.174 38.723 -1.549 25149
91 1 . 1 1 17 17 ASN H H 17 7.823 7.823 8.180 -0.357 25149
92 1 . 1 1 18 18 GLY N N 18 107.742 107.742 107.687 0.055 25149
93 1 . 1 1 18 18 GLY C C 18 173.759 173.759 172.769 0.990 25149
94 1 . 1 1 18 18 GLY CA C 18 44.464 44.464 44.493 -0.029 25149
95 1 . 1 1 18 18 GLY H H 18 7.579 7.579 8.125 -0.545 25149
96 1 . 1 1 19 19 CYS N N 19 117.050 117.050 117.926 -0.876 25149
97 1 . 1 1 19 19 CYS HA H 19 4.571 4.571 4.751 -0.180 25149
98 1 . 1 1 19 19 CYS C C 19 174.039 174.039 174.694 -0.655 25149
99 1 . 1 1 19 19 CYS CA C 19 58.433 58.433 57.072 1.361 25149
100 1 . 1 1 19 19 CYS CB C 19 30.681 30.681 29.880 0.801 25149
101 1 . 1 1 19 19 CYS H H 19 8.198 8.198 8.216 -0.018 25149
102 1 . 1 1 20 20 CYS N N 20 123.923 123.923 121.236 2.687 25149
103 1 . 1 1 20 20 CYS HA H 20 4.011 4.011 4.334 -0.323 25149
104 1 . 1 1 20 20 CYS C C 20 173.736 173.736 174.477 -0.741 25149
105 1 . 1 1 20 20 CYS CA C 20 57.999 57.999 57.921 0.078 25149
106 1 . 1 1 20 20 CYS CB C 20 28.205 28.205 27.356 0.849 25149
107 1 . 1 1 20 20 CYS H H 20 8.466 8.466 8.567 -0.101 25149
108 1 . 1 1 21 21 PRO HA H 21 4.029 4.029 4.308 -0.279 25149
109 1 . 1 1 21 21 PRO CA C 21 65.426 65.426 64.615 0.811 25149
110 1 . 1 1 21 21 PRO CB C 21 32.801 32.801 32.074 0.727 25149
111 1 . 1 1 22 22 ASP N N 22 117.053 117.053 118.557 -1.504 25149
112 1 . 1 1 22 22 ASP HA H 22 4.505 4.505 4.498 0.007 25149
113 1 . 1 1 22 22 ASP C C 22 176.501 176.501 176.016 0.485 25149
114 1 . 1 1 22 22 ASP CA C 22 55.017 55.017 54.997 0.020 25149
115 1 . 1 1 22 22 ASP CB C 22 42.522 42.522 40.379 2.143 25149
116 1 . 1 1 22 22 ASP H H 22 8.395 8.395 8.518 -0.123 25149
117 1 . 1 1 23 23 CYS N N 23 123.353 123.353 118.760 4.593 25149
118 1 . 1 1 23 23 CYS HA H 23 4.293 4.293 4.348 -0.055 25149
119 1 . 1 1 23 23 CYS C C 23 175.214 175.214 174.706 0.508 25149
120 1 . 1 1 23 23 CYS CA C 23 61.633 61.633 59.120 2.513 25149
121 1 . 1 1 23 23 CYS CB C 23 31.542 31.542 28.640 2.902 25149
122 1 . 1 1 23 23 CYS H H 23 7.246 7.246 7.653 -0.407 25149
123 1 . 1 1 24 24 LYS N N 24 117.539 117.539 126.223 -8.684 25149
124 1 . 1 1 24 24 LYS HA H 24 4.230 4.230 4.253 -0.023 25149
125 1 . 1 1 24 24 LYS C C 24 177.106 177.106 175.797 1.309 25149
126 1 . 1 1 24 24 LYS CA C 24 56.921 56.921 56.357 0.564 25149
127 1 . 1 1 24 24 LYS CB C 24 34.615 34.615 32.146 2.469 25149
128 1 . 1 1 24 24 LYS H H 24 8.173 8.173 8.393 -0.220 25149
129 1 . 1 1 25 25 VAL N N 25 120.661 120.661 121.513 -0.852 25149
130 1 . 1 1 25 25 VAL HA H 25 4.429 4.429 4.132 0.297 25149
131 1 . 1 1 25 25 VAL C C 25 174.027 174.027 174.616 -0.589 25149
132 1 . 1 1 25 25 VAL CA C 25 59.934 59.934 60.907 -0.973 25149
133 1 . 1 1 25 25 VAL CB C 25 33.507 33.507 32.432 1.075 25149
134 1 . 1 1 25 25 VAL H H 25 7.787 7.787 7.783 0.004 25149
135 1 . 1 1 26 26 PRO HA H 26 4.336 4.336 4.469 -0.133 25149
136 1 . 1 1 26 26 PRO CA C 26 63.279 63.279 63.429 -0.150 25149
137 1 . 1 1 26 26 PRO CB C 26 32.077 32.077 31.764 0.313 25149
138 1 . 1 1 27 27 GLY N N 27 109.926 109.926 109.165 0.761 25149
139 1 . 1 1 27 27 GLY C C 27 175.169 175.169 173.464 1.705 25149
140 1 . 1 1 27 27 GLY CA C 27 45.042 45.042 45.184 -0.142 25149
141 1 . 1 1 27 27 GLY H H 27 8.569 8.569 7.926 0.643 25149
142 1 . 1 1 28 28 ASP N N 28 122.592 122.592 120.060 2.532 25149
143 1 . 1 1 28 28 ASP HA H 28 4.231 4.231 4.677 -0.446 25149
144 1 . 1 1 28 28 ASP C C 28 176.602 176.602 175.956 0.646 25149
145 1 . 1 1 28 28 ASP CA C 28 56.402 56.402 54.394 2.008 25149
146 1 . 1 1 28 28 ASP CB C 28 40.912 40.912 41.580 -0.668 25149
147 1 . 1 1 28 28 ASP H H 28 8.214 8.214 8.336 -0.122 25149
148 1 . 1 1 29 29 ASP N N 29 117.500 117.500 121.020 -3.520 25149
149 1 . 1 1 29 29 ASP HA H 29 4.447 4.447 4.656 -0.209 25149
150 1 . 1 1 29 29 ASP C C 29 175.505 175.505 175.598 -0.093 25149
151 1 . 1 1 29 29 ASP CA C 29 55.266 55.266 54.405 0.861 25149
152 1 . 1 1 29 29 ASP CB C 29 41.225 41.225 39.834 1.391 25149
153 1 . 1 1 29 29 ASP H H 29 8.271 8.271 8.409 -0.138 25149
154 1 . 1 1 30 30 CYS N N 30 124.470 124.470 120.706 3.764 25149
155 1 . 1 1 30 30 CYS HA H 30 4.390 4.390 4.788 -0.398 25149
156 1 . 1 1 30 30 CYS C C 30 171.755 171.755 173.077 -1.322 25149
157 1 . 1 1 30 30 CYS CA C 30 57.676 57.676 56.528 1.148 25149
158 1 . 1 1 30 30 CYS CB C 30 29.154 29.154 28.265 0.889 25149
159 1 . 1 1 30 30 CYS H H 30 7.912 7.912 8.250 -0.337 25149
160 1 . 1 1 31 31 PRO HA H 31 4.687 4.687 4.555 0.132 25149
161 1 . 1 1 31 31 PRO CA C 31 62.875 62.875 62.712 0.163 25149
162 1 . 1 1 31 31 PRO CB C 31 33.984 33.984 32.379 1.605 25149
163 1 . 1 1 32 32 LEU N N 32 120.023 120.023 116.770 3.253 25149
164 1 . 1 1 32 32 LEU HA H 32 4.716 4.716 4.566 0.151 25149
165 1 . 1 1 32 32 LEU C C 32 176.300 176.300 175.243 1.057 25149
166 1 . 1 1 32 32 LEU CA C 32 53.921 53.921 53.668 0.253 25149
167 1 . 1 1 32 32 LEU CB C 32 43.336 43.336 43.635 -0.299 25149
168 1 . 1 1 32 32 LEU H H 32 8.580 8.580 7.955 0.625 25149
169 1 . 1 1 33 33 VAL N N 33 116.217 116.217 118.098 -1.881 25149
170 1 . 1 1 33 33 VAL HA H 33 4.663 4.663 4.518 0.145 25149
171 1 . 1 1 33 33 VAL C C 33 171.374 171.374 174.029 -2.655 25149
172 1 . 1 1 33 33 VAL CA C 33 60.449 60.449 60.416 0.033 25149
173 1 . 1 1 33 33 VAL CB C 33 36.448 36.448 35.477 0.971 25149
174 1 . 1 1 33 33 VAL H H 33 8.594 8.594 8.154 0.440 25149
175 1 . 1 1 34 34 TRP N N 34 122.711 122.711 125.256 -2.545 25149
176 1 . 1 1 34 34 TRP HA H 34 5.339 5.339 5.080 0.259 25149
177 1 . 1 1 34 34 TRP C C 34 176.770 176.770 175.589 1.181 25149
178 1 . 1 1 34 34 TRP CA C 34 57.267 57.267 55.830 1.437 25149
179 1 . 1 1 34 34 TRP CB C 34 33.780 33.780 33.447 0.333 25149
180 1 . 1 1 34 34 TRP H H 34 8.756 8.756 8.606 0.150 25149
181 1 . 1 1 35 35 GLY N N 35 107.569 107.569 107.051 0.518 25149
182 1 . 1 1 35 35 GLY C C 35 177.397 177.397 174.139 3.258 25149
183 1 . 1 1 35 35 GLY CA C 35 44.070 44.070 44.072 -0.002 25149
184 1 . 1 1 35 35 GLY H H 35 8.857 8.857 8.504 0.353 25149
185 1 . 1 1 36 36 GLN N N 36 122.723 122.723 118.517 4.206 25149
186 1 . 1 1 36 36 GLN HA H 36 3.746 3.746 4.049 -0.302 25149
187 1 . 1 1 36 36 GLN C C 36 176.445 176.445 176.032 0.412 25149
188 1 . 1 1 36 36 GLN CA C 36 58.429 58.429 58.173 0.256 25149
189 1 . 1 1 36 36 GLN CB C 36 27.631 27.631 28.401 -0.770 25149
190 1 . 1 1 36 36 GLN H H 36 8.338 8.338 8.561 -0.223 25149
191 1 . 1 1 37 37 CYS N N 37 115.763 115.763 114.001 1.762 25149
192 1 . 1 1 37 37 CYS HA H 37 4.284 4.284 4.891 -0.607 25149
193 1 . 1 1 37 37 CYS C C 37 175.281 175.281 175.778 -0.497 25149
194 1 . 1 1 37 37 CYS CA C 37 58.395 58.395 55.820 2.575 25149
195 1 . 1 1 37 37 CYS CB C 37 31.143 31.143 31.166 -0.023 25149
196 1 . 1 1 37 37 CYS H H 37 7.622 7.622 7.672 -0.050 25149
197 1 . 1 1 38 38 SER N N 38 114.540 114.540 115.110 -0.570 25149
198 1 . 1 1 38 38 SER HA H 38 4.004 4.004 4.237 -0.233 25149
199 1 . 1 1 38 38 SER C C 38 173.389 173.389 174.299 -0.910 25149
200 1 . 1 1 38 38 SER CA C 38 62.285 62.285 60.402 1.883 25149
201 1 . 1 1 38 38 SER H H 38 7.716 7.716 8.533 -0.817 25149
202 1 . 1 1 39 39 HIS N N 39 121.947 121.947 120.542 1.405 25149
203 1 . 1 1 39 39 HIS HA H 39 4.444 4.444 4.350 0.094 25149
204 1 . 1 1 39 39 HIS C C 39 172.326 172.326 173.628 -1.302 25149
205 1 . 1 1 39 39 HIS CA C 39 61.320 61.320 56.965 4.355 25149
206 1 . 1 1 39 39 HIS CB C 39 31.523 31.523 29.769 1.754 25149
207 1 . 1 1 39 39 HIS H H 39 7.829 7.829 7.810 0.019 25149
208 1 . 1 1 40 40 CYS N N 40 121.859 121.859 123.826 -1.967 25149
209 1 . 1 1 40 40 CYS HA H 40 4.609 4.609 4.452 0.157 25149
210 1 . 1 1 40 40 CYS C C 40 171.900 171.900 172.299 -0.399 25149
211 1 . 1 1 40 40 CYS CA C 40 55.791 55.791 55.986 -0.195 25149
212 1 . 1 1 40 40 CYS CB C 40 28.964 28.964 28.205 0.759 25149
213 1 . 1 1 40 40 CYS H H 40 8.049 8.049 8.544 -0.495 25149
214 1 . 1 1 41 41 PHE N N 41 120.690 120.690 121.276 -0.586 25149
215 1 . 1 1 41 41 PHE HA H 41 5.177 5.177 4.626 0.551 25149
216 1 . 1 1 41 41 PHE C C 41 176.613 176.613 174.835 1.778 25149
217 1 . 1 1 41 41 PHE CA C 41 56.033 56.033 55.615 0.418 25149
218 1 . 1 1 41 41 PHE CB C 41 45.760 45.760 43.469 2.291 25149
219 1 . 1 1 41 41 PHE H H 41 8.368 8.368 8.421 -0.053 25149
220 1 . 1 1 42 42 HIS N N 42 117.057 117.057 121.843 -4.786 25149
221 1 . 1 1 42 42 HIS HA H 42 4.669 4.669 4.395 0.274 25149
222 1 . 1 1 42 42 HIS C C 42 177.464 177.464 176.230 1.234 25149
223 1 . 1 1 42 42 HIS CA C 42 60.425 60.425 57.368 3.057 25149
224 1 . 1 1 42 42 HIS CB C 42 29.740 29.740 29.716 0.024 25149
225 1 . 1 1 42 42 HIS H H 42 8.384 8.384 8.388 -0.004 25149
226 1 . 1 1 43 43 MET N N 43 128.543 128.543 125.961 2.582 25149
227 1 . 1 1 43 43 MET HA H 43 3.965 3.965 4.025 -0.060 25149
228 1 . 1 1 43 43 MET C C 43 177.845 177.845 177.378 0.467 25149
229 1 . 1 1 43 43 MET CA C 43 59.209 59.209 60.494 -1.285 25149
230 1 . 1 1 43 43 MET CB C 43 33.009 33.009 32.680 0.329 25149
231 1 . 1 1 43 43 MET H H 43 9.439 9.439 8.293 1.146 25149
232 1 . 1 1 44 44 HIS N N 44 116.500 116.500 117.416 -0.916 25149
233 1 . 1 1 44 44 HIS HA H 44 4.256 4.256 4.213 0.043 25149
234 1 . 1 1 44 44 HIS C C 44 178.405 178.405 177.836 0.569 25149
235 1 . 1 1 44 44 HIS CA C 44 58.793 58.793 59.070 -0.277 25149
236 1 . 1 1 44 44 HIS CB C 44 32.747 32.747 29.146 3.601 25149
237 1 . 1 1 44 44 HIS H H 44 9.747 9.747 8.016 1.731 25149
238 1 . 1 1 45 45 CYS N N 45 115.950 115.950 117.498 -1.548 25149
239 1 . 1 1 45 45 CYS HA H 45 4.000 4.000 4.156 -0.156 25149
240 1 . 1 1 45 45 CYS C C 45 177.957 177.957 177.006 0.951 25149
241 1 . 1 1 45 45 CYS CA C 45 62.923 62.923 63.509 -0.586 25149
242 1 . 1 1 45 45 CYS CB C 45 29.102 29.102 26.774 2.328 25149
243 1 . 1 1 45 45 CYS H H 45 6.845 6.845 8.206 -1.361 25149
244 1 . 1 1 46 46 ILE N N 46 119.362 119.362 121.251 -1.889 25149
245 1 . 1 1 46 46 ILE HA H 46 3.665 3.665 3.699 -0.034 25149
246 1 . 1 1 46 46 ILE C C 46 176.613 176.613 177.643 -1.030 25149
247 1 . 1 1 46 46 ILE CA C 46 60.242 60.242 64.513 -4.271 25149
248 1 . 1 1 46 46 ILE CB C 46 37.319 37.319 37.769 -0.450 25149
249 1 . 1 1 46 46 ILE H H 46 7.816 7.816 7.970 -0.154 25149
250 1 . 1 1 47 47 LEU N N 47 122.180 122.180 120.574 1.606 25149
251 1 . 1 1 47 47 LEU HA H 47 3.873 3.873 4.137 -0.264 25149
252 1 . 1 1 47 47 LEU C C 47 179.726 179.726 178.919 0.807 25149
253 1 . 1 1 47 47 LEU CA C 47 58.633 58.633 59.103 -0.470 25149
254 1 . 1 1 47 47 LEU CB C 47 41.123 41.123 41.886 -0.763 25149
255 1 . 1 1 47 47 LEU H H 47 8.266 8.266 8.632 -0.366 25149
256 1 . 1 1 48 48 LYS N N 48 118.251 118.251 118.539 -0.288 25149
257 1 . 1 1 48 48 LYS HA H 48 3.864 3.864 4.204 -0.340 25149
258 1 . 1 1 48 48 LYS C C 48 179.423 179.423 178.715 0.708 25149
259 1 . 1 1 48 48 LYS CA C 48 59.987 59.987 59.611 0.376 25149
260 1 . 1 1 48 48 LYS CB C 48 32.765 32.765 31.996 0.769 25149
261 1 . 1 1 48 48 LYS H H 48 7.147 7.147 8.384 -1.237 25149
262 1 . 1 1 49 49 TRP N N 49 120.745 120.745 120.943 -0.198 25149
263 1 . 1 1 49 49 TRP HA H 49 4.080 4.080 4.350 -0.270 25149
264 1 . 1 1 49 49 TRP C C 49 178.147 178.147 177.839 0.308 25149
265 1 . 1 1 49 49 TRP CA C 49 60.545 60.545 60.565 -0.020 25149
266 1 . 1 1 49 49 TRP CB C 49 29.415 29.415 29.218 0.197 25149
267 1 . 1 1 49 49 TRP H H 49 7.709 7.709 7.837 -0.128 25149
268 1 . 1 1 50 50 LEU N N 50 117.236 117.236 117.183 0.053 25149
269 1 . 1 1 50 50 LEU HA H 50 3.605 3.605 3.642 -0.037 25149
270 1 . 1 1 50 50 LEU C C 50 179.658 179.658 176.986 2.672 25149
271 1 . 1 1 50 50 LEU CA C 50 57.330 57.330 55.000 2.330 25149
272 1 . 1 1 50 50 LEU CB C 50 41.416 41.416 42.146 -0.730 25149
273 1 . 1 1 50 50 LEU H H 50 8.512 8.512 7.852 0.660 25149
274 1 . 1 1 51 51 HIS N N 51 115.650 115.650 117.820 -2.170 25149
275 1 . 1 1 51 51 HIS HA H 51 4.274 4.274 4.516 -0.242 25149
276 1 . 1 1 51 51 HIS C C 51 175.942 175.942 175.971 -0.029 25149
277 1 . 1 1 51 51 HIS CA C 51 57.320 57.320 56.990 0.330 25149
278 1 . 1 1 51 51 HIS CB C 51 29.487 29.487 30.233 -0.746 25149
279 1 . 1 1 51 51 HIS H H 51 7.713 7.713 8.365 -0.652 25149
280 1 . 1 1 52 52 ALA N N 52 119.779 119.779 121.682 -1.903 25149
281 1 . 1 1 52 52 ALA HA H 52 4.023 4.023 4.304 -0.281 25149
282 1 . 1 1 52 52 ALA C C 52 177.834 177.834 177.161 0.673 25149
283 1 . 1 1 52 52 ALA CA C 52 52.865 52.865 53.174 -0.309 25149
284 1 . 1 1 52 52 ALA CB C 52 18.951 18.951 19.698 -0.747 25149
285 1 . 1 1 52 52 ALA H H 52 7.191 7.191 7.935 -0.744 25149
286 1 . 1 1 53 53 GLN N N 53 117.047 117.047 117.505 -0.458 25149
287 1 . 1 1 53 53 GLN HA H 53 3.933 3.933 4.382 -0.449 25149
288 1 . 1 1 53 53 GLN C C 53 175.998 175.998 175.400 0.598 25149
289 1 . 1 1 53 53 GLN CA C 53 55.482 55.482 55.157 0.325 25149
290 1 . 1 1 53 53 GLN CB C 53 28.887 28.887 29.747 -0.860 25149
291 1 . 1 1 53 53 GLN H H 53 7.317 7.317 7.823 -0.506 25149
292 1 . 1 1 54 54 GLN N N 54 118.463 118.463 119.991 -1.528 25149
293 1 . 1 1 54 54 GLN HA H 54 3.989 3.989 4.307 -0.318 25149
294 1 . 1 1 54 54 GLN C C 54 176.300 176.300 176.252 0.048 25149
295 1 . 1 1 54 54 GLN CA C 54 57.314 57.314 56.133 1.181 25149
296 1 . 1 1 54 54 GLN CB C 54 28.823 28.823 28.795 0.028 25149
297 1 . 1 1 54 54 GLN H H 54 7.949 7.949 8.541 -0.592 25149
298 1 . 1 1 55 55 VAL N N 55 116.755 116.755 117.652 -0.897 25149
299 1 . 1 1 55 55 VAL HA H 55 3.884 3.884 3.948 -0.064 25149
300 1 . 1 1 55 55 VAL C C 55 175.774 175.774 176.016 -0.242 25149
301 1 . 1 1 55 55 VAL CA C 55 63.210 63.210 62.806 0.404 25149
302 1 . 1 1 55 55 VAL CB C 55 32.870 32.870 31.803 1.067 25149
303 1 . 1 1 55 55 VAL H H 55 7.801 7.801 7.682 0.119 25149
304 1 . 1 1 56 56 GLN N N 56 120.192 120.192 119.264 0.928 25149
305 1 . 1 1 56 56 GLN HA H 56 4.117 4.117 4.458 -0.341 25149
306 1 . 1 1 56 56 GLN C C 56 175.236 175.236 175.740 -0.504 25149
307 1 . 1 1 56 56 GLN CA C 56 55.697 55.697 55.777 -0.080 25149
308 1 . 1 1 56 56 GLN CB C 56 29.319 29.319 29.324 -0.005 25149
309 1 . 1 1 56 56 GLN H H 56 8.018 8.018 8.154 -0.136 25149
310 1 . 1 1 57 57 GLN N N 57 121.276 121.276 120.483 0.793 25149
311 1 . 1 1 57 57 GLN HA H 57 4.204 4.204 4.109 0.095 25149
312 1 . 1 1 57 57 GLN C C 57 175.819 175.819 175.684 0.135 25149
313 1 . 1 1 57 57 GLN CA C 57 55.617 55.617 56.052 -0.435 25149
314 1 . 1 1 57 57 GLN CB C 57 29.094 29.094 28.986 0.108 25149
315 1 . 1 1 57 57 GLN H H 57 8.471 8.471 8.612 -0.141 25149
316 1 . 1 1 58 58 HIS N N 58 120.001 120.001 119.331 0.670 25149
317 1 . 1 1 58 58 HIS HA H 58 5.174 5.174 4.424 0.750 25149
318 1 . 1 1 58 58 HIS C C 58 173.636 173.636 176.083 -2.447 25149
319 1 . 1 1 58 58 HIS CA C 58 54.353 54.353 57.342 -2.989 25149
320 1 . 1 1 58 58 HIS CB C 58 33.057 33.057 29.497 3.560 25149
321 1 . 1 1 58 58 HIS H H 58 8.366 8.366 7.914 0.452 25149
322 1 . 1 1 59 59 CYS N N 59 121.924 121.924 121.948 -0.024 25149
323 1 . 1 1 59 59 CYS HA H 59 4.442 4.442 4.089 0.353 25149
324 1 . 1 1 59 59 CYS C C 59 176.334 176.334 174.837 1.497 25149
325 1 . 1 1 59 59 CYS CA C 59 56.772 56.772 60.402 -3.630 25149
326 1 . 1 1 59 59 CYS CB C 59 32.642 32.642 28.322 4.320 25149
327 1 . 1 1 59 59 CYS H H 59 9.035 9.035 8.374 0.661 25149
328 1 . 1 1 60 60 PRO HA H 60 3.813 3.813 4.309 -0.496 25149
329 1 . 1 1 60 60 PRO CA C 60 64.661 64.661 64.749 -0.088 25149
330 1 . 1 1 60 60 PRO CB C 60 30.659 30.659 31.182 -0.523 25149
331 1 . 1 1 61 61 MET N N 61 117.676 117.676 115.682 1.994 25149
332 1 . 1 1 61 61 MET HA H 61 4.317 4.317 4.396 -0.079 25149
333 1 . 1 1 61 61 MET C C 61 177.117 177.117 176.216 0.901 25149
334 1 . 1 1 61 61 MET CA C 61 56.408 56.408 56.301 0.107 25149
335 1 . 1 1 61 61 MET CB C 61 32.551 32.551 32.940 -0.389 25149
336 1 . 1 1 61 61 MET H H 61 9.135 9.135 7.500 1.635 25149
337 1 . 1 1 62 62 CYS N N 62 117.214 117.214 118.682 -1.468 25149
338 1 . 1 1 62 62 CYS HA H 62 4.874 4.874 4.481 0.393 25149
339 1 . 1 1 62 62 CYS C C 62 175.740 175.740 175.338 0.402 25149
340 1 . 1 1 62 62 CYS CA C 62 58.273 58.273 58.408 -0.135 25149
341 1 . 1 1 62 62 CYS CB C 62 32.776 32.776 29.100 3.676 25149
342 1 . 1 1 62 62 CYS H H 62 8.011 8.011 7.793 0.218 25149
343 1 . 1 1 63 63 ARG N N 63 116.555 116.555 118.594 -2.039 25149
344 1 . 1 1 63 63 ARG HA H 63 3.925 3.925 4.321 -0.396 25149
345 1 . 1 1 63 63 ARG C C 63 175.326 175.326 175.551 -0.225 25149
346 1 . 1 1 63 63 ARG CA C 63 58.073 58.073 56.330 1.742 25149
347 1 . 1 1 63 63 ARG CB C 63 27.136 27.136 30.116 -2.980 25149
348 1 . 1 1 63 63 ARG H H 63 8.086 8.086 8.315 -0.229 25149
349 1 . 1 1 64 64 GLN N N 64 118.932 118.932 118.876 0.056 25149
350 1 . 1 1 64 64 GLN HA H 64 4.259 4.259 4.479 -0.220 25149
351 1 . 1 1 64 64 GLN C C 64 176.054 176.054 175.822 0.232 25149
352 1 . 1 1 64 64 GLN CA C 64 56.316 56.316 54.994 1.322 25149
353 1 . 1 1 64 64 GLN CB C 64 30.083 30.083 29.635 0.448 25149
354 1 . 1 1 64 64 GLN H H 64 8.003 8.003 7.879 0.124 25149
355 1 . 1 1 65 65 GLU N N 65 122.038 122.038 122.231 -0.193 25149
356 1 . 1 1 65 65 GLU HA H 65 4.003 4.003 4.105 -0.102 25149
357 1 . 1 1 65 65 GLU C C 65 176.781 176.781 176.301 0.480 25149
358 1 . 1 1 65 65 GLU CA C 65 57.682 57.682 56.574 1.108 25149
359 1 . 1 1 65 65 GLU CB C 65 29.900 29.900 29.331 0.569 25149
360 1 . 1 1 65 65 GLU H H 65 8.657 8.657 8.684 -0.027 25149
361 1 . 1 1 66 66 TRP N N 66 125.730 125.730 128.048 -2.318 25149
362 1 . 1 1 66 66 TRP HA H 66 4.404 4.404 4.285 0.119 25149
363 1 . 1 1 66 66 TRP C C 66 175.460 175.460 175.107 0.353 25149
364 1 . 1 1 66 66 TRP CA C 66 57.625 57.625 57.653 -0.029 25149
365 1 . 1 1 66 66 TRP CB C 66 29.358 29.358 29.926 -0.568 25149
366 1 . 1 1 66 66 TRP H H 66 8.499 8.499 8.210 0.289 25149
367 1 . 1 1 67 67 LYS N N 67 127.396 127.396 127.224 0.172 25149
368 1 . 1 1 67 67 LYS HA H 67 4.018 4.018 4.055 -0.037 25149
369 1 . 1 1 67 67 LYS C C 67 175.180 175.180 175.118 0.062 25149
370 1 . 1 1 67 67 LYS CA C 67 54.514 54.514 53.813 0.701 25149
371 1 . 1 1 67 67 LYS CB C 67 36.231 36.231 34.596 1.635 25149
372 1 . 1 1 67 67 LYS H H 67 6.930 6.930 8.504 -1.574 25149
373 1 . 1 1 68 68 PHE N N 68 121.511 121.511 125.913 -4.403 25149
374 1 . 1 1 68 68 PHE HA H 68 4.108 4.108 3.965 0.143 25149
375 1 . 1 1 68 68 PHE C C 68 176.613 176.613 175.475 1.138 25149
376 1 . 1 1 68 68 PHE CA C 68 59.961 59.961 57.682 2.279 25149
377 1 . 1 1 68 68 PHE CB C 68 39.262 39.262 37.595 1.667 25149
378 1 . 1 1 68 68 PHE H H 68 8.430 8.430 8.503 -0.073 25149
379 1 . 1 1 69 69 LYS N N 69 124.210 124.210 122.358 1.852 25149
380 1 . 1 1 69 69 LYS HA H 69 3.995 3.995 4.095 -0.100 25149
381 1 . 1 1 69 69 LYS C C 69 175.651 175.651 176.203 -0.552 25149
382 1 . 1 1 69 69 LYS CA C 69 57.320 57.320 57.063 0.257 25149
383 1 . 1 1 69 69 LYS CB C 69 33.361 33.361 33.592 -0.231 25149
384 1 . 1 1 69 69 LYS H H 69 8.738 8.738 8.047 0.691 25149
stop_
save_