data_25755
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25755
_Entry.PDB_ID 2N69
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 25755
_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 ASP HA H 2 4.251 4.251 4.256 -0.005 25755
2 1 1 . 1 1 2 2 ASP CA C 2 59.484 59.484 55.445 4.039 25755
3 1 1 . 1 1 2 2 ASP CB C 2 39.412 39.412 39.499 -0.087 25755
4 1 1 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.391 -0.046 25755
5 1 1 . 1 1 3 3 LYS CA C 3 57.556 57.556 55.982 1.574 25755
6 1 1 . 1 1 3 3 LYS CB C 3 32.593 32.593 33.160 -0.567 25755
7 1 1 . 1 1 4 4 CYS N N 4 117.049 117.049 118.514 -1.465 25755
8 1 1 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.868 -0.140 25755
9 1 1 . 1 1 4 4 CYS CA C 4 57.415 57.415 57.052 0.363 25755
10 1 1 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.617 12.226 25755
11 1 1 . 1 1 4 4 CYS H H 4 8.486 8.486 8.118 0.368 25755
12 1 1 . 1 1 5 5 LYS N N 5 118.790 118.790 120.852 -2.062 25755
13 1 1 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.756 0.815 25755
14 1 1 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.742 -0.452 25755
15 1 1 . 1 1 5 5 LYS CB C 5 34.606 34.606 34.600 0.006 25755
16 1 1 . 1 1 5 5 LYS H H 5 8.007 8.007 8.196 -0.189 25755
17 1 1 . 1 1 6 6 LYS N N 6 121.177 121.177 120.758 0.419 25755
18 1 1 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.590 0.195 25755
19 1 1 . 1 1 6 6 LYS CA C 6 55.542 55.542 55.877 -0.335 25755
20 1 1 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.424 1.478 25755
21 1 1 . 1 1 6 6 LYS H H 6 9.014 9.014 8.830 0.184 25755
22 1 1 . 1 1 7 7 VAL N N 7 127.629 127.629 124.502 3.127 25755
23 1 1 . 1 1 7 7 VAL HA H 7 4.026 4.026 3.998 0.028 25755
24 1 1 . 1 1 7 7 VAL CA C 7 63.988 63.988 63.157 0.831 25755
25 1 1 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.056 1.051 25755
26 1 1 . 1 1 7 7 VAL H H 7 8.837 8.837 8.633 0.204 25755
27 1 1 . 1 1 8 8 TYR N N 8 130.003 130.003 129.122 0.881 25755
28 1 1 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.714 -0.255 25755
29 1 1 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.431 0.289 25755
30 1 1 . 1 1 8 8 TYR CB C 8 36.018 36.018 37.918 -1.900 25755
31 1 1 . 1 1 8 8 TYR H H 8 9.251 9.251 8.221 1.030 25755
32 1 1 . 1 1 9 9 GLU N N 9 130.851 130.851 124.745 6.106 25755
33 1 1 . 1 1 9 9 GLU HA H 9 4.204 4.204 4.033 0.171 25755
34 1 1 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.716 -0.199 25755
35 1 1 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.414 -0.023 25755
36 1 1 . 1 1 9 9 GLU H H 9 9.072 9.072 8.404 0.668 25755
37 1 1 . 1 1 10 10 ASN N N 10 116.120 116.120 116.981 -0.861 25755
38 1 1 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.575 -0.137 25755
39 1 1 . 1 1 10 10 ASN CA C 10 54.587 54.587 52.999 1.587 25755
40 1 1 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.344 -0.066 25755
41 1 1 . 1 1 10 10 ASN H H 10 9.301 9.301 7.703 1.598 25755
42 1 1 . 1 1 11 11 TYR N N 11 122.436 122.436 120.716 1.720 25755
43 1 1 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.651 -0.457 25755
44 1 1 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.490 2.122 25755
45 1 1 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.939 -2.472 25755
46 1 1 . 1 1 11 11 TYR H H 11 7.550 7.550 7.579 -0.029 25755
47 1 1 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.528 -0.081 25755
48 1 1 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.530 -0.032 25755
49 1 1 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.653 -2.062 25755
50 1 1 . 1 1 13 13 VAL N N 13 124.506 124.506 121.876 2.630 25755
51 1 1 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.783 0.053 25755
52 1 1 . 1 1 13 13 VAL CA C 13 65.761 65.761 64.803 0.958 25755
53 1 1 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.375 0.205 25755
54 1 1 . 1 1 13 13 VAL H H 13 8.169 8.169 8.480 -0.311 25755
55 1 1 . 1 1 14 14 SER N N 14 116.625 116.625 117.208 -0.583 25755
56 1 1 . 1 1 14 14 SER HA H 14 4.206 4.206 4.425 -0.219 25755
57 1 1 . 1 1 14 14 SER CA C 14 61.194 61.194 61.859 -0.665 25755
58 1 1 . 1 1 14 14 SER CB C 14 62.041 62.041 62.591 -0.550 25755
59 1 1 . 1 1 14 14 SER H H 14 8.396 8.396 8.220 0.176 25755
60 1 1 . 1 1 15 15 LYS N N 15 120.843 120.843 122.124 -1.281 25755
61 1 1 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.027 0.173 25755
62 1 1 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.212 0.411 25755
63 1 1 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.047 0.140 25755
64 1 1 . 1 1 15 15 LYS H H 15 7.791 7.791 7.776 0.015 25755
65 1 1 . 1 1 16 16 CYS N N 16 115.949 115.949 117.709 -1.760 25755
66 1 1 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.696 0.197 25755
67 1 1 . 1 1 16 16 CYS CA C 16 56.570 56.570 61.303 -4.734 25755
68 1 1 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.932 14.505 25755
69 1 1 . 1 1 16 16 CYS H H 16 7.870 7.870 7.483 0.387 25755
70 1 1 . 1 1 17 17 GLN N N 17 117.241 117.241 117.268 -0.027 25755
71 1 1 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.091 0.183 25755
72 1 1 . 1 1 17 17 GLN CA C 17 56.937 56.937 57.172 -0.235 25755
73 1 1 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.639 0.548 25755
74 1 1 . 1 1 17 17 GLN H H 17 7.560 7.560 7.618 -0.058 25755
75 1 1 . 1 1 18 18 LEU N N 18 120.537 120.537 121.213 -0.676 25755
76 1 1 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.147 0.293 25755
77 1 1 . 1 1 18 18 LEU CA C 18 55.448 55.448 55.378 0.070 25755
78 1 1 . 1 1 18 18 LEU CB C 18 41.837 41.837 41.108 0.729 25755
79 1 1 . 1 1 18 18 LEU H H 18 7.369 7.369 7.362 0.007 25755
80 1 1 . 1 1 19 19 ARG N N 19 121.697 121.697 123.237 -1.540 25755
81 1 1 . 1 1 19 19 ARG HA H 19 4.299 4.299 4.072 0.227 25755
82 1 1 . 1 1 19 19 ARG CA C 19 57.836 57.836 58.636 -0.800 25755
83 1 1 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.359 0.033 25755
84 1 1 . 1 1 19 19 ARG H H 19 8.447 8.447 7.975 0.472 25755
85 1 1 . 1 1 20 20 ILE N N 20 116.439 116.439 116.848 -0.409 25755
86 1 1 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.055 0.079 25755
87 1 1 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.459 0.038 25755
88 1 1 . 1 1 20 20 ILE CB C 20 38.164 38.164 38.237 -0.073 25755
89 1 1 . 1 1 20 20 ILE H H 20 7.758 7.758 7.758 -0.000 25755
90 1 1 . 1 1 21 21 ALA N N 21 122.642 122.642 122.963 -0.321 25755
91 1 1 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.584 -0.202 25755
92 1 1 . 1 1 21 21 ALA CA C 21 52.395 52.395 51.573 0.822 25755
93 1 1 . 1 1 21 21 ALA CB C 21 20.098 20.098 19.707 0.391 25755
94 1 1 . 1 1 21 21 ALA H H 21 7.727 7.727 7.219 0.508 25755
95 1 1 . 1 1 22 22 ASN N N 22 116.616 116.616 121.275 -4.659 25755
96 1 1 . 1 1 22 22 ASN HA H 22 4.791 4.791 5.017 -0.226 25755
97 1 1 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.020 0.857 25755
98 1 1 . 1 1 22 22 ASN CB C 22 37.554 37.554 38.165 -0.611 25755
99 1 1 . 1 1 22 22 ASN H H 22 8.307 8.307 8.535 -0.228 25755
100 1 1 . 1 1 23 23 GLN N N 23 124.357 124.357 123.644 0.713 25755
101 1 1 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.332 -0.314 25755
102 1 1 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.252 1.396 25755
103 1 1 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.182 1.217 25755
104 1 1 . 1 1 23 23 GLN H H 23 8.542 8.542 8.325 0.217 25755
105 1 1 . 1 1 24 24 CYS N N 24 118.909 118.909 119.907 -0.998 25755
106 1 1 . 1 1 24 24 CYS HA H 24 4.284 4.284 3.958 0.326 25755
107 1 1 . 1 1 24 24 CYS CA C 24 58.406 58.406 62.938 -4.532 25755
108 1 1 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.879 11.897 25755
109 1 1 . 1 1 24 24 CYS H H 24 8.352 8.352 8.433 -0.081 25755
110 1 1 . 1 1 25 25 ASN N N 25 118.182 118.182 119.061 -0.879 25755
111 1 1 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.233 -0.345 25755
112 1 1 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.568 1.104 25755
113 1 1 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.370 2.403 25755
114 1 1 . 1 1 25 25 ASN H H 25 7.504 7.504 8.380 -0.876 25755
115 1 1 . 1 1 26 26 TYR N N 26 117.354 117.354 119.305 -1.951 25755
116 1 1 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.228 -0.263 25755
117 1 1 . 1 1 26 26 TYR CA C 26 62.162 62.162 60.596 1.566 25755
118 1 1 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.615 0.015 25755
119 1 1 . 1 1 26 26 TYR H H 26 7.322 7.322 7.565 -0.243 25755
120 1 1 . 1 1 27 27 ASP N N 27 119.874 119.874 120.257 -0.383 25755
121 1 1 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.346 0.309 25755
122 1 1 . 1 1 27 27 ASP CB C 27 40.590 40.590 40.787 -0.197 25755
123 1 1 . 1 1 27 27 ASP H H 27 9.218 9.218 8.152 1.066 25755
124 1 1 . 1 1 28 28 CYS N N 28 119.782 119.782 119.160 0.622 25755
125 1 1 . 1 1 28 28 CYS HA H 28 4.168 4.168 3.902 0.266 25755
126 1 1 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.730 -1.816 25755
127 1 1 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.197 10.748 25755
128 1 1 . 1 1 28 28 CYS H H 28 9.171 9.171 8.331 0.840 25755
129 1 1 . 1 1 29 29 LYS N N 29 119.663 119.663 118.922 0.741 25755
130 1 1 . 1 1 29 29 LYS HA H 29 4.137 4.137 4.019 0.118 25755
131 1 1 . 1 1 29 29 LYS CA C 29 59.781 59.781 59.134 0.647 25755
132 1 1 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.901 0.512 25755
133 1 1 . 1 1 29 29 LYS H H 29 7.546 7.546 7.520 0.026 25755
134 1 1 . 1 1 30 30 LEU N N 30 119.987 119.987 120.958 -0.971 25755
135 1 1 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.937 0.174 25755
136 1 1 . 1 1 30 30 LEU CA C 30 57.672 57.672 57.927 -0.255 25755
137 1 1 . 1 1 30 30 LEU CB C 30 42.379 42.379 42.251 0.128 25755
138 1 1 . 1 1 30 30 LEU H H 30 8.226 8.226 7.687 0.539 25755
139 1 1 . 1 1 31 31 ASP N N 31 116.853 116.853 116.097 0.756 25755
140 1 1 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.602 -0.056 25755
141 1 1 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.390 0.876 25755
142 1 1 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.137 -0.659 25755
143 1 1 . 1 1 31 31 ASP H H 31 9.019 9.019 7.821 1.198 25755
144 1 1 . 1 1 32 32 LYS N N 32 112.075 112.075 118.378 -6.303 25755
145 1 1 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.157 0.392 25755
146 1 1 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.536 -4.071 25755
147 1 1 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.593 -0.728 25755
148 1 1 . 1 1 32 32 LYS H H 32 6.639 6.639 8.194 -1.555 25755
149 1 1 . 1 1 33 33 HIS N N 33 112.955 112.955 114.577 -1.622 25755
150 1 1 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.133 0.490 25755
151 1 1 . 1 1 33 33 HIS CA C 33 56.486 56.486 55.244 1.242 25755
152 1 1 . 1 1 33 33 HIS CB C 33 25.694 25.694 28.358 -2.664 25755
153 1 1 . 1 1 33 33 HIS H H 33 7.065 7.065 8.072 -1.007 25755
154 1 1 . 1 1 34 34 ALA N N 34 120.177 120.177 119.451 0.726 25755
155 1 1 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.684 0.465 25755
156 1 1 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.449 -1.669 25755
157 1 1 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.633 -0.515 25755
158 1 1 . 1 1 34 34 ALA H H 34 7.716 7.716 7.090 0.626 25755
159 1 1 . 1 1 35 35 ARG N N 35 116.636 116.636 117.703 -1.067 25755
160 1 1 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.016 0.190 25755
161 1 1 . 1 1 35 35 ARG CA C 35 58.076 58.076 59.497 -1.421 25755
162 1 1 . 1 1 35 35 ARG CB C 35 30.717 30.717 30.704 0.013 25755
163 1 1 . 1 1 35 35 ARG H H 35 8.295 8.295 8.018 0.277 25755
164 1 1 . 1 1 36 36 SER N N 36 109.273 109.273 110.910 -1.637 25755
165 1 1 . 1 1 36 36 SER HA H 36 4.646 4.646 4.434 0.212 25755
166 1 1 . 1 1 36 36 SER CA C 36 57.703 57.703 58.151 -0.448 25755
167 1 1 . 1 1 36 36 SER CB C 36 65.425 65.425 65.269 0.156 25755
168 1 1 . 1 1 36 36 SER H H 36 8.026 8.026 7.962 0.064 25755
169 1 1 . 1 1 37 37 GLY N N 37 107.305 107.305 109.361 -2.056 25755
170 1 1 . 1 1 37 37 GLY CA C 37 47.152 47.152 44.821 2.331 25755
171 1 1 . 1 1 37 37 GLY H H 37 8.679 8.679 7.799 0.880 25755
172 1 1 . 1 1 38 38 GLU N N 38 119.065 119.065 122.137 -3.072 25755
173 1 1 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.545 -0.143 25755
174 1 1 . 1 1 38 38 GLU CA C 38 55.773 55.773 54.760 1.013 25755
175 1 1 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.943 -2.121 25755
176 1 1 . 1 1 38 38 GLU H H 38 8.351 8.351 8.817 -0.466 25755
177 1 1 . 1 1 39 39 CYS N N 39 121.636 121.636 118.354 3.282 25755
178 1 1 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.446 0.541 25755
179 1 1 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.580 -0.852 25755
180 1 1 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.720 16.299 25755
181 1 1 . 1 1 39 39 CYS H H 39 8.839 8.839 8.237 0.602 25755
182 1 1 . 1 1 40 40 PHE N N 40 121.987 121.987 120.051 1.936 25755
183 1 1 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.779 -0.009 25755
184 1 1 . 1 1 40 40 PHE CA C 40 56.969 56.969 56.553 0.416 25755
185 1 1 . 1 1 40 40 PHE CB C 40 43.760 43.760 42.850 0.910 25755
186 1 1 . 1 1 40 40 PHE H H 40 9.214 9.214 8.895 0.319 25755
187 1 1 . 1 1 41 41 TYR N N 41 121.905 121.905 119.279 2.626 25755
188 1 1 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.708 0.252 25755
189 1 1 . 1 1 41 41 TYR CA C 41 58.532 58.532 58.687 -0.154 25755
190 1 1 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.388 0.914 25755
191 1 1 . 1 1 41 41 TYR H H 41 8.557 8.557 8.735 -0.178 25755
192 1 1 . 1 1 42 42 ASP N N 42 123.133 123.133 120.432 2.701 25755
193 1 1 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.767 -0.014 25755
194 1 1 . 1 1 42 42 ASP CA C 42 52.426 52.426 52.043 0.383 25755
195 1 1 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.492 -0.872 25755
196 1 1 . 1 1 42 42 ASP H H 42 8.603 8.603 8.364 0.239 25755
197 1 1 . 1 1 43 43 GLU N N 43 118.012 118.012 118.494 -0.482 25755
198 1 1 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.101 0.108 25755
199 1 1 . 1 1 43 43 GLU CA C 43 58.865 58.865 59.376 -0.511 25755
200 1 1 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.447 -0.210 25755
201 1 1 . 1 1 43 43 GLU H H 43 9.081 9.081 8.792 0.289 25755
202 1 1 . 1 1 44 44 LYS N N 44 120.047 120.047 116.738 3.309 25755
203 1 1 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.336 0.108 25755
204 1 1 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.551 0.110 25755
205 1 1 . 1 1 44 44 LYS CB C 44 32.039 32.039 31.725 0.314 25755
206 1 1 . 1 1 44 44 LYS H H 44 8.162 8.162 8.491 -0.329 25755
207 1 1 . 1 1 45 45 ARG N N 45 113.453 113.453 115.385 -1.932 25755
208 1 1 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.071 -0.408 25755
209 1 1 . 1 1 45 45 ARG CA C 45 57.736 57.736 57.113 0.623 25755
210 1 1 . 1 1 45 45 ARG CB C 45 26.390 26.390 26.956 -0.566 25755
211 1 1 . 1 1 45 45 ARG H H 45 8.335 8.335 8.095 0.240 25755
212 1 1 . 1 1 46 46 ASN N N 46 118.207 118.207 117.628 0.579 25755
213 1 1 . 1 1 46 46 ASN HA H 46 4.982 4.982 5.021 -0.039 25755
214 1 1 . 1 1 46 46 ASN CA C 46 53.066 53.066 51.826 1.240 25755
215 1 1 . 1 1 46 46 ASN CB C 46 39.293 39.293 39.684 -0.391 25755
216 1 1 . 1 1 46 46 ASN H H 46 8.745 8.745 9.026 -0.281 25755
217 1 1 . 1 1 47 47 LEU N N 47 125.815 125.815 127.032 -1.217 25755
218 1 1 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.053 0.226 25755
219 1 1 . 1 1 47 47 LEU CA C 47 55.290 55.290 54.939 0.351 25755
220 1 1 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.599 1.706 25755
221 1 1 . 1 1 47 47 LEU H H 47 8.509 8.509 8.801 -0.292 25755
222 1 1 . 1 1 48 48 GLN N N 48 120.834 120.834 122.527 -1.693 25755
223 1 1 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.652 0.084 25755
224 1 1 . 1 1 48 48 GLN CA C 48 54.105 54.105 54.049 0.056 25755
225 1 1 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.617 -0.751 25755
226 1 1 . 1 1 48 48 GLN H H 48 8.589 8.589 8.922 -0.333 25755
227 1 1 . 1 1 49 49 CYS N N 49 121.829 121.829 122.977 -1.148 25755
228 1 1 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.598 0.260 25755
229 1 1 . 1 1 49 49 CYS CA C 49 54.955 54.955 58.522 -3.567 25755
230 1 1 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.476 12.969 25755
231 1 1 . 1 1 49 49 CYS H H 49 9.247 9.247 8.976 0.271 25755
232 1 1 . 1 1 50 50 ILE N N 50 129.010 129.010 129.976 -0.966 25755
233 1 1 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.393 -0.007 25755
234 1 1 . 1 1 50 50 ILE CA C 50 60.421 60.421 62.116 -1.695 25755
235 1 1 . 1 1 50 50 ILE CB C 50 38.404 38.404 38.772 -0.368 25755
236 1 1 . 1 1 50 50 ILE H H 50 8.787 8.787 7.917 0.870 25755
237 1 1 . 1 1 51 51 CYS N N 51 126.108 126.108 127.592 -1.484 25755
238 1 1 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.620 0.717 25755
239 1 1 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.562 -6.744 25755
240 1 1 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.593 6.389 25755
241 1 1 . 1 1 51 51 CYS H H 51 8.556 8.556 9.303 -0.747 25755
242 1 1 . 1 1 52 52 ASP N N 52 122.342 122.342 120.455 1.887 25755
243 1 1 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.840 0.673 25755
244 1 1 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.875 -1.292 25755
245 1 1 . 1 1 52 52 ASP CB C 52 42.831 42.831 42.989 -0.158 25755
246 1 1 . 1 1 52 52 ASP H H 52 8.826 8.826 8.468 0.358 25755
247 1 1 . 1 1 53 53 TYR N N 53 125.370 125.370 123.419 1.951 25755
248 1 1 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.629 -0.371 25755
249 1 1 . 1 1 53 53 TYR CA C 53 59.665 59.665 58.882 0.783 25755
250 1 1 . 1 1 53 53 TYR CB C 53 38.783 38.783 39.305 -0.522 25755
251 1 1 . 1 1 53 53 TYR H H 53 9.734 9.734 8.732 1.002 25755
252 1 1 . 1 1 54 54 CYS N N 54 120.418 120.418 121.168 -0.750 25755
253 1 1 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.441 0.053 25755
254 1 1 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.813 -4.670 25755
255 1 1 . 1 1 54 54 CYS CB C 54 44.382 44.382 29.037 15.345 25755
256 1 1 . 1 1 54 54 CYS H H 54 9.478 9.478 8.975 0.503 25755
257 1 1 . 1 1 55 55 GLU N N 55 121.097 121.097 120.154 0.943 25755
258 1 1 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.686 -0.374 25755
259 1 1 . 1 1 55 55 GLU CA C 55 56.010 56.010 55.960 0.050 25755
260 1 1 . 1 1 55 55 GLU CB C 55 31.014 31.014 31.149 -0.135 25755
261 1 1 . 1 1 55 55 GLU H H 55 8.423 8.423 8.011 0.412 25755
262 1 2 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.292 -0.041 25755
263 1 2 . 1 1 2 2 ASP CA C 2 59.484 59.484 54.313 5.171 25755
264 1 2 . 1 1 2 2 ASP CB C 2 39.412 39.412 40.327 -0.915 25755
265 1 2 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.104 0.241 25755
266 1 2 . 1 1 3 3 LYS CA C 3 57.556 57.556 57.520 0.036 25755
267 1 2 . 1 1 3 3 LYS CB C 3 32.593 32.593 33.009 -0.416 25755
268 1 2 . 1 1 4 4 CYS N N 4 117.049 117.049 117.561 -0.512 25755
269 1 2 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.861 -0.133 25755
270 1 2 . 1 1 4 4 CYS CA C 4 57.415 57.415 56.002 1.413 25755
271 1 2 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.423 12.420 25755
272 1 2 . 1 1 4 4 CYS H H 4 8.486 8.486 7.982 0.504 25755
273 1 2 . 1 1 5 5 LYS N N 5 118.790 118.790 120.889 -2.099 25755
274 1 2 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.836 0.735 25755
275 1 2 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.749 -0.459 25755
276 1 2 . 1 1 5 5 LYS CB C 5 34.606 34.606 34.719 -0.113 25755
277 1 2 . 1 1 5 5 LYS H H 5 8.007 8.007 8.228 -0.221 25755
278 1 2 . 1 1 6 6 LYS N N 6 121.177 121.177 120.501 0.676 25755
279 1 2 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.558 0.227 25755
280 1 2 . 1 1 6 6 LYS CA C 6 55.542 55.542 55.819 -0.277 25755
281 1 2 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.426 1.476 25755
282 1 2 . 1 1 6 6 LYS H H 6 9.014 9.014 8.831 0.183 25755
283 1 2 . 1 1 7 7 VAL N N 7 127.629 127.629 124.785 2.844 25755
284 1 2 . 1 1 7 7 VAL HA H 7 4.026 4.026 4.152 -0.126 25755
285 1 2 . 1 1 7 7 VAL CA C 7 63.988 63.988 61.546 2.442 25755
286 1 2 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.634 0.473 25755
287 1 2 . 1 1 7 7 VAL H H 7 8.837 8.837 8.572 0.265 25755
288 1 2 . 1 1 8 8 TYR N N 8 130.003 130.003 129.757 0.246 25755
289 1 2 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.751 -0.292 25755
290 1 2 . 1 1 8 8 TYR CA C 8 55.720 55.720 56.031 -0.311 25755
291 1 2 . 1 1 8 8 TYR CB C 8 36.018 36.018 38.599 -2.581 25755
292 1 2 . 1 1 8 8 TYR H H 8 9.251 9.251 8.281 0.970 25755
293 1 2 . 1 1 9 9 GLU N N 9 130.851 130.851 125.819 5.032 25755
294 1 2 . 1 1 9 9 GLU HA H 9 4.204 4.204 4.163 0.041 25755
295 1 2 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.072 0.445 25755
296 1 2 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.492 -0.101 25755
297 1 2 . 1 1 9 9 GLU H H 9 9.072 9.072 8.577 0.495 25755
298 1 2 . 1 1 10 10 ASN N N 10 116.120 116.120 116.866 -0.746 25755
299 1 2 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.665 -0.227 25755
300 1 2 . 1 1 10 10 ASN CA C 10 54.587 54.587 53.034 1.553 25755
301 1 2 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.874 -0.596 25755
302 1 2 . 1 1 10 10 ASN H H 10 9.301 9.301 7.663 1.638 25755
303 1 2 . 1 1 11 11 TYR N N 11 122.436 122.436 120.559 1.877 25755
304 1 2 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.712 -0.518 25755
305 1 2 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.406 2.206 25755
306 1 2 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.747 -2.280 25755
307 1 2 . 1 1 11 11 TYR H H 11 7.550 7.550 7.329 0.221 25755
308 1 2 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.576 -0.129 25755
309 1 2 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.707 -0.209 25755
310 1 2 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.725 -2.134 25755
311 1 2 . 1 1 13 13 VAL N N 13 124.506 124.506 122.398 2.108 25755
312 1 2 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.758 0.078 25755
313 1 2 . 1 1 13 13 VAL CA C 13 65.761 65.761 65.081 0.680 25755
314 1 2 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.624 -0.044 25755
315 1 2 . 1 1 13 13 VAL H H 13 8.169 8.169 8.425 -0.256 25755
316 1 2 . 1 1 14 14 SER N N 14 116.625 116.625 116.792 -0.167 25755
317 1 2 . 1 1 14 14 SER HA H 14 4.206 4.206 4.390 -0.184 25755
318 1 2 . 1 1 14 14 SER CA C 14 61.194 61.194 61.705 -0.511 25755
319 1 2 . 1 1 14 14 SER CB C 14 62.041 62.041 62.479 -0.438 25755
320 1 2 . 1 1 14 14 SER H H 14 8.396 8.396 8.303 0.093 25755
321 1 2 . 1 1 15 15 LYS N N 15 120.843 120.843 122.311 -1.468 25755
322 1 2 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.018 0.182 25755
323 1 2 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.322 0.301 25755
324 1 2 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.085 0.101 25755
325 1 2 . 1 1 15 15 LYS H H 15 7.791 7.791 7.682 0.109 25755
326 1 2 . 1 1 16 16 CYS N N 16 115.949 115.949 117.475 -1.526 25755
327 1 2 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.475 0.418 25755
328 1 2 . 1 1 16 16 CYS CA C 16 56.570 56.570 61.278 -4.707 25755
329 1 2 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.725 14.712 25755
330 1 2 . 1 1 16 16 CYS H H 16 7.870 7.870 7.520 0.350 25755
331 1 2 . 1 1 17 17 GLN N N 17 117.241 117.241 117.320 -0.079 25755
332 1 2 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.082 0.192 25755
333 1 2 . 1 1 17 17 GLN CA C 17 56.937 56.937 57.201 -0.264 25755
334 1 2 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.649 0.538 25755
335 1 2 . 1 1 17 17 GLN H H 17 7.560 7.560 7.691 -0.131 25755
336 1 2 . 1 1 18 18 LEU N N 18 120.537 120.537 121.603 -1.066 25755
337 1 2 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.150 0.290 25755
338 1 2 . 1 1 18 18 LEU CA C 18 55.448 55.448 55.167 0.281 25755
339 1 2 . 1 1 18 18 LEU CB C 18 41.837 41.837 41.060 0.777 25755
340 1 2 . 1 1 18 18 LEU H H 18 7.369 7.369 7.444 -0.075 25755
341 1 2 . 1 1 19 19 ARG N N 19 121.697 121.697 123.480 -1.783 25755
342 1 2 . 1 1 19 19 ARG HA H 19 4.299 4.299 4.046 0.253 25755
343 1 2 . 1 1 19 19 ARG CA C 19 57.836 57.836 58.397 -0.561 25755
344 1 2 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.039 0.353 25755
345 1 2 . 1 1 19 19 ARG H H 19 8.447 8.447 8.046 0.401 25755
346 1 2 . 1 1 20 20 ILE N N 20 116.439 116.439 116.340 0.099 25755
347 1 2 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.073 0.061 25755
348 1 2 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.320 0.177 25755
349 1 2 . 1 1 20 20 ILE CB C 20 38.164 38.164 38.171 -0.007 25755
350 1 2 . 1 1 20 20 ILE H H 20 7.758 7.758 7.748 0.010 25755
351 1 2 . 1 1 21 21 ALA N N 21 122.642 122.642 122.877 -0.235 25755
352 1 2 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.587 -0.205 25755
353 1 2 . 1 1 21 21 ALA CA C 21 52.395 52.395 51.663 0.732 25755
354 1 2 . 1 1 21 21 ALA CB C 21 20.098 20.098 19.799 0.299 25755
355 1 2 . 1 1 21 21 ALA H H 21 7.727 7.727 7.328 0.399 25755
356 1 2 . 1 1 22 22 ASN N N 22 116.616 116.616 121.943 -5.327 25755
357 1 2 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.900 -0.109 25755
358 1 2 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.355 0.522 25755
359 1 2 . 1 1 22 22 ASN CB C 22 37.554 37.554 38.026 -0.472 25755
360 1 2 . 1 1 22 22 ASN H H 22 8.307 8.307 8.552 -0.245 25755
361 1 2 . 1 1 23 23 GLN N N 23 124.357 124.357 123.243 1.114 25755
362 1 2 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.328 -0.310 25755
363 1 2 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.883 0.765 25755
364 1 2 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.804 0.595 25755
365 1 2 . 1 1 23 23 GLN H H 23 8.542 8.542 8.209 0.333 25755
366 1 2 . 1 1 24 24 CYS N N 24 118.909 118.909 119.414 -0.505 25755
367 1 2 . 1 1 24 24 CYS HA H 24 4.284 4.284 3.985 0.299 25755
368 1 2 . 1 1 24 24 CYS CA C 24 58.406 58.406 62.581 -4.175 25755
369 1 2 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.816 11.960 25755
370 1 2 . 1 1 24 24 CYS H H 24 8.352 8.352 8.566 -0.214 25755
371 1 2 . 1 1 25 25 ASN N N 25 118.182 118.182 119.844 -1.662 25755
372 1 2 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.226 -0.338 25755
373 1 2 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.696 0.976 25755
374 1 2 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.148 2.625 25755
375 1 2 . 1 1 25 25 ASN H H 25 7.504 7.504 8.460 -0.956 25755
376 1 2 . 1 1 26 26 TYR N N 26 117.354 117.354 120.246 -2.892 25755
377 1 2 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.166 -0.201 25755
378 1 2 . 1 1 26 26 TYR CA C 26 62.162 62.162 61.530 0.632 25755
379 1 2 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.704 -0.074 25755
380 1 2 . 1 1 26 26 TYR H H 26 7.322 7.322 7.544 -0.222 25755
381 1 2 . 1 1 27 27 ASP N N 27 119.874 119.874 120.091 -0.217 25755
382 1 2 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.358 0.297 25755
383 1 2 . 1 1 27 27 ASP CB C 27 40.590 40.590 40.810 -0.220 25755
384 1 2 . 1 1 27 27 ASP H H 27 9.218 9.218 8.145 1.073 25755
385 1 2 . 1 1 28 28 CYS N N 28 119.782 119.782 119.065 0.717 25755
386 1 2 . 1 1 28 28 CYS HA H 28 4.168 4.168 3.881 0.287 25755
387 1 2 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.673 -1.759 25755
388 1 2 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.163 10.782 25755
389 1 2 . 1 1 28 28 CYS H H 28 9.171 9.171 8.364 0.807 25755
390 1 2 . 1 1 29 29 LYS N N 29 119.663 119.663 118.390 1.273 25755
391 1 2 . 1 1 29 29 LYS HA H 29 4.137 4.137 3.869 0.268 25755
392 1 2 . 1 1 29 29 LYS CA C 29 59.781 59.781 58.966 0.815 25755
393 1 2 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.695 0.718 25755
394 1 2 . 1 1 29 29 LYS H H 29 7.546 7.546 7.426 0.120 25755
395 1 2 . 1 1 30 30 LEU N N 30 119.987 119.987 120.986 -0.999 25755
396 1 2 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.952 0.159 25755
397 1 2 . 1 1 30 30 LEU CA C 30 57.672 57.672 57.871 -0.199 25755
398 1 2 . 1 1 30 30 LEU CB C 30 42.379 42.379 41.421 0.958 25755
399 1 2 . 1 1 30 30 LEU H H 30 8.226 8.226 7.560 0.666 25755
400 1 2 . 1 1 31 31 ASP N N 31 116.853 116.853 117.230 -0.377 25755
401 1 2 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.638 -0.092 25755
402 1 2 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.644 0.622 25755
403 1 2 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.735 -1.257 25755
404 1 2 . 1 1 31 31 ASP H H 31 9.019 9.019 7.827 1.192 25755
405 1 2 . 1 1 32 32 LYS N N 32 112.075 112.075 118.637 -6.562 25755
406 1 2 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.177 0.372 25755
407 1 2 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.869 -4.404 25755
408 1 2 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.590 -0.725 25755
409 1 2 . 1 1 32 32 LYS H H 32 6.639 6.639 8.351 -1.712 25755
410 1 2 . 1 1 33 33 HIS N N 33 112.955 112.955 114.338 -1.383 25755
411 1 2 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.205 0.418 25755
412 1 2 . 1 1 33 33 HIS CA C 33 56.486 56.486 55.928 0.558 25755
413 1 2 . 1 1 33 33 HIS CB C 33 25.694 25.694 27.820 -2.126 25755
414 1 2 . 1 1 33 33 HIS H H 33 7.065 7.065 8.051 -0.986 25755
415 1 2 . 1 1 34 34 ALA N N 34 120.177 120.177 118.771 1.406 25755
416 1 2 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.716 0.433 25755
417 1 2 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.379 -1.600 25755
418 1 2 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.582 -0.464 25755
419 1 2 . 1 1 34 34 ALA H H 34 7.716 7.716 7.099 0.617 25755
420 1 2 . 1 1 35 35 ARG N N 35 116.636 116.636 117.030 -0.394 25755
421 1 2 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.104 0.102 25755
422 1 2 . 1 1 35 35 ARG CA C 35 58.076 58.076 58.232 -0.156 25755
423 1 2 . 1 1 35 35 ARG CB C 35 30.717 30.717 29.923 0.794 25755
424 1 2 . 1 1 35 35 ARG H H 35 8.295 8.295 8.004 0.291 25755
425 1 2 . 1 1 36 36 SER N N 36 109.273 109.273 111.724 -2.451 25755
426 1 2 . 1 1 36 36 SER HA H 36 4.646 4.646 4.407 0.239 25755
427 1 2 . 1 1 36 36 SER CA C 36 57.703 57.703 57.789 -0.086 25755
428 1 2 . 1 1 36 36 SER CB C 36 65.425 65.425 64.757 0.668 25755
429 1 2 . 1 1 36 36 SER H H 36 8.026 8.026 7.924 0.102 25755
430 1 2 . 1 1 37 37 GLY N N 37 107.305 107.305 110.821 -3.516 25755
431 1 2 . 1 1 37 37 GLY CA C 37 47.152 47.152 44.807 2.345 25755
432 1 2 . 1 1 37 37 GLY H H 37 8.679 8.679 7.783 0.896 25755
433 1 2 . 1 1 38 38 GLU N N 38 119.065 119.065 122.097 -3.032 25755
434 1 2 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.556 -0.154 25755
435 1 2 . 1 1 38 38 GLU CA C 38 55.773 55.773 54.743 1.030 25755
436 1 2 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.968 -2.146 25755
437 1 2 . 1 1 38 38 GLU H H 38 8.351 8.351 8.879 -0.528 25755
438 1 2 . 1 1 39 39 CYS N N 39 121.636 121.636 118.555 3.081 25755
439 1 2 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.316 0.671 25755
440 1 2 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.773 -1.045 25755
441 1 2 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.396 16.623 25755
442 1 2 . 1 1 39 39 CYS H H 39 8.839 8.839 8.313 0.526 25755
443 1 2 . 1 1 40 40 PHE N N 40 121.987 121.987 120.395 1.592 25755
444 1 2 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.790 -0.020 25755
445 1 2 . 1 1 40 40 PHE CA C 40 56.969 56.969 56.560 0.409 25755
446 1 2 . 1 1 40 40 PHE CB C 40 43.760 43.760 43.019 0.741 25755
447 1 2 . 1 1 40 40 PHE H H 40 9.214 9.214 8.812 0.402 25755
448 1 2 . 1 1 41 41 TYR N N 41 121.905 121.905 119.025 2.880 25755
449 1 2 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.633 0.327 25755
450 1 2 . 1 1 41 41 TYR CA C 41 58.532 58.532 59.019 -0.487 25755
451 1 2 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.262 1.040 25755
452 1 2 . 1 1 41 41 TYR H H 41 8.557 8.557 8.671 -0.114 25755
453 1 2 . 1 1 42 42 ASP N N 42 123.133 123.133 121.157 1.976 25755
454 1 2 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.835 -0.082 25755
455 1 2 . 1 1 42 42 ASP CA C 42 52.426 52.426 53.038 -0.612 25755
456 1 2 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.638 -1.018 25755
457 1 2 . 1 1 42 42 ASP H H 42 8.603 8.603 7.984 0.619 25755
458 1 2 . 1 1 43 43 GLU N N 43 118.012 118.012 119.715 -1.703 25755
459 1 2 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.130 0.079 25755
460 1 2 . 1 1 43 43 GLU CA C 43 58.865 58.865 58.791 0.074 25755
461 1 2 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.588 -0.351 25755
462 1 2 . 1 1 43 43 GLU H H 43 9.081 9.081 8.641 0.440 25755
463 1 2 . 1 1 44 44 LYS N N 44 120.047 120.047 117.405 2.642 25755
464 1 2 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.436 0.008 25755
465 1 2 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.432 0.229 25755
466 1 2 . 1 1 44 44 LYS CB C 44 32.039 32.039 32.742 -0.703 25755
467 1 2 . 1 1 44 44 LYS H H 44 8.162 8.162 7.772 0.390 25755
468 1 2 . 1 1 45 45 ARG N N 45 113.453 113.453 115.674 -2.221 25755
469 1 2 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.052 -0.389 25755
470 1 2 . 1 1 45 45 ARG CA C 45 57.736 57.736 56.858 0.879 25755
471 1 2 . 1 1 45 45 ARG CB C 45 26.390 26.390 27.485 -1.095 25755
472 1 2 . 1 1 45 45 ARG H H 45 8.335 8.335 7.729 0.606 25755
473 1 2 . 1 1 46 46 ASN N N 46 118.207 118.207 116.572 1.635 25755
474 1 2 . 1 1 46 46 ASN HA H 46 4.982 4.982 4.932 0.050 25755
475 1 2 . 1 1 46 46 ASN CA C 46 53.066 53.066 52.309 0.757 25755
476 1 2 . 1 1 46 46 ASN CB C 46 39.293 39.293 38.764 0.529 25755
477 1 2 . 1 1 46 46 ASN H H 46 8.745 8.745 8.245 0.500 25755
478 1 2 . 1 1 47 47 LEU N N 47 125.815 125.815 126.735 -0.920 25755
479 1 2 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.017 0.262 25755
480 1 2 . 1 1 47 47 LEU CA C 47 55.290 55.290 54.956 0.334 25755
481 1 2 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.368 1.938 25755
482 1 2 . 1 1 47 47 LEU H H 47 8.509 8.509 8.796 -0.287 25755
483 1 2 . 1 1 48 48 GLN N N 48 120.834 120.834 122.294 -1.460 25755
484 1 2 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.683 0.053 25755
485 1 2 . 1 1 48 48 GLN CA C 48 54.105 54.105 54.015 0.090 25755
486 1 2 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.471 -0.605 25755
487 1 2 . 1 1 48 48 GLN H H 48 8.589 8.589 8.903 -0.314 25755
488 1 2 . 1 1 49 49 CYS N N 49 121.829 121.829 122.833 -1.004 25755
489 1 2 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.563 0.295 25755
490 1 2 . 1 1 49 49 CYS CA C 49 54.955 54.955 59.195 -4.240 25755
491 1 2 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.678 12.767 25755
492 1 2 . 1 1 49 49 CYS H H 49 9.247 9.247 8.853 0.394 25755
493 1 2 . 1 1 50 50 ILE N N 50 129.010 129.010 130.345 -1.335 25755
494 1 2 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.514 -0.128 25755
495 1 2 . 1 1 50 50 ILE CA C 50 60.421 60.421 61.663 -1.242 25755
496 1 2 . 1 1 50 50 ILE CB C 50 38.404 38.404 39.338 -0.934 25755
497 1 2 . 1 1 50 50 ILE H H 50 8.787 8.787 8.353 0.434 25755
498 1 2 . 1 1 51 51 CYS N N 51 126.108 126.108 127.275 -1.167 25755
499 1 2 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.698 0.639 25755
500 1 2 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.711 -6.893 25755
501 1 2 . 1 1 51 51 CYS CB C 51 35.982 35.982 30.012 5.970 25755
502 1 2 . 1 1 51 51 CYS H H 51 8.556 8.556 9.080 -0.524 25755
503 1 2 . 1 1 52 52 ASP N N 52 122.342 122.342 120.457 1.885 25755
504 1 2 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.762 0.751 25755
505 1 2 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.319 -0.736 25755
506 1 2 . 1 1 52 52 ASP CB C 52 42.831 42.831 42.296 0.535 25755
507 1 2 . 1 1 52 52 ASP H H 52 8.826 8.826 8.581 0.245 25755
508 1 2 . 1 1 53 53 TYR N N 53 125.370 125.370 123.643 1.727 25755
509 1 2 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.624 -0.366 25755
510 1 2 . 1 1 53 53 TYR CA C 53 59.665 59.665 58.894 0.771 25755
511 1 2 . 1 1 53 53 TYR CB C 53 38.783 38.783 39.618 -0.835 25755
512 1 2 . 1 1 53 53 TYR H H 53 9.734 9.734 8.676 1.058 25755
513 1 2 . 1 1 54 54 CYS N N 54 120.418 120.418 121.661 -1.243 25755
514 1 2 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.503 -0.009 25755
515 1 2 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.679 -4.536 25755
516 1 2 . 1 1 54 54 CYS CB C 54 44.382 44.382 28.763 15.619 25755
517 1 2 . 1 1 54 54 CYS H H 54 9.478 9.478 8.961 0.517 25755
518 1 2 . 1 1 55 55 GLU N N 55 121.097 121.097 118.420 2.677 25755
519 1 2 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.663 -0.351 25755
520 1 2 . 1 1 55 55 GLU CA C 55 56.010 56.010 56.136 -0.126 25755
521 1 2 . 1 1 55 55 GLU CB C 55 31.014 31.014 32.511 -1.497 25755
522 1 2 . 1 1 55 55 GLU H H 55 8.423 8.423 8.079 0.344 25755
523 1 3 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.936 -0.685 25755
524 1 3 . 1 1 2 2 ASP CA C 2 59.484 59.484 54.150 5.334 25755
525 1 3 . 1 1 2 2 ASP CB C 2 39.412 39.412 40.725 -1.313 25755
526 1 3 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.398 -0.053 25755
527 1 3 . 1 1 3 3 LYS CA C 3 57.556 57.556 56.227 1.329 25755
528 1 3 . 1 1 3 3 LYS CB C 3 32.593 32.593 32.740 -0.147 25755
529 1 3 . 1 1 4 4 CYS N N 4 117.049 117.049 120.403 -3.354 25755
530 1 3 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.828 -0.100 25755
531 1 3 . 1 1 4 4 CYS CA C 4 57.415 57.415 57.790 -0.375 25755
532 1 3 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.208 12.635 25755
533 1 3 . 1 1 4 4 CYS H H 4 8.486 8.486 8.283 0.203 25755
534 1 3 . 1 1 5 5 LYS N N 5 118.790 118.790 120.983 -2.193 25755
535 1 3 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.879 0.692 25755
536 1 3 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.537 -0.247 25755
537 1 3 . 1 1 5 5 LYS CB C 5 34.606 34.606 35.223 -0.617 25755
538 1 3 . 1 1 5 5 LYS H H 5 8.007 8.007 8.331 -0.324 25755
539 1 3 . 1 1 6 6 LYS N N 6 121.177 121.177 120.830 0.347 25755
540 1 3 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.586 0.199 25755
541 1 3 . 1 1 6 6 LYS CA C 6 55.542 55.542 55.802 -0.260 25755
542 1 3 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.426 1.476 25755
543 1 3 . 1 1 6 6 LYS H H 6 9.014 9.014 8.813 0.201 25755
544 1 3 . 1 1 7 7 VAL N N 7 127.629 127.629 125.101 2.528 25755
545 1 3 . 1 1 7 7 VAL HA H 7 4.026 4.026 4.034 -0.008 25755
546 1 3 . 1 1 7 7 VAL CA C 7 63.988 63.988 63.597 0.391 25755
547 1 3 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.215 0.892 25755
548 1 3 . 1 1 7 7 VAL H H 7 8.837 8.837 8.638 0.199 25755
549 1 3 . 1 1 8 8 TYR N N 8 130.003 130.003 129.316 0.687 25755
550 1 3 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.723 -0.264 25755
551 1 3 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.420 0.300 25755
552 1 3 . 1 1 8 8 TYR CB C 8 36.018 36.018 37.438 -1.419 25755
553 1 3 . 1 1 8 8 TYR H H 8 9.251 9.251 8.344 0.907 25755
554 1 3 . 1 1 9 9 GLU N N 9 130.851 130.851 124.031 6.820 25755
555 1 3 . 1 1 9 9 GLU HA H 9 4.204 4.204 3.979 0.225 25755
556 1 3 . 1 1 9 9 GLU CA C 9 58.517 58.517 59.023 -0.506 25755
557 1 3 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.516 -0.125 25755
558 1 3 . 1 1 9 9 GLU H H 9 9.072 9.072 8.457 0.615 25755
559 1 3 . 1 1 10 10 ASN N N 10 116.120 116.120 117.745 -1.625 25755
560 1 3 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.577 -0.139 25755
561 1 3 . 1 1 10 10 ASN CA C 10 54.587 54.587 52.849 1.738 25755
562 1 3 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.295 -0.017 25755
563 1 3 . 1 1 10 10 ASN H H 10 9.301 9.301 7.886 1.415 25755
564 1 3 . 1 1 11 11 TYR N N 11 122.436 122.436 121.159 1.277 25755
565 1 3 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.608 -0.414 25755
566 1 3 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.472 2.140 25755
567 1 3 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.736 -2.269 25755
568 1 3 . 1 1 11 11 TYR H H 11 7.550 7.550 7.644 -0.094 25755
569 1 3 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.515 -0.068 25755
570 1 3 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.539 -0.041 25755
571 1 3 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.496 -1.905 25755
572 1 3 . 1 1 13 13 VAL N N 13 124.506 124.506 122.786 1.720 25755
573 1 3 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.729 0.107 25755
574 1 3 . 1 1 13 13 VAL CA C 13 65.761 65.761 64.852 0.909 25755
575 1 3 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.312 0.268 25755
576 1 3 . 1 1 13 13 VAL H H 13 8.169 8.169 8.483 -0.314 25755
577 1 3 . 1 1 14 14 SER N N 14 116.625 116.625 117.017 -0.392 25755
578 1 3 . 1 1 14 14 SER HA H 14 4.206 4.206 4.380 -0.174 25755
579 1 3 . 1 1 14 14 SER CA C 14 61.194 61.194 62.298 -1.105 25755
580 1 3 . 1 1 14 14 SER CB C 14 62.041 62.041 62.712 -0.671 25755
581 1 3 . 1 1 14 14 SER H H 14 8.396 8.396 8.235 0.161 25755
582 1 3 . 1 1 15 15 LYS N N 15 120.843 120.843 121.620 -0.777 25755
583 1 3 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.013 0.187 25755
584 1 3 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.106 0.517 25755
585 1 3 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.024 0.162 25755
586 1 3 . 1 1 15 15 LYS H H 15 7.791 7.791 7.671 0.120 25755
587 1 3 . 1 1 16 16 CYS N N 16 115.949 115.949 117.860 -1.911 25755
588 1 3 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.475 0.418 25755
589 1 3 . 1 1 16 16 CYS CA C 16 56.570 56.570 61.468 -4.898 25755
590 1 3 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.655 14.782 25755
591 1 3 . 1 1 16 16 CYS H H 16 7.870 7.870 7.509 0.361 25755
592 1 3 . 1 1 17 17 GLN N N 17 117.241 117.241 117.525 -0.284 25755
593 1 3 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.055 0.219 25755
594 1 3 . 1 1 17 17 GLN CA C 17 56.937 56.937 57.543 -0.606 25755
595 1 3 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.629 0.558 25755
596 1 3 . 1 1 17 17 GLN H H 17 7.560 7.560 7.703 -0.143 25755
597 1 3 . 1 1 18 18 LEU N N 18 120.537 120.537 121.512 -0.975 25755
598 1 3 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.124 0.316 25755
599 1 3 . 1 1 18 18 LEU CA C 18 55.448 55.448 54.961 0.487 25755
600 1 3 . 1 1 18 18 LEU CB C 18 41.837 41.837 40.889 0.949 25755
601 1 3 . 1 1 18 18 LEU H H 18 7.369 7.369 7.348 0.021 25755
602 1 3 . 1 1 19 19 ARG N N 19 121.697 121.697 120.973 0.724 25755
603 1 3 . 1 1 19 19 ARG HA H 19 4.299 4.299 3.967 0.332 25755
604 1 3 . 1 1 19 19 ARG CA C 19 57.836 57.836 58.603 -0.767 25755
605 1 3 . 1 1 19 19 ARG CB C 19 30.392 30.392 29.925 0.467 25755
606 1 3 . 1 1 19 19 ARG H H 19 8.447 8.447 7.940 0.507 25755
607 1 3 . 1 1 20 20 ILE N N 20 116.439 116.439 118.972 -2.533 25755
608 1 3 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.044 0.090 25755
609 1 3 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.182 0.315 25755
610 1 3 . 1 1 20 20 ILE CB C 20 38.164 38.164 37.196 0.968 25755
611 1 3 . 1 1 20 20 ILE H H 20 7.758 7.758 7.886 -0.128 25755
612 1 3 . 1 1 21 21 ALA N N 21 122.642 122.642 123.218 -0.576 25755
613 1 3 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.483 -0.101 25755
614 1 3 . 1 1 21 21 ALA CA C 21 52.395 52.395 50.860 1.535 25755
615 1 3 . 1 1 21 21 ALA CB C 21 20.098 20.098 17.920 2.178 25755
616 1 3 . 1 1 21 21 ALA H H 21 7.727 7.727 7.870 -0.143 25755
617 1 3 . 1 1 22 22 ASN N N 22 116.616 116.616 120.851 -4.235 25755
618 1 3 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.791 -0.000 25755
619 1 3 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.793 0.084 25755
620 1 3 . 1 1 22 22 ASN CB C 22 37.554 37.554 38.208 -0.654 25755
621 1 3 . 1 1 22 22 ASN H H 22 8.307 8.307 8.433 -0.126 25755
622 1 3 . 1 1 23 23 GLN N N 23 124.357 124.357 123.290 1.067 25755
623 1 3 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.264 -0.246 25755
624 1 3 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.651 0.997 25755
625 1 3 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.487 0.912 25755
626 1 3 . 1 1 23 23 GLN H H 23 8.542 8.542 8.200 0.342 25755
627 1 3 . 1 1 24 24 CYS N N 24 118.909 118.909 118.786 0.123 25755
628 1 3 . 1 1 24 24 CYS HA H 24 4.284 4.284 3.973 0.311 25755
629 1 3 . 1 1 24 24 CYS CA C 24 58.406 58.406 62.758 -4.352 25755
630 1 3 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.936 11.840 25755
631 1 3 . 1 1 24 24 CYS H H 24 8.352 8.352 8.752 -0.400 25755
632 1 3 . 1 1 25 25 ASN N N 25 118.182 118.182 119.153 -0.971 25755
633 1 3 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.276 -0.388 25755
634 1 3 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.540 1.132 25755
635 1 3 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.273 2.500 25755
636 1 3 . 1 1 25 25 ASN H H 25 7.504 7.504 8.454 -0.950 25755
637 1 3 . 1 1 26 26 TYR N N 26 117.354 117.354 119.342 -1.988 25755
638 1 3 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.192 -0.227 25755
639 1 3 . 1 1 26 26 TYR CA C 26 62.162 62.162 61.255 0.907 25755
640 1 3 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.700 -0.070 25755
641 1 3 . 1 1 26 26 TYR H H 26 7.322 7.322 7.629 -0.307 25755
642 1 3 . 1 1 27 27 ASP N N 27 119.874 119.874 120.168 -0.294 25755
643 1 3 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.331 0.324 25755
644 1 3 . 1 1 27 27 ASP CB C 27 40.590 40.590 40.812 -0.222 25755
645 1 3 . 1 1 27 27 ASP H H 27 9.218 9.218 8.183 1.035 25755
646 1 3 . 1 1 28 28 CYS N N 28 119.782 119.782 119.065 0.717 25755
647 1 3 . 1 1 28 28 CYS HA H 28 4.168 4.168 3.874 0.294 25755
648 1 3 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.671 -1.757 25755
649 1 3 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.184 10.761 25755
650 1 3 . 1 1 28 28 CYS H H 28 9.171 9.171 8.328 0.843 25755
651 1 3 . 1 1 29 29 LYS N N 29 119.663 119.663 118.567 1.096 25755
652 1 3 . 1 1 29 29 LYS HA H 29 4.137 4.137 3.889 0.248 25755
653 1 3 . 1 1 29 29 LYS CA C 29 59.781 59.781 59.030 0.751 25755
654 1 3 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.708 0.705 25755
655 1 3 . 1 1 29 29 LYS H H 29 7.546 7.546 7.466 0.080 25755
656 1 3 . 1 1 30 30 LEU N N 30 119.987 119.987 120.222 -0.235 25755
657 1 3 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.765 0.346 25755
658 1 3 . 1 1 30 30 LEU CA C 30 57.672 57.672 57.595 0.077 25755
659 1 3 . 1 1 30 30 LEU CB C 30 42.379 42.379 41.181 1.198 25755
660 1 3 . 1 1 30 30 LEU H H 30 8.226 8.226 7.546 0.680 25755
661 1 3 . 1 1 31 31 ASP N N 31 116.853 116.853 116.316 0.537 25755
662 1 3 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.654 -0.108 25755
663 1 3 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.602 0.664 25755
664 1 3 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.343 -0.865 25755
665 1 3 . 1 1 31 31 ASP H H 31 9.019 9.019 7.693 1.326 25755
666 1 3 . 1 1 32 32 LYS N N 32 112.075 112.075 118.422 -6.347 25755
667 1 3 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.114 0.435 25755
668 1 3 . 1 1 32 32 LYS CA C 32 53.465 53.465 58.034 -4.569 25755
669 1 3 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.603 -0.738 25755
670 1 3 . 1 1 32 32 LYS H H 32 6.639 6.639 8.265 -1.626 25755
671 1 3 . 1 1 33 33 HIS N N 33 112.955 112.955 114.280 -1.325 25755
672 1 3 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.162 0.461 25755
673 1 3 . 1 1 33 33 HIS CA C 33 56.486 56.486 55.507 0.979 25755
674 1 3 . 1 1 33 33 HIS CB C 33 25.694 25.694 28.315 -2.621 25755
675 1 3 . 1 1 33 33 HIS H H 33 7.065 7.065 8.108 -1.043 25755
676 1 3 . 1 1 34 34 ALA N N 34 120.177 120.177 119.173 1.004 25755
677 1 3 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.722 0.427 25755
678 1 3 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.424 -1.645 25755
679 1 3 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.716 -0.598 25755
680 1 3 . 1 1 34 34 ALA H H 34 7.716 7.716 7.136 0.580 25755
681 1 3 . 1 1 35 35 ARG N N 35 116.636 116.636 117.813 -1.177 25755
682 1 3 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.226 -0.020 25755
683 1 3 . 1 1 35 35 ARG CA C 35 58.076 58.076 59.720 -1.644 25755
684 1 3 . 1 1 35 35 ARG CB C 35 30.717 30.717 31.078 -0.361 25755
685 1 3 . 1 1 35 35 ARG H H 35 8.295 8.295 8.103 0.192 25755
686 1 3 . 1 1 36 36 SER N N 36 109.273 109.273 112.307 -3.034 25755
687 1 3 . 1 1 36 36 SER HA H 36 4.646 4.646 4.471 0.175 25755
688 1 3 . 1 1 36 36 SER CA C 36 57.703 57.703 58.681 -0.978 25755
689 1 3 . 1 1 36 36 SER CB C 36 65.425 65.425 64.794 0.631 25755
690 1 3 . 1 1 36 36 SER H H 36 8.026 8.026 8.296 -0.270 25755
691 1 3 . 1 1 37 37 GLY N N 37 107.305 107.305 111.376 -4.071 25755
692 1 3 . 1 1 37 37 GLY CA C 37 47.152 47.152 45.188 1.964 25755
693 1 3 . 1 1 37 37 GLY H H 37 8.679 8.679 8.125 0.554 25755
694 1 3 . 1 1 38 38 GLU N N 38 119.065 119.065 122.625 -3.560 25755
695 1 3 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.601 -0.199 25755
696 1 3 . 1 1 38 38 GLU CA C 38 55.773 55.773 55.394 0.379 25755
697 1 3 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.848 -2.026 25755
698 1 3 . 1 1 38 38 GLU H H 38 8.351 8.351 8.806 -0.455 25755
699 1 3 . 1 1 39 39 CYS N N 39 121.636 121.636 118.757 2.879 25755
700 1 3 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.255 0.732 25755
701 1 3 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.967 -1.239 25755
702 1 3 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.324 16.695 25755
703 1 3 . 1 1 39 39 CYS H H 39 8.839 8.839 8.295 0.544 25755
704 1 3 . 1 1 40 40 PHE N N 40 121.987 121.987 120.417 1.570 25755
705 1 3 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.798 -0.028 25755
706 1 3 . 1 1 40 40 PHE CA C 40 56.969 56.969 56.544 0.425 25755
707 1 3 . 1 1 40 40 PHE CB C 40 43.760 43.760 42.953 0.807 25755
708 1 3 . 1 1 40 40 PHE H H 40 9.214 9.214 8.787 0.427 25755
709 1 3 . 1 1 41 41 TYR N N 41 121.905 121.905 119.024 2.881 25755
710 1 3 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.643 0.317 25755
711 1 3 . 1 1 41 41 TYR CA C 41 58.532 58.532 58.982 -0.450 25755
712 1 3 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.290 1.012 25755
713 1 3 . 1 1 41 41 TYR H H 41 8.557 8.557 8.671 -0.114 25755
714 1 3 . 1 1 42 42 ASP N N 42 123.133 123.133 121.288 1.845 25755
715 1 3 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.855 -0.102 25755
716 1 3 . 1 1 42 42 ASP CA C 42 52.426 52.426 53.028 -0.602 25755
717 1 3 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.725 -1.105 25755
718 1 3 . 1 1 42 42 ASP H H 42 8.603 8.603 7.982 0.621 25755
719 1 3 . 1 1 43 43 GLU N N 43 118.012 118.012 119.704 -1.692 25755
720 1 3 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.120 0.089 25755
721 1 3 . 1 1 43 43 GLU CA C 43 58.865 58.865 58.795 0.070 25755
722 1 3 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.668 -0.430 25755
723 1 3 . 1 1 43 43 GLU H H 43 9.081 9.081 8.667 0.414 25755
724 1 3 . 1 1 44 44 LYS N N 44 120.047 120.047 117.340 2.707 25755
725 1 3 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.434 0.010 25755
726 1 3 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.535 0.126 25755
727 1 3 . 1 1 44 44 LYS CB C 44 32.039 32.039 32.684 -0.645 25755
728 1 3 . 1 1 44 44 LYS H H 44 8.162 8.162 7.801 0.361 25755
729 1 3 . 1 1 45 45 ARG N N 45 113.453 113.453 115.596 -2.143 25755
730 1 3 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.043 -0.380 25755
731 1 3 . 1 1 45 45 ARG CA C 45 57.736 57.736 56.857 0.879 25755
732 1 3 . 1 1 45 45 ARG CB C 45 26.390 26.390 27.466 -1.076 25755
733 1 3 . 1 1 45 45 ARG H H 45 8.335 8.335 7.730 0.605 25755
734 1 3 . 1 1 46 46 ASN N N 46 118.207 118.207 116.611 1.596 25755
735 1 3 . 1 1 46 46 ASN HA H 46 4.982 4.982 4.929 0.053 25755
736 1 3 . 1 1 46 46 ASN CA C 46 53.066 53.066 52.358 0.708 25755
737 1 3 . 1 1 46 46 ASN CB C 46 39.293 39.293 38.751 0.542 25755
738 1 3 . 1 1 46 46 ASN H H 46 8.745 8.745 8.232 0.513 25755
739 1 3 . 1 1 47 47 LEU N N 47 125.815 125.815 126.730 -0.915 25755
740 1 3 . 1 1 47 47 LEU HA H 47 4.279 4.279 3.999 0.280 25755
741 1 3 . 1 1 47 47 LEU CA C 47 55.290 55.290 55.006 0.284 25755
742 1 3 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.429 1.877 25755
743 1 3 . 1 1 47 47 LEU H H 47 8.509 8.509 8.801 -0.292 25755
744 1 3 . 1 1 48 48 GLN N N 48 120.834 120.834 122.254 -1.420 25755
745 1 3 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.713 0.023 25755
746 1 3 . 1 1 48 48 GLN CA C 48 54.105 54.105 53.659 0.446 25755
747 1 3 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.580 -0.714 25755
748 1 3 . 1 1 48 48 GLN H H 48 8.589 8.589 8.828 -0.239 25755
749 1 3 . 1 1 49 49 CYS N N 49 121.829 121.829 123.651 -1.822 25755
750 1 3 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.561 0.297 25755
751 1 3 . 1 1 49 49 CYS CA C 49 54.955 54.955 58.976 -4.021 25755
752 1 3 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.592 12.853 25755
753 1 3 . 1 1 49 49 CYS H H 49 9.247 9.247 9.037 0.210 25755
754 1 3 . 1 1 50 50 ILE N N 50 129.010 129.010 130.154 -1.144 25755
755 1 3 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.461 -0.075 25755
756 1 3 . 1 1 50 50 ILE CA C 50 60.421 60.421 61.993 -1.572 25755
757 1 3 . 1 1 50 50 ILE CB C 50 38.404 38.404 39.067 -0.663 25755
758 1 3 . 1 1 50 50 ILE H H 50 8.787 8.787 7.952 0.835 25755
759 1 3 . 1 1 51 51 CYS N N 51 126.108 126.108 127.316 -1.208 25755
760 1 3 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.645 0.692 25755
761 1 3 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.521 -6.703 25755
762 1 3 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.793 6.189 25755
763 1 3 . 1 1 51 51 CYS H H 51 8.556 8.556 9.333 -0.777 25755
764 1 3 . 1 1 52 52 ASP N N 52 122.342 122.342 120.559 1.783 25755
765 1 3 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.857 0.656 25755
766 1 3 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.952 -1.369 25755
767 1 3 . 1 1 52 52 ASP CB C 52 42.831 42.831 42.911 -0.080 25755
768 1 3 . 1 1 52 52 ASP H H 52 8.826 8.826 8.483 0.343 25755
769 1 3 . 1 1 53 53 TYR N N 53 125.370 125.370 123.904 1.466 25755
770 1 3 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.564 -0.306 25755
771 1 3 . 1 1 53 53 TYR CA C 53 59.665 59.665 58.969 0.696 25755
772 1 3 . 1 1 53 53 TYR CB C 53 38.783 38.783 38.813 -0.030 25755
773 1 3 . 1 1 53 53 TYR H H 53 9.734 9.734 8.731 1.003 25755
774 1 3 . 1 1 54 54 CYS N N 54 120.418 120.418 120.929 -0.511 25755
775 1 3 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.466 0.028 25755
776 1 3 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.592 -4.449 25755
777 1 3 . 1 1 54 54 CYS CB C 54 44.382 44.382 29.303 15.079 25755
778 1 3 . 1 1 54 54 CYS H H 54 9.478 9.478 8.885 0.593 25755
779 1 3 . 1 1 55 55 GLU N N 55 121.097 121.097 119.361 1.736 25755
780 1 3 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.609 -0.297 25755
781 1 3 . 1 1 55 55 GLU CA C 55 56.010 56.010 55.573 0.437 25755
782 1 3 . 1 1 55 55 GLU CB C 55 31.014 31.014 32.428 -1.414 25755
783 1 3 . 1 1 55 55 GLU H H 55 8.423 8.423 7.756 0.667 25755
784 1 4 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.802 -0.551 25755
785 1 4 . 1 1 2 2 ASP CA C 2 59.484 59.484 54.167 5.317 25755
786 1 4 . 1 1 2 2 ASP CB C 2 39.412 39.412 39.508 -0.096 25755
787 1 4 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.465 -0.120 25755
788 1 4 . 1 1 3 3 LYS CA C 3 57.556 57.556 56.148 1.408 25755
789 1 4 . 1 1 3 3 LYS CB C 3 32.593 32.593 32.524 0.069 25755
790 1 4 . 1 1 4 4 CYS N N 4 117.049 117.049 118.937 -1.888 25755
791 1 4 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.920 -0.192 25755
792 1 4 . 1 1 4 4 CYS CA C 4 57.415 57.415 57.304 0.111 25755
793 1 4 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.751 12.092 25755
794 1 4 . 1 1 4 4 CYS H H 4 8.486 8.486 7.994 0.492 25755
795 1 4 . 1 1 5 5 LYS N N 5 118.790 118.790 121.399 -2.609 25755
796 1 4 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.955 0.616 25755
797 1 4 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.799 -0.509 25755
798 1 4 . 1 1 5 5 LYS CB C 5 34.606 34.606 34.918 -0.312 25755
799 1 4 . 1 1 5 5 LYS H H 5 8.007 8.007 8.253 -0.246 25755
800 1 4 . 1 1 6 6 LYS N N 6 121.177 121.177 120.360 0.817 25755
801 1 4 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.589 0.196 25755
802 1 4 . 1 1 6 6 LYS CA C 6 55.542 55.542 55.918 -0.376 25755
803 1 4 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.538 1.364 25755
804 1 4 . 1 1 6 6 LYS H H 6 9.014 9.014 8.857 0.157 25755
805 1 4 . 1 1 7 7 VAL N N 7 127.629 127.629 124.369 3.260 25755
806 1 4 . 1 1 7 7 VAL HA H 7 4.026 4.026 3.998 0.028 25755
807 1 4 . 1 1 7 7 VAL CA C 7 63.988 63.988 62.358 1.631 25755
808 1 4 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.656 0.451 25755
809 1 4 . 1 1 7 7 VAL H H 7 8.837 8.837 8.656 0.181 25755
810 1 4 . 1 1 8 8 TYR N N 8 130.003 130.003 129.577 0.426 25755
811 1 4 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.756 -0.297 25755
812 1 4 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.727 -0.007 25755
813 1 4 . 1 1 8 8 TYR CB C 8 36.018 36.018 38.246 -2.228 25755
814 1 4 . 1 1 8 8 TYR H H 8 9.251 9.251 8.365 0.886 25755
815 1 4 . 1 1 9 9 GLU N N 9 130.851 130.851 125.163 5.688 25755
816 1 4 . 1 1 9 9 GLU HA H 9 4.204 4.204 4.074 0.130 25755
817 1 4 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.452 0.065 25755
818 1 4 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.496 -0.105 25755
819 1 4 . 1 1 9 9 GLU H H 9 9.072 9.072 8.518 0.554 25755
820 1 4 . 1 1 10 10 ASN N N 10 116.120 116.120 117.183 -1.063 25755
821 1 4 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.601 -0.163 25755
822 1 4 . 1 1 10 10 ASN CA C 10 54.587 54.587 52.868 1.719 25755
823 1 4 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.478 -0.200 25755
824 1 4 . 1 1 10 10 ASN H H 10 9.301 9.301 7.606 1.695 25755
825 1 4 . 1 1 11 11 TYR N N 11 122.436 122.436 120.642 1.794 25755
826 1 4 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.680 -0.486 25755
827 1 4 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.432 2.180 25755
828 1 4 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.877 -2.410 25755
829 1 4 . 1 1 11 11 TYR H H 11 7.550 7.550 7.494 0.056 25755
830 1 4 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.555 -0.108 25755
831 1 4 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.664 -0.166 25755
832 1 4 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.713 -2.122 25755
833 1 4 . 1 1 13 13 VAL N N 13 124.506 124.506 122.929 1.577 25755
834 1 4 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.741 0.095 25755
835 1 4 . 1 1 13 13 VAL CA C 13 65.761 65.761 64.956 0.805 25755
836 1 4 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.630 -0.050 25755
837 1 4 . 1 1 13 13 VAL H H 13 8.169 8.169 8.402 -0.233 25755
838 1 4 . 1 1 14 14 SER N N 14 116.625 116.625 116.513 0.112 25755
839 1 4 . 1 1 14 14 SER HA H 14 4.206 4.206 4.331 -0.125 25755
840 1 4 . 1 1 14 14 SER CA C 14 61.194 61.194 61.594 -0.400 25755
841 1 4 . 1 1 14 14 SER CB C 14 62.041 62.041 62.751 -0.710 25755
842 1 4 . 1 1 14 14 SER H H 14 8.396 8.396 8.204 0.192 25755
843 1 4 . 1 1 15 15 LYS N N 15 120.843 120.843 121.808 -0.965 25755
844 1 4 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.015 0.185 25755
845 1 4 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.200 0.423 25755
846 1 4 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.075 0.111 25755
847 1 4 . 1 1 15 15 LYS H H 15 7.791 7.791 7.656 0.135 25755
848 1 4 . 1 1 16 16 CYS N N 16 115.949 115.949 117.510 -1.561 25755
849 1 4 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.479 0.414 25755
850 1 4 . 1 1 16 16 CYS CA C 16 56.570 56.570 61.357 -4.787 25755
851 1 4 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.712 14.725 25755
852 1 4 . 1 1 16 16 CYS H H 16 7.870 7.870 7.507 0.363 25755
853 1 4 . 1 1 17 17 GLN N N 17 117.241 117.241 117.343 -0.102 25755
854 1 4 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.082 0.192 25755
855 1 4 . 1 1 17 17 GLN CA C 17 56.937 56.937 57.246 -0.309 25755
856 1 4 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.648 0.538 25755
857 1 4 . 1 1 17 17 GLN H H 17 7.560 7.560 7.682 -0.122 25755
858 1 4 . 1 1 18 18 LEU N N 18 120.537 120.537 121.516 -0.979 25755
859 1 4 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.156 0.284 25755
860 1 4 . 1 1 18 18 LEU CA C 18 55.448 55.448 55.108 0.340 25755
861 1 4 . 1 1 18 18 LEU CB C 18 41.837 41.837 41.026 0.811 25755
862 1 4 . 1 1 18 18 LEU H H 18 7.369 7.369 7.468 -0.099 25755
863 1 4 . 1 1 19 19 ARG N N 19 121.697 121.697 123.503 -1.806 25755
864 1 4 . 1 1 19 19 ARG HA H 19 4.299 4.299 4.035 0.264 25755
865 1 4 . 1 1 19 19 ARG CA C 19 57.836 57.836 58.762 -0.926 25755
866 1 4 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.178 0.214 25755
867 1 4 . 1 1 19 19 ARG H H 19 8.447 8.447 8.026 0.421 25755
868 1 4 . 1 1 20 20 ILE N N 20 116.439 116.439 116.275 0.164 25755
869 1 4 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.061 0.073 25755
870 1 4 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.346 0.151 25755
871 1 4 . 1 1 20 20 ILE CB C 20 38.164 38.164 38.181 -0.017 25755
872 1 4 . 1 1 20 20 ILE H H 20 7.758 7.758 7.746 0.012 25755
873 1 4 . 1 1 21 21 ALA N N 21 122.642 122.642 122.855 -0.213 25755
874 1 4 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.570 -0.188 25755
875 1 4 . 1 1 21 21 ALA CA C 21 52.395 52.395 51.656 0.739 25755
876 1 4 . 1 1 21 21 ALA CB C 21 20.098 20.098 19.801 0.297 25755
877 1 4 . 1 1 21 21 ALA H H 21 7.727 7.727 7.343 0.384 25755
878 1 4 . 1 1 22 22 ASN N N 22 116.616 116.616 121.967 -5.351 25755
879 1 4 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.895 -0.104 25755
880 1 4 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.388 0.489 25755
881 1 4 . 1 1 22 22 ASN CB C 22 37.554 37.554 38.022 -0.468 25755
882 1 4 . 1 1 22 22 ASN H H 22 8.307 8.307 8.546 -0.239 25755
883 1 4 . 1 1 23 23 GLN N N 23 124.357 124.357 123.246 1.111 25755
884 1 4 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.325 -0.307 25755
885 1 4 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.890 0.758 25755
886 1 4 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.806 0.593 25755
887 1 4 . 1 1 23 23 GLN H H 23 8.542 8.542 8.199 0.343 25755
888 1 4 . 1 1 24 24 CYS N N 24 118.909 118.909 119.469 -0.560 25755
889 1 4 . 1 1 24 24 CYS HA H 24 4.284 4.284 4.001 0.283 25755
890 1 4 . 1 1 24 24 CYS CA C 24 58.406 58.406 62.617 -4.211 25755
891 1 4 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.856 11.920 25755
892 1 4 . 1 1 24 24 CYS H H 24 8.352 8.352 8.611 -0.259 25755
893 1 4 . 1 1 25 25 ASN N N 25 118.182 118.182 119.877 -1.695 25755
894 1 4 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.281 -0.393 25755
895 1 4 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.722 0.950 25755
896 1 4 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.200 2.573 25755
897 1 4 . 1 1 25 25 ASN H H 25 7.504 7.504 8.500 -0.996 25755
898 1 4 . 1 1 26 26 TYR N N 26 117.354 117.354 120.346 -2.992 25755
899 1 4 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.137 -0.172 25755
900 1 4 . 1 1 26 26 TYR CA C 26 62.162 62.162 61.981 0.181 25755
901 1 4 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.843 -0.213 25755
902 1 4 . 1 1 26 26 TYR H H 26 7.322 7.322 7.543 -0.221 25755
903 1 4 . 1 1 27 27 ASP N N 27 119.874 119.874 119.929 -0.055 25755
904 1 4 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.364 0.291 25755
905 1 4 . 1 1 27 27 ASP CB C 27 40.590 40.590 40.750 -0.160 25755
906 1 4 . 1 1 27 27 ASP H H 27 9.218 9.218 8.222 0.996 25755
907 1 4 . 1 1 28 28 CYS N N 28 119.782 119.782 119.086 0.696 25755
908 1 4 . 1 1 28 28 CYS HA H 28 4.168 4.168 3.892 0.277 25755
909 1 4 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.652 -1.738 25755
910 1 4 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.194 10.751 25755
911 1 4 . 1 1 28 28 CYS H H 28 9.171 9.171 8.390 0.781 25755
912 1 4 . 1 1 29 29 LYS N N 29 119.663 119.663 119.004 0.659 25755
913 1 4 . 1 1 29 29 LYS HA H 29 4.137 4.137 3.863 0.274 25755
914 1 4 . 1 1 29 29 LYS CA C 29 59.781 59.781 58.954 0.827 25755
915 1 4 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.761 0.652 25755
916 1 4 . 1 1 29 29 LYS H H 29 7.546 7.546 7.434 0.112 25755
917 1 4 . 1 1 30 30 LEU N N 30 119.987 119.987 120.447 -0.460 25755
918 1 4 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.817 0.294 25755
919 1 4 . 1 1 30 30 LEU CA C 30 57.672 57.672 57.618 0.054 25755
920 1 4 . 1 1 30 30 LEU CB C 30 42.379 42.379 42.167 0.212 25755
921 1 4 . 1 1 30 30 LEU H H 30 8.226 8.226 7.558 0.668 25755
922 1 4 . 1 1 31 31 ASP N N 31 116.853 116.853 116.350 0.503 25755
923 1 4 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.684 -0.138 25755
924 1 4 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.533 0.733 25755
925 1 4 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.415 -0.937 25755
926 1 4 . 1 1 31 31 ASP H H 31 9.019 9.019 7.861 1.158 25755
927 1 4 . 1 1 32 32 LYS N N 32 112.075 112.075 118.546 -6.471 25755
928 1 4 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.141 0.408 25755
929 1 4 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.828 -4.363 25755
930 1 4 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.582 -0.717 25755
931 1 4 . 1 1 32 32 LYS H H 32 6.639 6.639 8.322 -1.683 25755
932 1 4 . 1 1 33 33 HIS N N 33 112.955 112.955 114.311 -1.356 25755
933 1 4 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.172 0.451 25755
934 1 4 . 1 1 33 33 HIS CA C 33 56.486 56.486 55.865 0.620 25755
935 1 4 . 1 1 33 33 HIS CB C 33 25.694 25.694 28.132 -2.438 25755
936 1 4 . 1 1 33 33 HIS H H 33 7.065 7.065 8.048 -0.983 25755
937 1 4 . 1 1 34 34 ALA N N 34 120.177 120.177 119.211 0.966 25755
938 1 4 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.835 0.314 25755
939 1 4 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.234 -1.456 25755
940 1 4 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.684 -0.566 25755
941 1 4 . 1 1 34 34 ALA H H 34 7.716 7.716 7.128 0.588 25755
942 1 4 . 1 1 35 35 ARG N N 35 116.636 116.636 117.197 -0.561 25755
943 1 4 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.129 0.077 25755
944 1 4 . 1 1 35 35 ARG CA C 35 58.076 58.076 58.255 -0.179 25755
945 1 4 . 1 1 35 35 ARG CB C 35 30.717 30.717 29.839 0.878 25755
946 1 4 . 1 1 35 35 ARG H H 35 8.295 8.295 8.132 0.163 25755
947 1 4 . 1 1 36 36 SER N N 36 109.273 109.273 110.710 -1.437 25755
948 1 4 . 1 1 36 36 SER HA H 36 4.646 4.646 4.466 0.180 25755
949 1 4 . 1 1 36 36 SER CA C 36 57.703 57.703 58.623 -0.920 25755
950 1 4 . 1 1 36 36 SER CB C 36 65.425 65.425 65.492 -0.067 25755
951 1 4 . 1 1 36 36 SER H H 36 8.026 8.026 8.073 -0.047 25755
952 1 4 . 1 1 37 37 GLY N N 37 107.305 107.305 109.727 -2.422 25755
953 1 4 . 1 1 37 37 GLY CA C 37 47.152 47.152 44.857 2.295 25755
954 1 4 . 1 1 37 37 GLY H H 37 8.679 8.679 7.807 0.872 25755
955 1 4 . 1 1 38 38 GLU N N 38 119.065 119.065 121.874 -2.809 25755
956 1 4 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.584 -0.182 25755
957 1 4 . 1 1 38 38 GLU CA C 38 55.773 55.773 54.772 1.001 25755
958 1 4 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.988 -2.166 25755
959 1 4 . 1 1 38 38 GLU H H 38 8.351 8.351 8.942 -0.591 25755
960 1 4 . 1 1 39 39 CYS N N 39 121.636 121.636 118.516 3.120 25755
961 1 4 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.299 0.688 25755
962 1 4 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.759 -1.031 25755
963 1 4 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.453 16.566 25755
964 1 4 . 1 1 39 39 CYS H H 39 8.839 8.839 8.319 0.520 25755
965 1 4 . 1 1 40 40 PHE N N 40 121.987 121.987 120.308 1.679 25755
966 1 4 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.811 -0.041 25755
967 1 4 . 1 1 40 40 PHE CA C 40 56.969 56.969 56.566 0.403 25755
968 1 4 . 1 1 40 40 PHE CB C 40 43.760 43.760 43.004 0.756 25755
969 1 4 . 1 1 40 40 PHE H H 40 9.214 9.214 8.846 0.368 25755
970 1 4 . 1 1 41 41 TYR N N 41 121.905 121.905 118.550 3.355 25755
971 1 4 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.688 0.272 25755
972 1 4 . 1 1 41 41 TYR CA C 41 58.532 58.532 59.074 -0.542 25755
973 1 4 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.340 0.962 25755
974 1 4 . 1 1 41 41 TYR H H 41 8.557 8.557 8.724 -0.167 25755
975 1 4 . 1 1 42 42 ASP N N 42 123.133 123.133 121.296 1.837 25755
976 1 4 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.856 -0.103 25755
977 1 4 . 1 1 42 42 ASP CA C 42 52.426 52.426 52.602 -0.176 25755
978 1 4 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.902 -1.282 25755
979 1 4 . 1 1 42 42 ASP H H 42 8.603 8.603 8.426 0.177 25755
980 1 4 . 1 1 43 43 GLU N N 43 118.012 118.012 119.023 -1.011 25755
981 1 4 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.158 0.051 25755
982 1 4 . 1 1 43 43 GLU CA C 43 58.865 58.865 58.672 0.193 25755
983 1 4 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.658 -0.421 25755
984 1 4 . 1 1 43 43 GLU H H 43 9.081 9.081 8.751 0.330 25755
985 1 4 . 1 1 44 44 LYS N N 44 120.047 120.047 117.031 3.016 25755
986 1 4 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.386 0.058 25755
987 1 4 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.572 0.089 25755
988 1 4 . 1 1 44 44 LYS CB C 44 32.039 32.039 32.462 -0.423 25755
989 1 4 . 1 1 44 44 LYS H H 44 8.162 8.162 8.062 0.100 25755
990 1 4 . 1 1 45 45 ARG N N 45 113.453 113.453 116.053 -2.600 25755
991 1 4 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.108 -0.445 25755
992 1 4 . 1 1 45 45 ARG CA C 45 57.736 57.736 56.520 1.216 25755
993 1 4 . 1 1 45 45 ARG CB C 45 26.390 26.390 27.260 -0.870 25755
994 1 4 . 1 1 45 45 ARG H H 45 8.335 8.335 7.788 0.547 25755
995 1 4 . 1 1 46 46 ASN N N 46 118.207 118.207 117.295 0.912 25755
996 1 4 . 1 1 46 46 ASN HA H 46 4.982 4.982 4.950 0.032 25755
997 1 4 . 1 1 46 46 ASN CA C 46 53.066 53.066 51.916 1.151 25755
998 1 4 . 1 1 46 46 ASN CB C 46 39.293 39.293 38.977 0.316 25755
999 1 4 . 1 1 46 46 ASN H H 46 8.745 8.745 8.283 0.462 25755
1000 1 4 . 1 1 47 47 LEU N N 47 125.815 125.815 127.316 -1.501 25755
1001 1 4 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.108 0.171 25755
1002 1 4 . 1 1 47 47 LEU CA C 47 55.290 55.290 54.973 0.317 25755
1003 1 4 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.658 1.648 25755
1004 1 4 . 1 1 47 47 LEU H H 47 8.509 8.509 8.906 -0.397 25755
1005 1 4 . 1 1 48 48 GLN N N 48 120.834 120.834 122.298 -1.464 25755
1006 1 4 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.690 0.046 25755
1007 1 4 . 1 1 48 48 GLN CA C 48 54.105 54.105 53.945 0.160 25755
1008 1 4 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.446 -0.580 25755
1009 1 4 . 1 1 48 48 GLN H H 48 8.589 8.589 8.996 -0.407 25755
1010 1 4 . 1 1 49 49 CYS N N 49 121.829 121.829 123.191 -1.362 25755
1011 1 4 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.570 0.288 25755
1012 1 4 . 1 1 49 49 CYS CA C 49 54.955 54.955 59.244 -4.289 25755
1013 1 4 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.717 12.728 25755
1014 1 4 . 1 1 49 49 CYS H H 49 9.247 9.247 8.935 0.312 25755
1015 1 4 . 1 1 50 50 ILE N N 50 129.010 129.010 130.380 -1.370 25755
1016 1 4 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.488 -0.102 25755
1017 1 4 . 1 1 50 50 ILE CA C 50 60.421 60.421 61.778 -1.357 25755
1018 1 4 . 1 1 50 50 ILE CB C 50 38.404 38.404 39.278 -0.874 25755
1019 1 4 . 1 1 50 50 ILE H H 50 8.787 8.787 8.396 0.391 25755
1020 1 4 . 1 1 51 51 CYS N N 51 126.108 126.108 127.879 -1.771 25755
1021 1 4 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.685 0.652 25755
1022 1 4 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.170 -6.352 25755
1023 1 4 . 1 1 51 51 CYS CB C 51 35.982 35.982 30.119 5.863 25755
1024 1 4 . 1 1 51 51 CYS H H 51 8.556 8.556 9.180 -0.624 25755
1025 1 4 . 1 1 52 52 ASP N N 52 122.342 122.342 120.887 1.455 25755
1026 1 4 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.978 0.535 25755
1027 1 4 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.715 -1.132 25755
1028 1 4 . 1 1 52 52 ASP CB C 52 42.831 42.831 41.711 1.120 25755
1029 1 4 . 1 1 52 52 ASP H H 52 8.826 8.826 8.594 0.232 25755
1030 1 4 . 1 1 53 53 TYR N N 53 125.370 125.370 122.637 2.733 25755
1031 1 4 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.614 -0.356 25755
1032 1 4 . 1 1 53 53 TYR CA C 53 59.665 59.665 59.319 0.346 25755
1033 1 4 . 1 1 53 53 TYR CB C 53 38.783 38.783 39.384 -0.601 25755
1034 1 4 . 1 1 53 53 TYR H H 53 9.734 9.734 8.718 1.016 25755
1035 1 4 . 1 1 54 54 CYS N N 54 120.418 120.418 120.947 -0.529 25755
1036 1 4 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.462 0.032 25755
1037 1 4 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.627 -4.484 25755
1038 1 4 . 1 1 54 54 CYS CB C 54 44.382 44.382 28.706 15.677 25755
1039 1 4 . 1 1 54 54 CYS H H 54 9.478 9.478 8.917 0.561 25755
1040 1 4 . 1 1 55 55 GLU N N 55 121.097 121.097 118.733 2.364 25755
1041 1 4 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.109 0.203 25755
1042 1 4 . 1 1 55 55 GLU CA C 55 56.010 56.010 57.290 -1.280 25755
1043 1 4 . 1 1 55 55 GLU CB C 55 31.014 31.014 29.821 1.193 25755
1044 1 4 . 1 1 55 55 GLU H H 55 8.423 8.423 8.227 0.196 25755
1045 1 5 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.374 -0.123 25755
1046 1 5 . 1 1 2 2 ASP CA C 2 59.484 59.484 55.391 4.093 25755
1047 1 5 . 1 1 2 2 ASP CB C 2 39.412 39.412 40.268 -0.856 25755
1048 1 5 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.364 -0.019 25755
1049 1 5 . 1 1 3 3 LYS CA C 3 57.556 57.556 56.722 0.834 25755
1050 1 5 . 1 1 3 3 LYS CB C 3 32.593 32.593 32.968 -0.375 25755
1051 1 5 . 1 1 4 4 CYS N N 4 117.049 117.049 118.426 -1.377 25755
1052 1 5 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.919 -0.191 25755
1053 1 5 . 1 1 4 4 CYS CA C 4 57.415 57.415 56.596 0.819 25755
1054 1 5 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.245 12.598 25755
1055 1 5 . 1 1 4 4 CYS H H 4 8.486 8.486 8.043 0.443 25755
1056 1 5 . 1 1 5 5 LYS N N 5 118.790 118.790 121.197 -2.407 25755
1057 1 5 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.849 0.722 25755
1058 1 5 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.755 -0.465 25755
1059 1 5 . 1 1 5 5 LYS CB C 5 34.606 34.606 34.949 -0.343 25755
1060 1 5 . 1 1 5 5 LYS H H 5 8.007 8.007 8.218 -0.211 25755
1061 1 5 . 1 1 6 6 LYS N N 6 121.177 121.177 120.408 0.769 25755
1062 1 5 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.530 0.255 25755
1063 1 5 . 1 1 6 6 LYS CA C 6 55.542 55.542 56.067 -0.525 25755
1064 1 5 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.729 1.173 25755
1065 1 5 . 1 1 6 6 LYS H H 6 9.014 9.014 8.692 0.322 25755
1066 1 5 . 1 1 7 7 VAL N N 7 127.629 127.629 125.161 2.468 25755
1067 1 5 . 1 1 7 7 VAL HA H 7 4.026 4.026 4.213 -0.187 25755
1068 1 5 . 1 1 7 7 VAL CA C 7 63.988 63.988 61.501 2.487 25755
1069 1 5 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.596 0.510 25755
1070 1 5 . 1 1 7 7 VAL H H 7 8.837 8.837 8.577 0.260 25755
1071 1 5 . 1 1 8 8 TYR N N 8 130.003 130.003 130.036 -0.033 25755
1072 1 5 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.754 -0.295 25755
1073 1 5 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.750 -0.030 25755
1074 1 5 . 1 1 8 8 TYR CB C 8 36.018 36.018 38.356 -2.338 25755
1075 1 5 . 1 1 8 8 TYR H H 8 9.251 9.251 8.377 0.874 25755
1076 1 5 . 1 1 9 9 GLU N N 9 130.851 130.851 124.948 5.903 25755
1077 1 5 . 1 1 9 9 GLU HA H 9 4.204 4.204 4.282 -0.078 25755
1078 1 5 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.395 0.122 25755
1079 1 5 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.568 -0.177 25755
1080 1 5 . 1 1 9 9 GLU H H 9 9.072 9.072 8.366 0.706 25755
1081 1 5 . 1 1 10 10 ASN N N 10 116.120 116.120 117.484 -1.364 25755
1082 1 5 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.599 -0.161 25755
1083 1 5 . 1 1 10 10 ASN CA C 10 54.587 54.587 52.621 1.966 25755
1084 1 5 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.008 0.270 25755
1085 1 5 . 1 1 10 10 ASN H H 10 9.301 9.301 7.606 1.695 25755
1086 1 5 . 1 1 11 11 TYR N N 11 122.436 122.436 120.216 2.220 25755
1087 1 5 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.632 -0.438 25755
1088 1 5 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.709 1.903 25755
1089 1 5 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.965 -2.498 25755
1090 1 5 . 1 1 11 11 TYR H H 11 7.550 7.550 7.376 0.174 25755
1091 1 5 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.589 -0.142 25755
1092 1 5 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.632 -0.134 25755
1093 1 5 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.937 -2.346 25755
1094 1 5 . 1 1 13 13 VAL N N 13 124.506 124.506 120.964 3.542 25755
1095 1 5 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.781 0.055 25755
1096 1 5 . 1 1 13 13 VAL CA C 13 65.761 65.761 64.784 0.977 25755
1097 1 5 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.733 -0.153 25755
1098 1 5 . 1 1 13 13 VAL H H 13 8.169 8.169 8.399 -0.230 25755
1099 1 5 . 1 1 14 14 SER N N 14 116.625 116.625 117.465 -0.840 25755
1100 1 5 . 1 1 14 14 SER HA H 14 4.206 4.206 4.399 -0.193 25755
1101 1 5 . 1 1 14 14 SER CA C 14 61.194 61.194 61.985 -0.791 25755
1102 1 5 . 1 1 14 14 SER CB C 14 62.041 62.041 62.881 -0.840 25755
1103 1 5 . 1 1 14 14 SER H H 14 8.396 8.396 8.199 0.197 25755
1104 1 5 . 1 1 15 15 LYS N N 15 120.843 120.843 121.376 -0.533 25755
1105 1 5 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.049 0.151 25755
1106 1 5 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.123 0.500 25755
1107 1 5 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.111 0.075 25755
1108 1 5 . 1 1 15 15 LYS H H 15 7.791 7.791 8.013 -0.222 25755
1109 1 5 . 1 1 16 16 CYS N N 16 115.949 115.949 117.249 -1.300 25755
1110 1 5 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.344 0.549 25755
1111 1 5 . 1 1 16 16 CYS CA C 16 56.570 56.570 61.112 -4.542 25755
1112 1 5 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.706 14.731 25755
1113 1 5 . 1 1 16 16 CYS H H 16 7.870 7.870 7.556 0.314 25755
1114 1 5 . 1 1 17 17 GLN N N 17 117.241 117.241 117.321 -0.080 25755
1115 1 5 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.095 0.179 25755
1116 1 5 . 1 1 17 17 GLN CA C 17 56.937 56.937 57.176 -0.239 25755
1117 1 5 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.648 0.539 25755
1118 1 5 . 1 1 17 17 GLN H H 17 7.560 7.560 7.629 -0.069 25755
1119 1 5 . 1 1 18 18 LEU N N 18 120.537 120.537 121.209 -0.672 25755
1120 1 5 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.132 0.308 25755
1121 1 5 . 1 1 18 18 LEU CA C 18 55.448 55.448 55.398 0.051 25755
1122 1 5 . 1 1 18 18 LEU CB C 18 41.837 41.837 41.066 0.770 25755
1123 1 5 . 1 1 18 18 LEU H H 18 7.369 7.369 7.359 0.010 25755
1124 1 5 . 1 1 19 19 ARG N N 19 121.697 121.697 122.585 -0.888 25755
1125 1 5 . 1 1 19 19 ARG HA H 19 4.299 4.299 4.061 0.238 25755
1126 1 5 . 1 1 19 19 ARG CA C 19 57.836 57.836 58.498 -0.662 25755
1127 1 5 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.213 0.179 25755
1128 1 5 . 1 1 19 19 ARG H H 19 8.447 8.447 8.024 0.423 25755
1129 1 5 . 1 1 20 20 ILE N N 20 116.439 116.439 116.685 -0.246 25755
1130 1 5 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.057 0.077 25755
1131 1 5 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.384 0.113 25755
1132 1 5 . 1 1 20 20 ILE CB C 20 38.164 38.164 38.163 0.001 25755
1133 1 5 . 1 1 20 20 ILE H H 20 7.758 7.758 7.747 0.011 25755
1134 1 5 . 1 1 21 21 ALA N N 21 122.642 122.642 122.969 -0.327 25755
1135 1 5 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.537 -0.155 25755
1136 1 5 . 1 1 21 21 ALA CA C 21 52.395 52.395 51.572 0.823 25755
1137 1 5 . 1 1 21 21 ALA CB C 21 20.098 20.098 19.690 0.408 25755
1138 1 5 . 1 1 21 21 ALA H H 21 7.727 7.727 7.241 0.486 25755
1139 1 5 . 1 1 22 22 ASN N N 22 116.616 116.616 121.799 -5.183 25755
1140 1 5 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.877 -0.086 25755
1141 1 5 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.532 0.345 25755
1142 1 5 . 1 1 22 22 ASN CB C 22 37.554 37.554 38.093 -0.539 25755
1143 1 5 . 1 1 22 22 ASN H H 22 8.307 8.307 8.517 -0.210 25755
1144 1 5 . 1 1 23 23 GLN N N 23 124.357 124.357 123.316 1.041 25755
1145 1 5 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.347 -0.329 25755
1146 1 5 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.253 1.395 25755
1147 1 5 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.617 0.782 25755
1148 1 5 . 1 1 23 23 GLN H H 23 8.542 8.542 8.214 0.328 25755
1149 1 5 . 1 1 24 24 CYS N N 24 118.909 118.909 118.577 0.332 25755
1150 1 5 . 1 1 24 24 CYS HA H 24 4.284 4.284 3.974 0.310 25755
1151 1 5 . 1 1 24 24 CYS CA C 24 58.406 58.406 63.475 -5.069 25755
1152 1 5 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.727 12.049 25755
1153 1 5 . 1 1 24 24 CYS H H 24 8.352 8.352 8.680 -0.328 25755
1154 1 5 . 1 1 25 25 ASN N N 25 118.182 118.182 117.868 0.314 25755
1155 1 5 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.320 -0.432 25755
1156 1 5 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.478 1.194 25755
1157 1 5 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.406 2.367 25755
1158 1 5 . 1 1 25 25 ASN H H 25 7.504 7.504 8.552 -1.048 25755
1159 1 5 . 1 1 26 26 TYR N N 26 117.354 117.354 119.339 -1.985 25755
1160 1 5 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.200 -0.235 25755
1161 1 5 . 1 1 26 26 TYR CA C 26 62.162 62.162 61.445 0.717 25755
1162 1 5 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.739 -0.109 25755
1163 1 5 . 1 1 26 26 TYR H H 26 7.322 7.322 7.671 -0.349 25755
1164 1 5 . 1 1 27 27 ASP N N 27 119.874 119.874 120.136 -0.262 25755
1165 1 5 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.360 0.295 25755
1166 1 5 . 1 1 27 27 ASP CB C 27 40.590 40.590 40.868 -0.278 25755
1167 1 5 . 1 1 27 27 ASP H H 27 9.218 9.218 8.140 1.078 25755
1168 1 5 . 1 1 28 28 CYS N N 28 119.782 119.782 119.129 0.653 25755
1169 1 5 . 1 1 28 28 CYS HA H 28 4.168 4.168 3.909 0.259 25755
1170 1 5 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.738 -1.824 25755
1171 1 5 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.200 10.745 25755
1172 1 5 . 1 1 28 28 CYS H H 28 9.171 9.171 8.242 0.929 25755
1173 1 5 . 1 1 29 29 LYS N N 29 119.663 119.663 118.961 0.702 25755
1174 1 5 . 1 1 29 29 LYS HA H 29 4.137 4.137 3.917 0.220 25755
1175 1 5 . 1 1 29 29 LYS CA C 29 59.781 59.781 59.082 0.699 25755
1176 1 5 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.789 0.624 25755
1177 1 5 . 1 1 29 29 LYS H H 29 7.546 7.546 7.476 0.070 25755
1178 1 5 . 1 1 30 30 LEU N N 30 119.987 119.987 120.835 -0.848 25755
1179 1 5 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.833 0.278 25755
1180 1 5 . 1 1 30 30 LEU CA C 30 57.672 57.672 57.870 -0.198 25755
1181 1 5 . 1 1 30 30 LEU CB C 30 42.379 42.379 42.141 0.238 25755
1182 1 5 . 1 1 30 30 LEU H H 30 8.226 8.226 7.598 0.628 25755
1183 1 5 . 1 1 31 31 ASP N N 31 116.853 116.853 116.362 0.491 25755
1184 1 5 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.553 -0.007 25755
1185 1 5 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.367 0.899 25755
1186 1 5 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.190 -0.712 25755
1187 1 5 . 1 1 31 31 ASP H H 31 9.019 9.019 7.798 1.221 25755
1188 1 5 . 1 1 32 32 LYS N N 32 112.075 112.075 118.684 -6.609 25755
1189 1 5 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.181 0.368 25755
1190 1 5 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.566 -4.101 25755
1191 1 5 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.685 -0.820 25755
1192 1 5 . 1 1 32 32 LYS H H 32 6.639 6.639 8.222 -1.583 25755
1193 1 5 . 1 1 33 33 HIS N N 33 112.955 112.955 115.229 -2.274 25755
1194 1 5 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.105 0.518 25755
1195 1 5 . 1 1 33 33 HIS CA C 33 56.486 56.486 55.508 0.978 25755
1196 1 5 . 1 1 33 33 HIS CB C 33 25.694 25.694 28.369 -2.675 25755
1197 1 5 . 1 1 33 33 HIS H H 33 7.065 7.065 8.085 -1.020 25755
1198 1 5 . 1 1 34 34 ALA N N 34 120.177 120.177 119.528 0.649 25755
1199 1 5 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.741 0.408 25755
1200 1 5 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.356 -1.577 25755
1201 1 5 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.506 -0.388 25755
1202 1 5 . 1 1 34 34 ALA H H 34 7.716 7.716 7.069 0.647 25755
1203 1 5 . 1 1 35 35 ARG N N 35 116.636 116.636 117.863 -1.227 25755
1204 1 5 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.105 0.101 25755
1205 1 5 . 1 1 35 35 ARG CA C 35 58.076 58.076 57.999 0.077 25755
1206 1 5 . 1 1 35 35 ARG CB C 35 30.717 30.717 29.953 0.764 25755
1207 1 5 . 1 1 35 35 ARG H H 35 8.295 8.295 8.062 0.233 25755
1208 1 5 . 1 1 36 36 SER N N 36 109.273 109.273 111.865 -2.592 25755
1209 1 5 . 1 1 36 36 SER HA H 36 4.646 4.646 4.454 0.193 25755
1210 1 5 . 1 1 36 36 SER CA C 36 57.703 57.703 58.080 -0.377 25755
1211 1 5 . 1 1 36 36 SER CB C 36 65.425 65.425 65.257 0.168 25755
1212 1 5 . 1 1 36 36 SER H H 36 8.026 8.026 7.775 0.251 25755
1213 1 5 . 1 1 37 37 GLY N N 37 107.305 107.305 110.469 -3.164 25755
1214 1 5 . 1 1 37 37 GLY CA C 37 47.152 47.152 44.738 2.414 25755
1215 1 5 . 1 1 37 37 GLY H H 37 8.679 8.679 7.832 0.847 25755
1216 1 5 . 1 1 38 38 GLU N N 38 119.065 119.065 122.236 -3.171 25755
1217 1 5 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.554 -0.152 25755
1218 1 5 . 1 1 38 38 GLU CA C 38 55.773 55.773 54.777 0.996 25755
1219 1 5 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.972 -2.150 25755
1220 1 5 . 1 1 38 38 GLU H H 38 8.351 8.351 8.817 -0.466 25755
1221 1 5 . 1 1 39 39 CYS N N 39 121.636 121.636 117.990 3.646 25755
1222 1 5 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.267 0.720 25755
1223 1 5 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.446 -0.718 25755
1224 1 5 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.252 16.767 25755
1225 1 5 . 1 1 39 39 CYS H H 39 8.839 8.839 8.254 0.585 25755
1226 1 5 . 1 1 40 40 PHE N N 40 121.987 121.987 120.860 1.127 25755
1227 1 5 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.862 -0.092 25755
1228 1 5 . 1 1 40 40 PHE CA C 40 56.969 56.969 55.921 1.048 25755
1229 1 5 . 1 1 40 40 PHE CB C 40 43.760 43.760 42.794 0.966 25755
1230 1 5 . 1 1 40 40 PHE H H 40 9.214 9.214 8.815 0.399 25755
1231 1 5 . 1 1 41 41 TYR N N 41 121.905 121.905 119.585 2.320 25755
1232 1 5 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.730 0.230 25755
1233 1 5 . 1 1 41 41 TYR CA C 41 58.532 58.532 58.876 -0.344 25755
1234 1 5 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.240 1.062 25755
1235 1 5 . 1 1 41 41 TYR H H 41 8.557 8.557 8.776 -0.219 25755
1236 1 5 . 1 1 42 42 ASP N N 42 123.133 123.133 121.207 1.926 25755
1237 1 5 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.845 -0.092 25755
1238 1 5 . 1 1 42 42 ASP CA C 42 52.426 52.426 52.123 0.303 25755
1239 1 5 . 1 1 42 42 ASP CB C 42 41.620 41.620 41.940 -0.320 25755
1240 1 5 . 1 1 42 42 ASP H H 42 8.603 8.603 8.512 0.091 25755
1241 1 5 . 1 1 43 43 GLU N N 43 118.012 118.012 116.858 1.154 25755
1242 1 5 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.078 0.131 25755
1243 1 5 . 1 1 43 43 GLU CA C 43 58.865 58.865 59.008 -0.143 25755
1244 1 5 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.196 0.041 25755
1245 1 5 . 1 1 43 43 GLU H H 43 9.081 9.081 8.739 0.342 25755
1246 1 5 . 1 1 44 44 LYS N N 44 120.047 120.047 118.151 1.896 25755
1247 1 5 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.366 0.078 25755
1248 1 5 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.115 0.546 25755
1249 1 5 . 1 1 44 44 LYS CB C 44 32.039 32.039 32.672 -0.632 25755
1250 1 5 . 1 1 44 44 LYS H H 44 8.162 8.162 8.121 0.041 25755
1251 1 5 . 1 1 45 45 ARG N N 45 113.453 113.453 115.415 -1.962 25755
1252 1 5 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.086 -0.423 25755
1253 1 5 . 1 1 45 45 ARG CA C 45 57.736 57.736 56.777 0.959 25755
1254 1 5 . 1 1 45 45 ARG CB C 45 26.390 26.390 26.731 -0.341 25755
1255 1 5 . 1 1 45 45 ARG H H 45 8.335 8.335 8.217 0.118 25755
1256 1 5 . 1 1 46 46 ASN N N 46 118.207 118.207 117.780 0.427 25755
1257 1 5 . 1 1 46 46 ASN HA H 46 4.982 4.982 5.024 -0.042 25755
1258 1 5 . 1 1 46 46 ASN CA C 46 53.066 53.066 51.633 1.433 25755
1259 1 5 . 1 1 46 46 ASN CB C 46 39.293 39.293 39.954 -0.661 25755
1260 1 5 . 1 1 46 46 ASN H H 46 8.745 8.745 9.009 -0.264 25755
1261 1 5 . 1 1 47 47 LEU N N 47 125.815 125.815 126.347 -0.532 25755
1262 1 5 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.058 0.221 25755
1263 1 5 . 1 1 47 47 LEU CA C 47 55.290 55.290 55.166 0.124 25755
1264 1 5 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.736 1.570 25755
1265 1 5 . 1 1 47 47 LEU H H 47 8.509 8.509 8.752 -0.243 25755
1266 1 5 . 1 1 48 48 GLN N N 48 120.834 120.834 121.581 -0.747 25755
1267 1 5 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.656 0.080 25755
1268 1 5 . 1 1 48 48 GLN CA C 48 54.105 54.105 53.779 0.326 25755
1269 1 5 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.679 -0.813 25755
1270 1 5 . 1 1 48 48 GLN H H 48 8.589 8.589 8.989 -0.400 25755
1271 1 5 . 1 1 49 49 CYS N N 49 121.829 121.829 122.645 -0.816 25755
1272 1 5 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.466 0.392 25755
1273 1 5 . 1 1 49 49 CYS CA C 49 54.955 54.955 59.303 -4.348 25755
1274 1 5 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.557 12.888 25755
1275 1 5 . 1 1 49 49 CYS H H 49 9.247 9.247 9.012 0.235 25755
1276 1 5 . 1 1 50 50 ILE N N 50 129.010 129.010 129.398 -0.388 25755
1277 1 5 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.430 -0.044 25755
1278 1 5 . 1 1 50 50 ILE CA C 50 60.421 60.421 61.962 -1.541 25755
1279 1 5 . 1 1 50 50 ILE CB C 50 38.404 38.404 38.862 -0.458 25755
1280 1 5 . 1 1 50 50 ILE H H 50 8.787 8.787 7.976 0.811 25755
1281 1 5 . 1 1 51 51 CYS N N 51 126.108 126.108 126.987 -0.879 25755
1282 1 5 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.630 0.707 25755
1283 1 5 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.455 -6.637 25755
1284 1 5 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.787 6.195 25755
1285 1 5 . 1 1 51 51 CYS H H 51 8.556 8.556 9.323 -0.767 25755
1286 1 5 . 1 1 52 52 ASP N N 52 122.342 122.342 119.859 2.483 25755
1287 1 5 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.852 0.661 25755
1288 1 5 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.402 -0.819 25755
1289 1 5 . 1 1 52 52 ASP CB C 52 42.831 42.831 42.513 0.318 25755
1290 1 5 . 1 1 52 52 ASP H H 52 8.826 8.826 8.449 0.377 25755
1291 1 5 . 1 1 53 53 TYR N N 53 125.370 125.370 123.462 1.908 25755
1292 1 5 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.661 -0.403 25755
1293 1 5 . 1 1 53 53 TYR CA C 53 59.665 59.665 58.823 0.842 25755
1294 1 5 . 1 1 53 53 TYR CB C 53 38.783 38.783 39.445 -0.662 25755
1295 1 5 . 1 1 53 53 TYR H H 53 9.734 9.734 8.666 1.068 25755
1296 1 5 . 1 1 54 54 CYS N N 54 120.418 120.418 121.369 -0.951 25755
1297 1 5 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.486 0.008 25755
1298 1 5 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.698 -4.555 25755
1299 1 5 . 1 1 54 54 CYS CB C 54 44.382 44.382 28.719 15.663 25755
1300 1 5 . 1 1 54 54 CYS H H 54 9.478 9.478 8.845 0.633 25755
1301 1 5 . 1 1 55 55 GLU N N 55 121.097 121.097 120.386 0.711 25755
1302 1 5 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.526 -0.214 25755
1303 1 5 . 1 1 55 55 GLU CA C 55 56.010 56.010 57.351 -1.341 25755
1304 1 5 . 1 1 55 55 GLU CB C 55 31.014 31.014 30.675 0.339 25755
1305 1 5 . 1 1 55 55 GLU H H 55 8.423 8.423 8.220 0.203 25755
1306 1 6 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.801 -0.550 25755
1307 1 6 . 1 1 2 2 ASP CA C 2 59.484 59.484 54.208 5.276 25755
1308 1 6 . 1 1 2 2 ASP CB C 2 39.412 39.412 40.902 -1.490 25755
1309 1 6 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.363 -0.018 25755
1310 1 6 . 1 1 3 3 LYS CA C 3 57.556 57.556 56.343 1.213 25755
1311 1 6 . 1 1 3 3 LYS CB C 3 32.593 32.593 32.221 0.372 25755
1312 1 6 . 1 1 4 4 CYS N N 4 117.049 117.049 118.073 -1.024 25755
1313 1 6 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.871 -0.143 25755
1314 1 6 . 1 1 4 4 CYS CA C 4 57.415 57.415 56.842 0.573 25755
1315 1 6 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.681 12.162 25755
1316 1 6 . 1 1 4 4 CYS H H 4 8.486 8.486 7.749 0.737 25755
1317 1 6 . 1 1 5 5 LYS N N 5 118.790 118.790 121.218 -2.428 25755
1318 1 6 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.851 0.720 25755
1319 1 6 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.735 -0.445 25755
1320 1 6 . 1 1 5 5 LYS CB C 5 34.606 34.606 35.000 -0.394 25755
1321 1 6 . 1 1 5 5 LYS H H 5 8.007 8.007 8.237 -0.230 25755
1322 1 6 . 1 1 6 6 LYS N N 6 121.177 121.177 120.610 0.567 25755
1323 1 6 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.561 0.224 25755
1324 1 6 . 1 1 6 6 LYS CA C 6 55.542 55.542 56.024 -0.482 25755
1325 1 6 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.487 1.415 25755
1326 1 6 . 1 1 6 6 LYS H H 6 9.014 9.014 8.816 0.198 25755
1327 1 6 . 1 1 7 7 VAL N N 7 127.629 127.629 124.502 3.127 25755
1328 1 6 . 1 1 7 7 VAL HA H 7 4.026 4.026 4.014 0.012 25755
1329 1 6 . 1 1 7 7 VAL CA C 7 63.988 63.988 62.480 1.508 25755
1330 1 6 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.082 1.025 25755
1331 1 6 . 1 1 7 7 VAL H H 7 8.837 8.837 8.574 0.263 25755
1332 1 6 . 1 1 8 8 TYR N N 8 130.003 130.003 129.270 0.733 25755
1333 1 6 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.698 -0.239 25755
1334 1 6 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.366 0.354 25755
1335 1 6 . 1 1 8 8 TYR CB C 8 36.018 36.018 38.028 -2.010 25755
1336 1 6 . 1 1 8 8 TYR H H 8 9.251 9.251 8.190 1.061 25755
1337 1 6 . 1 1 9 9 GLU N N 9 130.851 130.851 124.873 5.978 25755
1338 1 6 . 1 1 9 9 GLU HA H 9 4.204 4.204 4.007 0.197 25755
1339 1 6 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.794 -0.277 25755
1340 1 6 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.463 -0.072 25755
1341 1 6 . 1 1 9 9 GLU H H 9 9.072 9.072 8.444 0.628 25755
1342 1 6 . 1 1 10 10 ASN N N 10 116.120 116.120 117.842 -1.722 25755
1343 1 6 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.555 -0.117 25755
1344 1 6 . 1 1 10 10 ASN CA C 10 54.587 54.587 53.108 1.479 25755
1345 1 6 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.305 -0.027 25755
1346 1 6 . 1 1 10 10 ASN H H 10 9.301 9.301 7.781 1.520 25755
1347 1 6 . 1 1 11 11 TYR N N 11 122.436 122.436 120.812 1.624 25755
1348 1 6 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.641 -0.447 25755
1349 1 6 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.386 2.226 25755
1350 1 6 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.912 -2.445 25755
1351 1 6 . 1 1 11 11 TYR H H 11 7.550 7.550 7.591 -0.041 25755
1352 1 6 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.519 -0.072 25755
1353 1 6 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.493 0.005 25755
1354 1 6 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.641 -2.050 25755
1355 1 6 . 1 1 13 13 VAL N N 13 124.506 124.506 122.113 2.393 25755
1356 1 6 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.734 0.102 25755
1357 1 6 . 1 1 13 13 VAL CA C 13 65.761 65.761 64.655 1.106 25755
1358 1 6 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.437 0.143 25755
1359 1 6 . 1 1 13 13 VAL H H 13 8.169 8.169 8.445 -0.276 25755
1360 1 6 . 1 1 14 14 SER N N 14 116.625 116.625 116.233 0.392 25755
1361 1 6 . 1 1 14 14 SER HA H 14 4.206 4.206 4.174 0.032 25755
1362 1 6 . 1 1 14 14 SER CA C 14 61.194 61.194 62.397 -1.203 25755
1363 1 6 . 1 1 14 14 SER CB C 14 62.041 62.041 62.774 -0.733 25755
1364 1 6 . 1 1 14 14 SER H H 14 8.396 8.396 8.185 0.211 25755
1365 1 6 . 1 1 15 15 LYS N N 15 120.843 120.843 122.237 -1.394 25755
1366 1 6 . 1 1 15 15 LYS HA H 15 4.200 4.200 3.967 0.233 25755
1367 1 6 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.296 0.327 25755
1368 1 6 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.117 0.069 25755
1369 1 6 . 1 1 15 15 LYS H H 15 7.791 7.791 7.619 0.172 25755
1370 1 6 . 1 1 16 16 CYS N N 16 115.949 115.949 116.423 -0.474 25755
1371 1 6 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.557 0.336 25755
1372 1 6 . 1 1 16 16 CYS CA C 16 56.570 56.570 60.830 -4.260 25755
1373 1 6 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.454 14.983 25755
1374 1 6 . 1 1 16 16 CYS H H 16 7.870 7.870 7.505 0.365 25755
1375 1 6 . 1 1 17 17 GLN N N 17 117.241 117.241 116.826 0.415 25755
1376 1 6 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.226 0.048 25755
1377 1 6 . 1 1 17 17 GLN CA C 17 56.937 56.937 56.352 0.585 25755
1378 1 6 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.851 0.337 25755
1379 1 6 . 1 1 17 17 GLN H H 17 7.560 7.560 7.564 -0.004 25755
1380 1 6 . 1 1 18 18 LEU N N 18 120.537 120.537 122.217 -1.680 25755
1381 1 6 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.202 0.238 25755
1382 1 6 . 1 1 18 18 LEU CA C 18 55.448 55.448 55.085 0.363 25755
1383 1 6 . 1 1 18 18 LEU CB C 18 41.837 41.837 40.906 0.931 25755
1384 1 6 . 1 1 18 18 LEU H H 18 7.369 7.369 7.496 -0.127 25755
1385 1 6 . 1 1 19 19 ARG N N 19 121.697 121.697 123.452 -1.755 25755
1386 1 6 . 1 1 19 19 ARG HA H 19 4.299 4.299 4.036 0.263 25755
1387 1 6 . 1 1 19 19 ARG CA C 19 57.836 57.836 58.469 -0.633 25755
1388 1 6 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.000 0.392 25755
1389 1 6 . 1 1 19 19 ARG H H 19 8.447 8.447 8.081 0.366 25755
1390 1 6 . 1 1 20 20 ILE N N 20 116.439 116.439 116.237 0.202 25755
1391 1 6 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.069 0.065 25755
1392 1 6 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.342 0.155 25755
1393 1 6 . 1 1 20 20 ILE CB C 20 38.164 38.164 38.172 -0.008 25755
1394 1 6 . 1 1 20 20 ILE H H 20 7.758 7.758 7.772 -0.014 25755
1395 1 6 . 1 1 21 21 ALA N N 21 122.642 122.642 122.847 -0.205 25755
1396 1 6 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.575 -0.193 25755
1397 1 6 . 1 1 21 21 ALA CA C 21 52.395 52.395 51.658 0.737 25755
1398 1 6 . 1 1 21 21 ALA CB C 21 20.098 20.098 19.799 0.299 25755
1399 1 6 . 1 1 21 21 ALA H H 21 7.727 7.727 7.359 0.368 25755
1400 1 6 . 1 1 22 22 ASN N N 22 116.616 116.616 121.916 -5.300 25755
1401 1 6 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.877 -0.086 25755
1402 1 6 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.440 0.437 25755
1403 1 6 . 1 1 22 22 ASN CB C 22 37.554 37.554 38.022 -0.468 25755
1404 1 6 . 1 1 22 22 ASN H H 22 8.307 8.307 8.548 -0.241 25755
1405 1 6 . 1 1 23 23 GLN N N 23 124.357 124.357 123.868 0.489 25755
1406 1 6 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.290 -0.272 25755
1407 1 6 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.576 1.072 25755
1408 1 6 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.724 0.674 25755
1409 1 6 . 1 1 23 23 GLN H H 23 8.542 8.542 8.301 0.241 25755
1410 1 6 . 1 1 24 24 CYS N N 24 118.909 118.909 119.254 -0.345 25755
1411 1 6 . 1 1 24 24 CYS HA H 24 4.284 4.284 4.141 0.143 25755
1412 1 6 . 1 1 24 24 CYS CA C 24 58.406 58.406 63.118 -4.713 25755
1413 1 6 . 1 1 24 24 CYS CB C 24 38.776 38.776 27.016 11.760 25755
1414 1 6 . 1 1 24 24 CYS H H 24 8.352 8.352 8.503 -0.151 25755
1415 1 6 . 1 1 25 25 ASN N N 25 118.182 118.182 119.277 -1.095 25755
1416 1 6 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.261 -0.373 25755
1417 1 6 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.458 1.214 25755
1418 1 6 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.299 2.474 25755
1419 1 6 . 1 1 25 25 ASN H H 25 7.504 7.504 8.466 -0.962 25755
1420 1 6 . 1 1 26 26 TYR N N 26 117.354 117.354 119.331 -1.977 25755
1421 1 6 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.176 -0.211 25755
1422 1 6 . 1 1 26 26 TYR CA C 26 62.162 62.162 61.901 0.261 25755
1423 1 6 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.918 -0.288 25755
1424 1 6 . 1 1 26 26 TYR H H 26 7.322 7.322 7.553 -0.231 25755
1425 1 6 . 1 1 27 27 ASP N N 27 119.874 119.874 120.172 -0.298 25755
1426 1 6 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.321 0.334 25755
1427 1 6 . 1 1 27 27 ASP CB C 27 40.590 40.590 40.924 -0.334 25755
1428 1 6 . 1 1 27 27 ASP H H 27 9.218 9.218 8.261 0.957 25755
1429 1 6 . 1 1 28 28 CYS N N 28 119.782 119.782 118.982 0.800 25755
1430 1 6 . 1 1 28 28 CYS HA H 28 4.168 4.168 3.916 0.252 25755
1431 1 6 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.414 -1.500 25755
1432 1 6 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.267 10.678 25755
1433 1 6 . 1 1 28 28 CYS H H 28 9.171 9.171 8.302 0.869 25755
1434 1 6 . 1 1 29 29 LYS N N 29 119.663 119.663 119.133 0.530 25755
1435 1 6 . 1 1 29 29 LYS HA H 29 4.137 4.137 3.983 0.154 25755
1436 1 6 . 1 1 29 29 LYS CA C 29 59.781 59.781 59.045 0.735 25755
1437 1 6 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.868 0.545 25755
1438 1 6 . 1 1 29 29 LYS H H 29 7.546 7.546 7.468 0.078 25755
1439 1 6 . 1 1 30 30 LEU N N 30 119.987 119.987 120.926 -0.939 25755
1440 1 6 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.847 0.264 25755
1441 1 6 . 1 1 30 30 LEU CA C 30 57.672 57.672 57.743 -0.071 25755
1442 1 6 . 1 1 30 30 LEU CB C 30 42.379 42.379 42.255 0.124 25755
1443 1 6 . 1 1 30 30 LEU H H 30 8.226 8.226 7.779 0.447 25755
1444 1 6 . 1 1 31 31 ASP N N 31 116.853 116.853 117.469 -0.616 25755
1445 1 6 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.537 0.009 25755
1446 1 6 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.456 0.810 25755
1447 1 6 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.103 -0.625 25755
1448 1 6 . 1 1 31 31 ASP H H 31 9.019 9.019 7.913 1.106 25755
1449 1 6 . 1 1 32 32 LYS N N 32 112.075 112.075 118.555 -6.480 25755
1450 1 6 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.116 0.433 25755
1451 1 6 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.799 -4.334 25755
1452 1 6 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.611 -0.747 25755
1453 1 6 . 1 1 32 32 LYS H H 32 6.639 6.639 8.227 -1.588 25755
1454 1 6 . 1 1 33 33 HIS N N 33 112.955 112.955 114.497 -1.542 25755
1455 1 6 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.276 0.347 25755
1456 1 6 . 1 1 33 33 HIS CA C 33 56.486 56.486 56.453 0.033 25755
1457 1 6 . 1 1 33 33 HIS CB C 33 25.694 25.694 27.507 -1.813 25755
1458 1 6 . 1 1 33 33 HIS H H 33 7.065 7.065 8.072 -1.007 25755
1459 1 6 . 1 1 34 34 ALA N N 34 120.177 120.177 119.404 0.773 25755
1460 1 6 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.617 0.532 25755
1461 1 6 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.407 -1.627 25755
1462 1 6 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.530 -0.412 25755
1463 1 6 . 1 1 34 34 ALA H H 34 7.716 7.716 7.074 0.642 25755
1464 1 6 . 1 1 35 35 ARG N N 35 116.636 116.636 117.228 -0.592 25755
1465 1 6 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.086 0.120 25755
1466 1 6 . 1 1 35 35 ARG CA C 35 58.076 58.076 58.182 -0.106 25755
1467 1 6 . 1 1 35 35 ARG CB C 35 30.717 30.717 30.152 0.565 25755
1468 1 6 . 1 1 35 35 ARG H H 35 8.295 8.295 8.049 0.246 25755
1469 1 6 . 1 1 36 36 SER N N 36 109.273 109.273 110.897 -1.624 25755
1470 1 6 . 1 1 36 36 SER HA H 36 4.646 4.646 4.411 0.235 25755
1471 1 6 . 1 1 36 36 SER CA C 36 57.703 57.703 57.955 -0.252 25755
1472 1 6 . 1 1 36 36 SER CB C 36 65.425 65.425 65.047 0.378 25755
1473 1 6 . 1 1 36 36 SER H H 36 8.026 8.026 7.949 0.077 25755
1474 1 6 . 1 1 37 37 GLY N N 37 107.305 107.305 109.089 -1.784 25755
1475 1 6 . 1 1 37 37 GLY CA C 37 47.152 47.152 44.792 2.360 25755
1476 1 6 . 1 1 37 37 GLY H H 37 8.679 8.679 7.782 0.897 25755
1477 1 6 . 1 1 38 38 GLU N N 38 119.065 119.065 122.061 -2.996 25755
1478 1 6 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.563 -0.161 25755
1479 1 6 . 1 1 38 38 GLU CA C 38 55.773 55.773 54.811 0.962 25755
1480 1 6 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.904 -2.082 25755
1481 1 6 . 1 1 38 38 GLU H H 38 8.351 8.351 8.866 -0.515 25755
1482 1 6 . 1 1 39 39 CYS N N 39 121.636 121.636 118.396 3.240 25755
1483 1 6 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.428 0.559 25755
1484 1 6 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.636 -0.908 25755
1485 1 6 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.669 16.350 25755
1486 1 6 . 1 1 39 39 CYS H H 39 8.839 8.839 8.273 0.566 25755
1487 1 6 . 1 1 40 40 PHE N N 40 121.987 121.987 120.191 1.796 25755
1488 1 6 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.825 -0.055 25755
1489 1 6 . 1 1 40 40 PHE CA C 40 56.969 56.969 56.557 0.412 25755
1490 1 6 . 1 1 40 40 PHE CB C 40 43.760 43.760 42.856 0.904 25755
1491 1 6 . 1 1 40 40 PHE H H 40 9.214 9.214 8.897 0.317 25755
1492 1 6 . 1 1 41 41 TYR N N 41 121.905 121.905 119.630 2.275 25755
1493 1 6 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.642 0.318 25755
1494 1 6 . 1 1 41 41 TYR CA C 41 58.532 58.532 59.234 -0.702 25755
1495 1 6 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.142 1.160 25755
1496 1 6 . 1 1 41 41 TYR H H 41 8.557 8.557 8.731 -0.174 25755
1497 1 6 . 1 1 42 42 ASP N N 42 123.133 123.133 121.063 2.070 25755
1498 1 6 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.847 -0.094 25755
1499 1 6 . 1 1 42 42 ASP CA C 42 52.426 52.426 52.933 -0.507 25755
1500 1 6 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.618 -0.998 25755
1501 1 6 . 1 1 42 42 ASP H H 42 8.603 8.603 7.933 0.670 25755
1502 1 6 . 1 1 43 43 GLU N N 43 118.012 118.012 119.446 -1.434 25755
1503 1 6 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.148 0.061 25755
1504 1 6 . 1 1 43 43 GLU CA C 43 58.865 58.865 58.700 0.165 25755
1505 1 6 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.592 -0.355 25755
1506 1 6 . 1 1 43 43 GLU H H 43 9.081 9.081 8.711 0.370 25755
1507 1 6 . 1 1 44 44 LYS N N 44 120.047 120.047 117.510 2.537 25755
1508 1 6 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.437 0.007 25755
1509 1 6 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.401 0.260 25755
1510 1 6 . 1 1 44 44 LYS CB C 44 32.039 32.039 32.821 -0.782 25755
1511 1 6 . 1 1 44 44 LYS H H 44 8.162 8.162 7.726 0.436 25755
1512 1 6 . 1 1 45 45 ARG N N 45 113.453 113.453 116.392 -2.939 25755
1513 1 6 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.137 -0.474 25755
1514 1 6 . 1 1 45 45 ARG CA C 45 57.736 57.736 56.788 0.949 25755
1515 1 6 . 1 1 45 45 ARG CB C 45 26.390 26.390 27.528 -1.138 25755
1516 1 6 . 1 1 45 45 ARG H H 45 8.335 8.335 7.732 0.603 25755
1517 1 6 . 1 1 46 46 ASN N N 46 118.207 118.207 116.586 1.621 25755
1518 1 6 . 1 1 46 46 ASN HA H 46 4.982 4.982 4.947 0.035 25755
1519 1 6 . 1 1 46 46 ASN CA C 46 53.066 53.066 52.010 1.056 25755
1520 1 6 . 1 1 46 46 ASN CB C 46 39.293 39.293 38.957 0.336 25755
1521 1 6 . 1 1 46 46 ASN H H 46 8.745 8.745 8.282 0.463 25755
1522 1 6 . 1 1 47 47 LEU N N 47 125.815 125.815 126.577 -0.762 25755
1523 1 6 . 1 1 47 47 LEU HA H 47 4.279 4.279 3.977 0.302 25755
1524 1 6 . 1 1 47 47 LEU CA C 47 55.290 55.290 55.095 0.195 25755
1525 1 6 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.525 1.781 25755
1526 1 6 . 1 1 47 47 LEU H H 47 8.509 8.509 8.726 -0.217 25755
1527 1 6 . 1 1 48 48 GLN N N 48 120.834 120.834 122.397 -1.563 25755
1528 1 6 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.700 0.036 25755
1529 1 6 . 1 1 48 48 GLN CA C 48 54.105 54.105 53.932 0.173 25755
1530 1 6 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.907 -1.041 25755
1531 1 6 . 1 1 48 48 GLN H H 48 8.589 8.589 8.956 -0.367 25755
1532 1 6 . 1 1 49 49 CYS N N 49 121.829 121.829 122.939 -1.110 25755
1533 1 6 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.658 0.200 25755
1534 1 6 . 1 1 49 49 CYS CA C 49 54.955 54.955 58.452 -3.497 25755
1535 1 6 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.570 12.875 25755
1536 1 6 . 1 1 49 49 CYS H H 49 9.247 9.247 9.010 0.237 25755
1537 1 6 . 1 1 50 50 ILE N N 50 129.010 129.010 130.100 -1.090 25755
1538 1 6 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.412 -0.026 25755
1539 1 6 . 1 1 50 50 ILE CA C 50 60.421 60.421 62.161 -1.740 25755
1540 1 6 . 1 1 50 50 ILE CB C 50 38.404 38.404 38.723 -0.319 25755
1541 1 6 . 1 1 50 50 ILE H H 50 8.787 8.787 7.957 0.830 25755
1542 1 6 . 1 1 51 51 CYS N N 51 126.108 126.108 127.268 -1.160 25755
1543 1 6 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.626 0.711 25755
1544 1 6 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.631 -6.813 25755
1545 1 6 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.441 6.541 25755
1546 1 6 . 1 1 51 51 CYS H H 51 8.556 8.556 9.316 -0.760 25755
1547 1 6 . 1 1 52 52 ASP N N 52 122.342 122.342 119.678 2.664 25755
1548 1 6 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.834 0.679 25755
1549 1 6 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.464 -0.881 25755
1550 1 6 . 1 1 52 52 ASP CB C 52 42.831 42.831 42.649 0.182 25755
1551 1 6 . 1 1 52 52 ASP H H 52 8.826 8.826 8.474 0.352 25755
1552 1 6 . 1 1 53 53 TYR N N 53 125.370 125.370 123.557 1.813 25755
1553 1 6 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.584 -0.326 25755
1554 1 6 . 1 1 53 53 TYR CA C 53 59.665 59.665 58.750 0.915 25755
1555 1 6 . 1 1 53 53 TYR CB C 53 38.783 38.783 39.771 -0.988 25755
1556 1 6 . 1 1 53 53 TYR H H 53 9.734 9.734 8.667 1.067 25755
1557 1 6 . 1 1 54 54 CYS N N 54 120.418 120.418 121.889 -1.471 25755
1558 1 6 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.473 0.021 25755
1559 1 6 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.614 -4.471 25755
1560 1 6 . 1 1 54 54 CYS CB C 54 44.382 44.382 29.111 15.271 25755
1561 1 6 . 1 1 54 54 CYS H H 54 9.478 9.478 8.844 0.634 25755
1562 1 6 . 1 1 55 55 GLU N N 55 121.097 121.097 119.027 2.070 25755
1563 1 6 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.443 -0.131 25755
1564 1 6 . 1 1 55 55 GLU CA C 55 56.010 56.010 56.109 -0.099 25755
1565 1 6 . 1 1 55 55 GLU CB C 55 31.014 31.014 31.980 -0.966 25755
1566 1 6 . 1 1 55 55 GLU H H 55 8.423 8.423 7.953 0.470 25755
1567 1 7 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.783 -0.532 25755
1568 1 7 . 1 1 2 2 ASP CA C 2 59.484 59.484 54.032 5.452 25755
1569 1 7 . 1 1 2 2 ASP CB C 2 39.412 39.412 39.746 -0.334 25755
1570 1 7 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.416 -0.071 25755
1571 1 7 . 1 1 3 3 LYS CA C 3 57.556 57.556 56.298 1.258 25755
1572 1 7 . 1 1 3 3 LYS CB C 3 32.593 32.593 32.459 0.134 25755
1573 1 7 . 1 1 4 4 CYS N N 4 117.049 117.049 118.794 -1.745 25755
1574 1 7 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.955 -0.227 25755
1575 1 7 . 1 1 4 4 CYS CA C 4 57.415 57.415 57.426 -0.011 25755
1576 1 7 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.540 12.303 25755
1577 1 7 . 1 1 4 4 CYS H H 4 8.486 8.486 7.997 0.489 25755
1578 1 7 . 1 1 5 5 LYS N N 5 118.790 118.790 121.129 -2.339 25755
1579 1 7 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.781 0.790 25755
1580 1 7 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.735 -0.445 25755
1581 1 7 . 1 1 5 5 LYS CB C 5 34.606 34.606 34.874 -0.268 25755
1582 1 7 . 1 1 5 5 LYS H H 5 8.007 8.007 8.180 -0.173 25755
1583 1 7 . 1 1 6 6 LYS N N 6 121.177 121.177 120.590 0.587 25755
1584 1 7 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.578 0.207 25755
1585 1 7 . 1 1 6 6 LYS CA C 6 55.542 55.542 56.144 -0.602 25755
1586 1 7 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.583 1.319 25755
1587 1 7 . 1 1 6 6 LYS H H 6 9.014 9.014 8.731 0.283 25755
1588 1 7 . 1 1 7 7 VAL N N 7 127.629 127.629 124.535 3.094 25755
1589 1 7 . 1 1 7 7 VAL HA H 7 4.026 4.026 4.058 -0.032 25755
1590 1 7 . 1 1 7 7 VAL CA C 7 63.988 63.988 62.783 1.205 25755
1591 1 7 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.512 0.595 25755
1592 1 7 . 1 1 7 7 VAL H H 7 8.837 8.837 8.585 0.252 25755
1593 1 7 . 1 1 8 8 TYR N N 8 130.003 130.003 128.874 1.129 25755
1594 1 7 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.682 -0.223 25755
1595 1 7 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.139 0.581 25755
1596 1 7 . 1 1 8 8 TYR CB C 8 36.018 36.018 36.610 -0.592 25755
1597 1 7 . 1 1 8 8 TYR H H 8 9.251 9.251 8.367 0.884 25755
1598 1 7 . 1 1 9 9 GLU N N 9 130.851 130.851 123.013 7.838 25755
1599 1 7 . 1 1 9 9 GLU HA H 9 4.204 4.204 4.115 0.089 25755
1600 1 7 . 1 1 9 9 GLU CA C 9 58.517 58.517 59.275 -0.758 25755
1601 1 7 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.691 -0.300 25755
1602 1 7 . 1 1 9 9 GLU H H 9 9.072 9.072 8.187 0.885 25755
1603 1 7 . 1 1 10 10 ASN N N 10 116.120 116.120 118.079 -1.959 25755
1604 1 7 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.845 -0.407 25755
1605 1 7 . 1 1 10 10 ASN CA C 10 54.587 54.587 52.833 1.754 25755
1606 1 7 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.960 -0.682 25755
1607 1 7 . 1 1 10 10 ASN H H 10 9.301 9.301 8.616 0.685 25755
1608 1 7 . 1 1 11 11 TYR N N 11 122.436 122.436 120.238 2.198 25755
1609 1 7 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.417 -0.223 25755
1610 1 7 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.536 2.076 25755
1611 1 7 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.782 -2.315 25755
1612 1 7 . 1 1 11 11 TYR H H 11 7.550 7.550 7.501 0.049 25755
1613 1 7 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.573 -0.126 25755
1614 1 7 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.628 -0.130 25755
1615 1 7 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.853 -2.262 25755
1616 1 7 . 1 1 13 13 VAL N N 13 124.506 124.506 121.074 3.432 25755
1617 1 7 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.774 0.062 25755
1618 1 7 . 1 1 13 13 VAL CA C 13 65.761 65.761 64.708 1.053 25755
1619 1 7 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.746 -0.166 25755
1620 1 7 . 1 1 13 13 VAL H H 13 8.169 8.169 8.407 -0.238 25755
1621 1 7 . 1 1 14 14 SER N N 14 116.625 116.625 117.518 -0.893 25755
1622 1 7 . 1 1 14 14 SER HA H 14 4.206 4.206 4.382 -0.176 25755
1623 1 7 . 1 1 14 14 SER CA C 14 61.194 61.194 62.050 -0.856 25755
1624 1 7 . 1 1 14 14 SER CB C 14 62.041 62.041 62.782 -0.741 25755
1625 1 7 . 1 1 14 14 SER H H 14 8.396 8.396 8.258 0.138 25755
1626 1 7 . 1 1 15 15 LYS N N 15 120.843 120.843 121.565 -0.722 25755
1627 1 7 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.015 0.185 25755
1628 1 7 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.191 0.432 25755
1629 1 7 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.071 0.115 25755
1630 1 7 . 1 1 15 15 LYS H H 15 7.791 7.791 7.769 0.022 25755
1631 1 7 . 1 1 16 16 CYS N N 16 115.949 115.949 118.124 -2.175 25755
1632 1 7 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.444 0.449 25755
1633 1 7 . 1 1 16 16 CYS CA C 16 56.570 56.570 61.613 -5.043 25755
1634 1 7 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.538 14.899 25755
1635 1 7 . 1 1 16 16 CYS H H 16 7.870 7.870 7.665 0.205 25755
1636 1 7 . 1 1 17 17 GLN N N 17 117.241 117.241 118.802 -1.561 25755
1637 1 7 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.052 0.222 25755
1638 1 7 . 1 1 17 17 GLN CA C 17 56.937 56.937 57.510 -0.573 25755
1639 1 7 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.590 0.597 25755
1640 1 7 . 1 1 17 17 GLN H H 17 7.560 7.560 7.778 -0.218 25755
1641 1 7 . 1 1 18 18 LEU N N 18 120.537 120.537 121.535 -0.998 25755
1642 1 7 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.138 0.302 25755
1643 1 7 . 1 1 18 18 LEU CA C 18 55.448 55.448 55.120 0.328 25755
1644 1 7 . 1 1 18 18 LEU CB C 18 41.837 41.837 40.862 0.975 25755
1645 1 7 . 1 1 18 18 LEU H H 18 7.369 7.369 7.425 -0.056 25755
1646 1 7 . 1 1 19 19 ARG N N 19 121.697 121.697 122.412 -0.715 25755
1647 1 7 . 1 1 19 19 ARG HA H 19 4.299 4.299 4.020 0.279 25755
1648 1 7 . 1 1 19 19 ARG CA C 19 57.836 57.836 58.425 -0.589 25755
1649 1 7 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.006 0.386 25755
1650 1 7 . 1 1 19 19 ARG H H 19 8.447 8.447 8.114 0.333 25755
1651 1 7 . 1 1 20 20 ILE N N 20 116.439 116.439 116.328 0.111 25755
1652 1 7 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.060 0.074 25755
1653 1 7 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.343 0.154 25755
1654 1 7 . 1 1 20 20 ILE CB C 20 38.164 38.164 38.131 0.033 25755
1655 1 7 . 1 1 20 20 ILE H H 20 7.758 7.758 7.758 0.000 25755
1656 1 7 . 1 1 21 21 ALA N N 21 122.642 122.642 122.844 -0.202 25755
1657 1 7 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.542 -0.160 25755
1658 1 7 . 1 1 21 21 ALA CA C 21 52.395 52.395 51.617 0.778 25755
1659 1 7 . 1 1 21 21 ALA CB C 21 20.098 20.098 19.759 0.339 25755
1660 1 7 . 1 1 21 21 ALA H H 21 7.727 7.727 7.338 0.389 25755
1661 1 7 . 1 1 22 22 ASN N N 22 116.616 116.616 121.845 -5.229 25755
1662 1 7 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.683 0.108 25755
1663 1 7 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.441 0.436 25755
1664 1 7 . 1 1 22 22 ASN CB C 22 37.554 37.554 37.971 -0.417 25755
1665 1 7 . 1 1 22 22 ASN H H 22 8.307 8.307 8.508 -0.201 25755
1666 1 7 . 1 1 23 23 GLN N N 23 124.357 124.357 122.976 1.381 25755
1667 1 7 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.307 -0.289 25755
1668 1 7 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.781 0.867 25755
1669 1 7 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.565 0.834 25755
1670 1 7 . 1 1 23 23 GLN H H 23 8.542 8.542 8.104 0.438 25755
1671 1 7 . 1 1 24 24 CYS N N 24 118.909 118.909 118.904 0.005 25755
1672 1 7 . 1 1 24 24 CYS HA H 24 4.284 4.284 4.061 0.223 25755
1673 1 7 . 1 1 24 24 CYS CA C 24 58.406 58.406 62.411 -4.005 25755
1674 1 7 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.802 11.974 25755
1675 1 7 . 1 1 24 24 CYS H H 24 8.352 8.352 8.724 -0.372 25755
1676 1 7 . 1 1 25 25 ASN N N 25 118.182 118.182 119.819 -1.637 25755
1677 1 7 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.299 -0.411 25755
1678 1 7 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.781 0.891 25755
1679 1 7 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.207 2.566 25755
1680 1 7 . 1 1 25 25 ASN H H 25 7.504 7.504 8.475 -0.971 25755
1681 1 7 . 1 1 26 26 TYR N N 26 117.354 117.354 120.151 -2.797 25755
1682 1 7 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.221 -0.256 25755
1683 1 7 . 1 1 26 26 TYR CA C 26 62.162 62.162 61.256 0.906 25755
1684 1 7 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.630 -0.000 25755
1685 1 7 . 1 1 26 26 TYR H H 26 7.322 7.322 7.596 -0.274 25755
1686 1 7 . 1 1 27 27 ASP N N 27 119.874 119.874 120.142 -0.268 25755
1687 1 7 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.348 0.307 25755
1688 1 7 . 1 1 27 27 ASP CB C 27 40.590 40.590 41.183 -0.593 25755
1689 1 7 . 1 1 27 27 ASP H H 27 9.218 9.218 8.187 1.031 25755
1690 1 7 . 1 1 28 28 CYS N N 28 119.782 119.782 118.952 0.830 25755
1691 1 7 . 1 1 28 28 CYS HA H 28 4.168 4.168 4.084 0.084 25755
1692 1 7 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.621 -1.707 25755
1693 1 7 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.388 10.557 25755
1694 1 7 . 1 1 28 28 CYS H H 28 9.171 9.171 8.521 0.650 25755
1695 1 7 . 1 1 29 29 LYS N N 29 119.663 119.663 118.597 1.066 25755
1696 1 7 . 1 1 29 29 LYS HA H 29 4.137 4.137 3.855 0.282 25755
1697 1 7 . 1 1 29 29 LYS CA C 29 59.781 59.781 59.049 0.732 25755
1698 1 7 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.784 0.629 25755
1699 1 7 . 1 1 29 29 LYS H H 29 7.546 7.546 7.442 0.104 25755
1700 1 7 . 1 1 30 30 LEU N N 30 119.987 119.987 119.423 0.564 25755
1701 1 7 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.833 0.278 25755
1702 1 7 . 1 1 30 30 LEU CA C 30 57.672 57.672 58.333 -0.661 25755
1703 1 7 . 1 1 30 30 LEU CB C 30 42.379 42.379 42.093 0.286 25755
1704 1 7 . 1 1 30 30 LEU H H 30 8.226 8.226 7.523 0.703 25755
1705 1 7 . 1 1 31 31 ASP N N 31 116.853 116.853 116.598 0.255 25755
1706 1 7 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.661 -0.115 25755
1707 1 7 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.818 0.448 25755
1708 1 7 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.802 -1.324 25755
1709 1 7 . 1 1 31 31 ASP H H 31 9.019 9.019 7.865 1.154 25755
1710 1 7 . 1 1 32 32 LYS N N 32 112.075 112.075 119.100 -7.025 25755
1711 1 7 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.154 0.395 25755
1712 1 7 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.642 -4.177 25755
1713 1 7 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.496 -0.631 25755
1714 1 7 . 1 1 32 32 LYS H H 32 6.639 6.639 8.290 -1.651 25755
1715 1 7 . 1 1 33 33 HIS N N 33 112.955 112.955 113.454 -0.499 25755
1716 1 7 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.152 0.471 25755
1717 1 7 . 1 1 33 33 HIS CA C 33 56.486 56.486 56.698 -0.212 25755
1718 1 7 . 1 1 33 33 HIS CB C 33 25.694 25.694 27.668 -1.974 25755
1719 1 7 . 1 1 33 33 HIS H H 33 7.065 7.065 8.083 -1.018 25755
1720 1 7 . 1 1 34 34 ALA N N 34 120.177 120.177 119.396 0.781 25755
1721 1 7 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.688 0.461 25755
1722 1 7 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.490 -1.711 25755
1723 1 7 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.456 -0.338 25755
1724 1 7 . 1 1 34 34 ALA H H 34 7.716 7.716 7.056 0.660 25755
1725 1 7 . 1 1 35 35 ARG N N 35 116.636 116.636 117.047 -0.411 25755
1726 1 7 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.124 0.082 25755
1727 1 7 . 1 1 35 35 ARG CA C 35 58.076 58.076 58.386 -0.310 25755
1728 1 7 . 1 1 35 35 ARG CB C 35 30.717 30.717 30.113 0.603 25755
1729 1 7 . 1 1 35 35 ARG H H 35 8.295 8.295 8.039 0.256 25755
1730 1 7 . 1 1 36 36 SER N N 36 109.273 109.273 111.903 -2.630 25755
1731 1 7 . 1 1 36 36 SER HA H 36 4.646 4.646 4.517 0.129 25755
1732 1 7 . 1 1 36 36 SER CA C 36 57.703 57.703 57.861 -0.159 25755
1733 1 7 . 1 1 36 36 SER CB C 36 65.425 65.425 65.034 0.391 25755
1734 1 7 . 1 1 36 36 SER H H 36 8.026 8.026 8.011 0.015 25755
1735 1 7 . 1 1 37 37 GLY N N 37 107.305 107.305 111.093 -3.788 25755
1736 1 7 . 1 1 37 37 GLY CA C 37 47.152 47.152 44.851 2.301 25755
1737 1 7 . 1 1 37 37 GLY H H 37 8.679 8.679 7.833 0.846 25755
1738 1 7 . 1 1 38 38 GLU N N 38 119.065 119.065 122.359 -3.294 25755
1739 1 7 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.560 -0.158 25755
1740 1 7 . 1 1 38 38 GLU CA C 38 55.773 55.773 54.750 1.023 25755
1741 1 7 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.946 -2.124 25755
1742 1 7 . 1 1 38 38 GLU H H 38 8.351 8.351 8.869 -0.518 25755
1743 1 7 . 1 1 39 39 CYS N N 39 121.636 121.636 118.523 3.113 25755
1744 1 7 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.344 0.643 25755
1745 1 7 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.717 -0.989 25755
1746 1 7 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.441 16.578 25755
1747 1 7 . 1 1 39 39 CYS H H 39 8.839 8.839 8.282 0.557 25755
1748 1 7 . 1 1 40 40 PHE N N 40 121.987 121.987 120.387 1.600 25755
1749 1 7 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.785 -0.015 25755
1750 1 7 . 1 1 40 40 PHE CA C 40 56.969 56.969 56.524 0.445 25755
1751 1 7 . 1 1 40 40 PHE CB C 40 43.760 43.760 42.914 0.846 25755
1752 1 7 . 1 1 40 40 PHE H H 40 9.214 9.214 8.810 0.404 25755
1753 1 7 . 1 1 41 41 TYR N N 41 121.905 121.905 118.951 2.954 25755
1754 1 7 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.643 0.317 25755
1755 1 7 . 1 1 41 41 TYR CA C 41 58.532 58.532 59.013 -0.481 25755
1756 1 7 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.255 1.047 25755
1757 1 7 . 1 1 41 41 TYR H H 41 8.557 8.557 8.663 -0.106 25755
1758 1 7 . 1 1 42 42 ASP N N 42 123.133 123.133 121.090 2.043 25755
1759 1 7 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.830 -0.077 25755
1760 1 7 . 1 1 42 42 ASP CA C 42 52.426 52.426 52.981 -0.555 25755
1761 1 7 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.694 -1.073 25755
1762 1 7 . 1 1 42 42 ASP H H 42 8.603 8.603 8.019 0.584 25755
1763 1 7 . 1 1 43 43 GLU N N 43 118.012 118.012 119.949 -1.937 25755
1764 1 7 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.147 0.062 25755
1765 1 7 . 1 1 43 43 GLU CA C 43 58.865 58.865 58.951 -0.086 25755
1766 1 7 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.568 -0.331 25755
1767 1 7 . 1 1 43 43 GLU H H 43 9.081 9.081 8.714 0.367 25755
1768 1 7 . 1 1 44 44 LYS N N 44 120.047 120.047 117.176 2.871 25755
1769 1 7 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.361 0.083 25755
1770 1 7 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.648 0.013 25755
1771 1 7 . 1 1 44 44 LYS CB C 44 32.039 32.039 32.492 -0.453 25755
1772 1 7 . 1 1 44 44 LYS H H 44 8.162 8.162 7.962 0.200 25755
1773 1 7 . 1 1 45 45 ARG N N 45 113.453 113.453 115.779 -2.326 25755
1774 1 7 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.063 -0.400 25755
1775 1 7 . 1 1 45 45 ARG CA C 45 57.736 57.736 56.792 0.944 25755
1776 1 7 . 1 1 45 45 ARG CB C 45 26.390 26.390 27.548 -1.158 25755
1777 1 7 . 1 1 45 45 ARG H H 45 8.335 8.335 7.742 0.593 25755
1778 1 7 . 1 1 46 46 ASN N N 46 118.207 118.207 117.087 1.120 25755
1779 1 7 . 1 1 46 46 ASN HA H 46 4.982 4.982 4.937 0.045 25755
1780 1 7 . 1 1 46 46 ASN CA C 46 53.066 53.066 52.087 0.979 25755
1781 1 7 . 1 1 46 46 ASN CB C 46 39.293 39.293 38.650 0.643 25755
1782 1 7 . 1 1 46 46 ASN H H 46 8.745 8.745 8.295 0.450 25755
1783 1 7 . 1 1 47 47 LEU N N 47 125.815 125.815 127.038 -1.223 25755
1784 1 7 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.042 0.237 25755
1785 1 7 . 1 1 47 47 LEU CA C 47 55.290 55.290 54.917 0.373 25755
1786 1 7 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.605 1.702 25755
1787 1 7 . 1 1 47 47 LEU H H 47 8.509 8.509 8.825 -0.317 25755
1788 1 7 . 1 1 48 48 GLN N N 48 120.834 120.834 122.216 -1.382 25755
1789 1 7 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.703 0.033 25755
1790 1 7 . 1 1 48 48 GLN CA C 48 54.105 54.105 53.812 0.293 25755
1791 1 7 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.803 -0.937 25755
1792 1 7 . 1 1 48 48 GLN H H 48 8.589 8.589 8.858 -0.269 25755
1793 1 7 . 1 1 49 49 CYS N N 49 121.829 121.829 123.030 -1.201 25755
1794 1 7 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.562 0.296 25755
1795 1 7 . 1 1 49 49 CYS CA C 49 54.955 54.955 58.720 -3.765 25755
1796 1 7 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.472 12.973 25755
1797 1 7 . 1 1 49 49 CYS H H 49 9.247 9.247 9.045 0.202 25755
1798 1 7 . 1 1 50 50 ILE N N 50 129.010 129.010 130.259 -1.249 25755
1799 1 7 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.456 -0.070 25755
1800 1 7 . 1 1 50 50 ILE CA C 50 60.421 60.421 61.921 -1.500 25755
1801 1 7 . 1 1 50 50 ILE CB C 50 38.404 38.404 38.919 -0.515 25755
1802 1 7 . 1 1 50 50 ILE H H 50 8.787 8.787 7.956 0.831 25755
1803 1 7 . 1 1 51 51 CYS N N 51 126.108 126.108 127.137 -1.029 25755
1804 1 7 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.656 0.681 25755
1805 1 7 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.588 -6.770 25755
1806 1 7 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.691 6.291 25755
1807 1 7 . 1 1 51 51 CYS H H 51 8.556 8.556 9.315 -0.759 25755
1808 1 7 . 1 1 52 52 ASP N N 52 122.342 122.342 119.697 2.645 25755
1809 1 7 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.834 0.679 25755
1810 1 7 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.443 -0.860 25755
1811 1 7 . 1 1 52 52 ASP CB C 52 42.831 42.831 42.699 0.132 25755
1812 1 7 . 1 1 52 52 ASP H H 52 8.826 8.826 8.467 0.359 25755
1813 1 7 . 1 1 53 53 TYR N N 53 125.370 125.370 123.718 1.652 25755
1814 1 7 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.573 -0.315 25755
1815 1 7 . 1 1 53 53 TYR CA C 53 59.665 59.665 58.748 0.917 25755
1816 1 7 . 1 1 53 53 TYR CB C 53 38.783 38.783 39.601 -0.818 25755
1817 1 7 . 1 1 53 53 TYR H H 53 9.734 9.734 8.633 1.101 25755
1818 1 7 . 1 1 54 54 CYS N N 54 120.418 120.418 121.031 -0.613 25755
1819 1 7 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.384 0.110 25755
1820 1 7 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.758 -4.615 25755
1821 1 7 . 1 1 54 54 CYS CB C 54 44.382 44.382 28.594 15.788 25755
1822 1 7 . 1 1 54 54 CYS H H 54 9.478 9.478 8.685 0.793 25755
1823 1 7 . 1 1 55 55 GLU N N 55 121.097 121.097 120.450 0.647 25755
1824 1 7 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.286 0.026 25755
1825 1 7 . 1 1 55 55 GLU CA C 55 56.010 56.010 57.339 -1.329 25755
1826 1 7 . 1 1 55 55 GLU CB C 55 31.014 31.014 30.470 0.544 25755
1827 1 7 . 1 1 55 55 GLU H H 55 8.423 8.423 8.350 0.073 25755
1828 1 8 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.730 -0.479 25755
1829 1 8 . 1 1 2 2 ASP CA C 2 59.484 59.484 53.868 5.616 25755
1830 1 8 . 1 1 2 2 ASP CB C 2 39.412 39.412 41.476 -2.064 25755
1831 1 8 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.133 0.212 25755
1832 1 8 . 1 1 3 3 LYS CA C 3 57.556 57.556 57.395 0.161 25755
1833 1 8 . 1 1 3 3 LYS CB C 3 32.593 32.593 32.779 -0.186 25755
1834 1 8 . 1 1 4 4 CYS N N 4 117.049 117.049 117.371 -0.322 25755
1835 1 8 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.847 -0.119 25755
1836 1 8 . 1 1 4 4 CYS CA C 4 57.415 57.415 56.192 1.223 25755
1837 1 8 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.419 12.424 25755
1838 1 8 . 1 1 4 4 CYS H H 4 8.486 8.486 7.730 0.756 25755
1839 1 8 . 1 1 5 5 LYS N N 5 118.790 118.790 121.146 -2.356 25755
1840 1 8 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.944 0.627 25755
1841 1 8 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.628 -0.338 25755
1842 1 8 . 1 1 5 5 LYS CB C 5 34.606 34.606 35.031 -0.425 25755
1843 1 8 . 1 1 5 5 LYS H H 5 8.007 8.007 8.261 -0.254 25755
1844 1 8 . 1 1 6 6 LYS N N 6 121.177 121.177 120.398 0.779 25755
1845 1 8 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.578 0.207 25755
1846 1 8 . 1 1 6 6 LYS CA C 6 55.542 55.542 55.851 -0.309 25755
1847 1 8 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.465 1.437 25755
1848 1 8 . 1 1 6 6 LYS H H 6 9.014 9.014 8.827 0.187 25755
1849 1 8 . 1 1 7 7 VAL N N 7 127.629 127.629 123.953 3.676 25755
1850 1 8 . 1 1 7 7 VAL HA H 7 4.026 4.026 4.109 -0.083 25755
1851 1 8 . 1 1 7 7 VAL CA C 7 63.988 63.988 61.974 2.014 25755
1852 1 8 . 1 1 7 7 VAL CB C 7 33.107 33.107 33.083 0.024 25755
1853 1 8 . 1 1 7 7 VAL H H 7 8.837 8.837 8.541 0.296 25755
1854 1 8 . 1 1 8 8 TYR N N 8 130.003 130.003 128.747 1.256 25755
1855 1 8 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.726 -0.267 25755
1856 1 8 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.506 0.214 25755
1857 1 8 . 1 1 8 8 TYR CB C 8 36.018 36.018 37.910 -1.892 25755
1858 1 8 . 1 1 8 8 TYR H H 8 9.251 9.251 7.959 1.292 25755
1859 1 8 . 1 1 9 9 GLU N N 9 130.851 130.851 124.626 6.225 25755
1860 1 8 . 1 1 9 9 GLU HA H 9 4.204 4.204 4.524 -0.320 25755
1861 1 8 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.350 0.167 25755
1862 1 8 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.858 -0.467 25755
1863 1 8 . 1 1 9 9 GLU H H 9 9.072 9.072 8.422 0.650 25755
1864 1 8 . 1 1 10 10 ASN N N 10 116.120 116.120 117.314 -1.194 25755
1865 1 8 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.905 -0.467 25755
1866 1 8 . 1 1 10 10 ASN CA C 10 54.587 54.587 53.089 1.498 25755
1867 1 8 . 1 1 10 10 ASN CB C 10 37.278 37.278 38.216 -0.938 25755
1868 1 8 . 1 1 10 10 ASN H H 10 9.301 9.301 8.449 0.852 25755
1869 1 8 . 1 1 11 11 TYR N N 11 122.436 122.436 121.495 0.941 25755
1870 1 8 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.504 -0.310 25755
1871 1 8 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.395 2.217 25755
1872 1 8 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.382 -1.915 25755
1873 1 8 . 1 1 11 11 TYR H H 11 7.550 7.550 7.514 0.036 25755
1874 1 8 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.540 -0.093 25755
1875 1 8 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.508 -0.010 25755
1876 1 8 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.831 -2.240 25755
1877 1 8 . 1 1 13 13 VAL N N 13 124.506 124.506 121.531 2.975 25755
1878 1 8 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.945 -0.109 25755
1879 1 8 . 1 1 13 13 VAL CA C 13 65.761 65.761 64.542 1.219 25755
1880 1 8 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.496 0.084 25755
1881 1 8 . 1 1 13 13 VAL H H 13 8.169 8.169 8.437 -0.268 25755
1882 1 8 . 1 1 14 14 SER N N 14 116.625 116.625 116.627 -0.002 25755
1883 1 8 . 1 1 14 14 SER HA H 14 4.206 4.206 4.211 -0.005 25755
1884 1 8 . 1 1 14 14 SER CA C 14 61.194 61.194 61.737 -0.543 25755
1885 1 8 . 1 1 14 14 SER CB C 14 62.041 62.041 62.475 -0.434 25755
1886 1 8 . 1 1 14 14 SER H H 14 8.396 8.396 8.239 0.157 25755
1887 1 8 . 1 1 15 15 LYS N N 15 120.843 120.843 121.582 -0.739 25755
1888 1 8 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.014 0.186 25755
1889 1 8 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.245 0.378 25755
1890 1 8 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.184 0.001 25755
1891 1 8 . 1 1 15 15 LYS H H 15 7.791 7.791 7.996 -0.205 25755
1892 1 8 . 1 1 16 16 CYS N N 16 115.949 115.949 115.150 0.799 25755
1893 1 8 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.513 0.380 25755
1894 1 8 . 1 1 16 16 CYS CA C 16 56.570 56.570 60.442 -3.872 25755
1895 1 8 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.419 15.018 25755
1896 1 8 . 1 1 16 16 CYS H H 16 7.870 7.870 7.626 0.244 25755
1897 1 8 . 1 1 17 17 GLN N N 17 117.241 117.241 117.114 0.127 25755
1898 1 8 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.264 0.010 25755
1899 1 8 . 1 1 17 17 GLN CA C 17 56.937 56.937 55.985 0.952 25755
1900 1 8 . 1 1 17 17 GLN CB C 17 29.187 29.187 29.001 0.186 25755
1901 1 8 . 1 1 17 17 GLN H H 17 7.560 7.560 7.633 -0.073 25755
1902 1 8 . 1 1 18 18 LEU N N 18 120.537 120.537 121.987 -1.450 25755
1903 1 8 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.195 0.245 25755
1904 1 8 . 1 1 18 18 LEU CA C 18 55.448 55.448 55.068 0.380 25755
1905 1 8 . 1 1 18 18 LEU CB C 18 41.837 41.837 40.863 0.974 25755
1906 1 8 . 1 1 18 18 LEU H H 18 7.369 7.369 7.486 -0.117 25755
1907 1 8 . 1 1 19 19 ARG N N 19 121.697 121.697 123.176 -1.479 25755
1908 1 8 . 1 1 19 19 ARG HA H 19 4.299 4.299 4.005 0.294 25755
1909 1 8 . 1 1 19 19 ARG CA C 19 57.836 57.836 59.126 -1.290 25755
1910 1 8 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.258 0.134 25755
1911 1 8 . 1 1 19 19 ARG H H 19 8.447 8.447 8.028 0.419 25755
1912 1 8 . 1 1 20 20 ILE N N 20 116.439 116.439 116.247 0.192 25755
1913 1 8 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.041 0.093 25755
1914 1 8 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.339 0.158 25755
1915 1 8 . 1 1 20 20 ILE CB C 20 38.164 38.164 38.196 -0.032 25755
1916 1 8 . 1 1 20 20 ILE H H 20 7.758 7.758 7.800 -0.042 25755
1917 1 8 . 1 1 21 21 ALA N N 21 122.642 122.642 122.826 -0.184 25755
1918 1 8 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.562 -0.180 25755
1919 1 8 . 1 1 21 21 ALA CA C 21 52.395 52.395 51.663 0.732 25755
1920 1 8 . 1 1 21 21 ALA CB C 21 20.098 20.098 19.785 0.313 25755
1921 1 8 . 1 1 21 21 ALA H H 21 7.727 7.727 7.338 0.389 25755
1922 1 8 . 1 1 22 22 ASN N N 22 116.616 116.616 121.899 -5.283 25755
1923 1 8 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.702 0.089 25755
1924 1 8 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.494 0.383 25755
1925 1 8 . 1 1 22 22 ASN CB C 22 37.554 37.554 38.026 -0.472 25755
1926 1 8 . 1 1 22 22 ASN H H 22 8.307 8.307 8.540 -0.233 25755
1927 1 8 . 1 1 23 23 GLN N N 23 124.357 124.357 122.855 1.502 25755
1928 1 8 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.346 -0.328 25755
1929 1 8 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.564 1.084 25755
1930 1 8 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.699 0.700 25755
1931 1 8 . 1 1 23 23 GLN H H 23 8.542 8.542 8.130 0.412 25755
1932 1 8 . 1 1 24 24 CYS N N 24 118.909 118.909 118.871 0.038 25755
1933 1 8 . 1 1 24 24 CYS HA H 24 4.284 4.284 4.146 0.138 25755
1934 1 8 . 1 1 24 24 CYS CA C 24 58.406 58.406 63.276 -4.870 25755
1935 1 8 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.640 12.136 25755
1936 1 8 . 1 1 24 24 CYS H H 24 8.352 8.352 8.669 -0.317 25755
1937 1 8 . 1 1 25 25 ASN N N 25 118.182 118.182 118.163 0.019 25755
1938 1 8 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.288 -0.400 25755
1939 1 8 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.845 0.827 25755
1940 1 8 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.581 2.192 25755
1941 1 8 . 1 1 25 25 ASN H H 25 7.504 7.504 8.510 -1.006 25755
1942 1 8 . 1 1 26 26 TYR N N 26 117.354 117.354 120.228 -2.874 25755
1943 1 8 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.181 -0.216 25755
1944 1 8 . 1 1 26 26 TYR CA C 26 62.162 62.162 61.875 0.287 25755
1945 1 8 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.878 -0.248 25755
1946 1 8 . 1 1 26 26 TYR H H 26 7.322 7.322 7.590 -0.268 25755
1947 1 8 . 1 1 27 27 ASP N N 27 119.874 119.874 120.105 -0.231 25755
1948 1 8 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.434 0.221 25755
1949 1 8 . 1 1 27 27 ASP CB C 27 40.590 40.590 40.941 -0.351 25755
1950 1 8 . 1 1 27 27 ASP H H 27 9.218 9.218 8.203 1.015 25755
1951 1 8 . 1 1 28 28 CYS N N 28 119.782 119.782 119.073 0.709 25755
1952 1 8 . 1 1 28 28 CYS HA H 28 4.168 4.168 4.069 0.099 25755
1953 1 8 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.717 -1.803 25755
1954 1 8 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.248 10.697 25755
1955 1 8 . 1 1 28 28 CYS H H 28 9.171 9.171 8.271 0.900 25755
1956 1 8 . 1 1 29 29 LYS N N 29 119.663 119.663 118.463 1.200 25755
1957 1 8 . 1 1 29 29 LYS HA H 29 4.137 4.137 3.897 0.240 25755
1958 1 8 . 1 1 29 29 LYS CA C 29 59.781 59.781 58.993 0.788 25755
1959 1 8 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.665 0.748 25755
1960 1 8 . 1 1 29 29 LYS H H 29 7.546 7.546 7.444 0.102 25755
1961 1 8 . 1 1 30 30 LEU N N 30 119.987 119.987 120.560 -0.573 25755
1962 1 8 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.971 0.140 25755
1963 1 8 . 1 1 30 30 LEU CA C 30 57.672 57.672 57.839 -0.167 25755
1964 1 8 . 1 1 30 30 LEU CB C 30 42.379 42.379 41.315 1.064 25755
1965 1 8 . 1 1 30 30 LEU H H 30 8.226 8.226 7.567 0.659 25755
1966 1 8 . 1 1 31 31 ASP N N 31 116.853 116.853 117.307 -0.454 25755
1967 1 8 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.704 -0.158 25755
1968 1 8 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.774 0.492 25755
1969 1 8 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.797 -1.319 25755
1970 1 8 . 1 1 31 31 ASP H H 31 9.019 9.019 7.870 1.149 25755
1971 1 8 . 1 1 32 32 LYS N N 32 112.075 112.075 118.494 -6.419 25755
1972 1 8 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.206 0.343 25755
1973 1 8 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.773 -4.308 25755
1974 1 8 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.630 -0.765 25755
1975 1 8 . 1 1 32 32 LYS H H 32 6.639 6.639 8.441 -1.802 25755
1976 1 8 . 1 1 33 33 HIS N N 33 112.955 112.955 114.823 -1.868 25755
1977 1 8 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.193 0.430 25755
1978 1 8 . 1 1 33 33 HIS CA C 33 56.486 56.486 56.207 0.279 25755
1979 1 8 . 1 1 33 33 HIS CB C 33 25.694 25.694 28.363 -2.669 25755
1980 1 8 . 1 1 33 33 HIS H H 33 7.065 7.065 8.103 -1.038 25755
1981 1 8 . 1 1 34 34 ALA N N 34 120.177 120.177 118.875 1.302 25755
1982 1 8 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.768 0.381 25755
1983 1 8 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.447 -1.668 25755
1984 1 8 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.715 -0.597 25755
1985 1 8 . 1 1 34 34 ALA H H 34 7.716 7.716 6.987 0.729 25755
1986 1 8 . 1 1 35 35 ARG N N 35 116.636 116.636 117.083 -0.447 25755
1987 1 8 . 1 1 35 35 ARG HA H 35 4.206 4.206 3.989 0.217 25755
1988 1 8 . 1 1 35 35 ARG CA C 35 58.076 58.076 59.883 -1.807 25755
1989 1 8 . 1 1 35 35 ARG CB C 35 30.717 30.717 30.417 0.300 25755
1990 1 8 . 1 1 35 35 ARG H H 35 8.295 8.295 8.202 0.093 25755
1991 1 8 . 1 1 36 36 SER N N 36 109.273 109.273 111.795 -2.522 25755
1992 1 8 . 1 1 36 36 SER HA H 36 4.646 4.646 4.466 0.180 25755
1993 1 8 . 1 1 36 36 SER CA C 36 57.703 57.703 58.297 -0.594 25755
1994 1 8 . 1 1 36 36 SER CB C 36 65.425 65.425 65.536 -0.111 25755
1995 1 8 . 1 1 36 36 SER H H 36 8.026 8.026 8.136 -0.110 25755
1996 1 8 . 1 1 37 37 GLY N N 37 107.305 107.305 111.134 -3.829 25755
1997 1 8 . 1 1 37 37 GLY CA C 37 47.152 47.152 44.850 2.301 25755
1998 1 8 . 1 1 37 37 GLY H H 37 8.679 8.679 7.855 0.824 25755
1999 1 8 . 1 1 38 38 GLU N N 38 119.065 119.065 122.307 -3.242 25755
2000 1 8 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.551 -0.149 25755
2001 1 8 . 1 1 38 38 GLU CA C 38 55.773 55.773 54.804 0.969 25755
2002 1 8 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.904 -2.082 25755
2003 1 8 . 1 1 38 38 GLU H H 38 8.351 8.351 8.856 -0.505 25755
2004 1 8 . 1 1 39 39 CYS N N 39 121.636 121.636 118.288 3.348 25755
2005 1 8 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.423 0.564 25755
2006 1 8 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.573 -0.845 25755
2007 1 8 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.744 16.275 25755
2008 1 8 . 1 1 39 39 CYS H H 39 8.839 8.839 8.241 0.598 25755
2009 1 8 . 1 1 40 40 PHE N N 40 121.987 121.987 120.128 1.859 25755
2010 1 8 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.787 -0.017 25755
2011 1 8 . 1 1 40 40 PHE CA C 40 56.969 56.969 56.582 0.387 25755
2012 1 8 . 1 1 40 40 PHE CB C 40 43.760 43.760 42.856 0.904 25755
2013 1 8 . 1 1 40 40 PHE H H 40 9.214 9.214 8.889 0.325 25755
2014 1 8 . 1 1 41 41 TYR N N 41 121.905 121.905 119.791 2.114 25755
2015 1 8 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.593 0.367 25755
2016 1 8 . 1 1 41 41 TYR CA C 41 58.532 58.532 59.037 -0.505 25755
2017 1 8 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.172 1.130 25755
2018 1 8 . 1 1 41 41 TYR H H 41 8.557 8.557 8.755 -0.198 25755
2019 1 8 . 1 1 42 42 ASP N N 42 123.133 123.133 120.379 2.754 25755
2020 1 8 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.788 -0.035 25755
2021 1 8 . 1 1 42 42 ASP CA C 42 52.426 52.426 52.051 0.375 25755
2022 1 8 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.354 -0.734 25755
2023 1 8 . 1 1 42 42 ASP H H 42 8.603 8.603 8.378 0.225 25755
2024 1 8 . 1 1 43 43 GLU N N 43 118.012 118.012 118.265 -0.253 25755
2025 1 8 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.119 0.090 25755
2026 1 8 . 1 1 43 43 GLU CA C 43 58.865 58.865 58.949 -0.084 25755
2027 1 8 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.507 -0.270 25755
2028 1 8 . 1 1 43 43 GLU H H 43 9.081 9.081 8.760 0.321 25755
2029 1 8 . 1 1 44 44 LYS N N 44 120.047 120.047 116.747 3.300 25755
2030 1 8 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.347 0.097 25755
2031 1 8 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.568 0.093 25755
2032 1 8 . 1 1 44 44 LYS CB C 44 32.039 32.039 31.725 0.314 25755
2033 1 8 . 1 1 44 44 LYS H H 44 8.162 8.162 8.447 -0.285 25755
2034 1 8 . 1 1 45 45 ARG N N 45 113.453 113.453 115.506 -2.053 25755
2035 1 8 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.089 -0.426 25755
2036 1 8 . 1 1 45 45 ARG CA C 45 57.736 57.736 57.159 0.577 25755
2037 1 8 . 1 1 45 45 ARG CB C 45 26.390 26.390 27.011 -0.621 25755
2038 1 8 . 1 1 45 45 ARG H H 45 8.335 8.335 8.057 0.278 25755
2039 1 8 . 1 1 46 46 ASN N N 46 118.207 118.207 117.574 0.633 25755
2040 1 8 . 1 1 46 46 ASN HA H 46 4.982 4.982 5.028 -0.046 25755
2041 1 8 . 1 1 46 46 ASN CA C 46 53.066 53.066 51.683 1.383 25755
2042 1 8 . 1 1 46 46 ASN CB C 46 39.293 39.293 39.991 -0.698 25755
2043 1 8 . 1 1 46 46 ASN H H 46 8.745 8.745 9.043 -0.298 25755
2044 1 8 . 1 1 47 47 LEU N N 47 125.815 125.815 126.821 -1.006 25755
2045 1 8 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.011 0.268 25755
2046 1 8 . 1 1 47 47 LEU CA C 47 55.290 55.290 55.176 0.114 25755
2047 1 8 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.380 1.926 25755
2048 1 8 . 1 1 47 47 LEU H H 47 8.509 8.509 8.766 -0.257 25755
2049 1 8 . 1 1 48 48 GLN N N 48 120.834 120.834 122.010 -1.176 25755
2050 1 8 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.653 0.083 25755
2051 1 8 . 1 1 48 48 GLN CA C 48 54.105 54.105 54.131 -0.026 25755
2052 1 8 . 1 1 48 48 GLN CB C 48 32.866 32.866 32.998 -0.132 25755
2053 1 8 . 1 1 48 48 GLN H H 48 8.589 8.589 8.989 -0.400 25755
2054 1 8 . 1 1 49 49 CYS N N 49 121.829 121.829 122.582 -0.753 25755
2055 1 8 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.475 0.383 25755
2056 1 8 . 1 1 49 49 CYS CA C 49 54.955 54.955 58.938 -3.983 25755
2057 1 8 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.386 13.059 25755
2058 1 8 . 1 1 49 49 CYS H H 49 9.247 9.247 8.986 0.261 25755
2059 1 8 . 1 1 50 50 ILE N N 50 129.010 129.010 128.392 0.618 25755
2060 1 8 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.295 0.091 25755
2061 1 8 . 1 1 50 50 ILE CA C 50 60.421 60.421 62.064 -1.643 25755
2062 1 8 . 1 1 50 50 ILE CB C 50 38.404 38.404 38.725 -0.321 25755
2063 1 8 . 1 1 50 50 ILE H H 50 8.787 8.787 7.858 0.929 25755
2064 1 8 . 1 1 51 51 CYS N N 51 126.108 126.108 128.166 -2.058 25755
2065 1 8 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.634 0.703 25755
2066 1 8 . 1 1 51 51 CYS CA C 51 51.818 51.818 59.121 -7.303 25755
2067 1 8 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.451 6.531 25755
2068 1 8 . 1 1 51 51 CYS H H 51 8.556 8.556 9.177 -0.621 25755
2069 1 8 . 1 1 52 52 ASP N N 52 122.342 122.342 120.843 1.499 25755
2070 1 8 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.821 0.692 25755
2071 1 8 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.822 -1.239 25755
2072 1 8 . 1 1 52 52 ASP CB C 52 42.831 42.831 42.301 0.530 25755
2073 1 8 . 1 1 52 52 ASP H H 52 8.826 8.826 8.600 0.226 25755
2074 1 8 . 1 1 53 53 TYR N N 53 125.370 125.370 123.277 2.093 25755
2075 1 8 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.636 -0.378 25755
2076 1 8 . 1 1 53 53 TYR CA C 53 59.665 59.665 59.047 0.618 25755
2077 1 8 . 1 1 53 53 TYR CB C 53 38.783 38.783 39.329 -0.546 25755
2078 1 8 . 1 1 53 53 TYR H H 53 9.734 9.734 8.705 1.029 25755
2079 1 8 . 1 1 54 54 CYS N N 54 120.418 120.418 121.357 -0.939 25755
2080 1 8 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.369 0.125 25755
2081 1 8 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.795 -4.652 25755
2082 1 8 . 1 1 54 54 CYS CB C 54 44.382 44.382 28.644 15.738 25755
2083 1 8 . 1 1 54 54 CYS H H 54 9.478 9.478 8.889 0.589 25755
2084 1 8 . 1 1 55 55 GLU N N 55 121.097 121.097 119.208 1.889 25755
2085 1 8 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.361 -0.049 25755
2086 1 8 . 1 1 55 55 GLU CA C 55 56.010 56.010 55.300 0.710 25755
2087 1 8 . 1 1 55 55 GLU CB C 55 31.014 31.014 33.144 -2.130 25755
2088 1 8 . 1 1 55 55 GLU H H 55 8.423 8.423 7.749 0.674 25755
2089 1 9 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.810 -0.559 25755
2090 1 9 . 1 1 2 2 ASP CA C 2 59.484 59.484 54.526 4.958 25755
2091 1 9 . 1 1 2 2 ASP CB C 2 39.412 39.412 41.861 -2.449 25755
2092 1 9 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.334 0.011 25755
2093 1 9 . 1 1 3 3 LYS CA C 3 57.556 57.556 56.829 0.727 25755
2094 1 9 . 1 1 3 3 LYS CB C 3 32.593 32.593 33.143 -0.550 25755
2095 1 9 . 1 1 4 4 CYS N N 4 117.049 117.049 120.572 -3.523 25755
2096 1 9 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.835 -0.107 25755
2097 1 9 . 1 1 4 4 CYS CA C 4 57.415 57.415 57.254 0.161 25755
2098 1 9 . 1 1 4 4 CYS CB C 4 41.843 41.843 28.965 12.878 25755
2099 1 9 . 1 1 4 4 CYS H H 4 8.486 8.486 8.385 0.101 25755
2100 1 9 . 1 1 5 5 LYS N N 5 118.790 118.790 120.993 -2.203 25755
2101 1 9 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.893 0.678 25755
2102 1 9 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.551 -0.261 25755
2103 1 9 . 1 1 5 5 LYS CB C 5 34.606 34.606 35.215 -0.609 25755
2104 1 9 . 1 1 5 5 LYS H H 5 8.007 8.007 8.338 -0.332 25755
2105 1 9 . 1 1 6 6 LYS N N 6 121.177 121.177 120.667 0.510 25755
2106 1 9 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.645 0.140 25755
2107 1 9 . 1 1 6 6 LYS CA C 6 55.542 55.542 56.056 -0.514 25755
2108 1 9 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.715 1.187 25755
2109 1 9 . 1 1 6 6 LYS H H 6 9.014 9.014 8.863 0.151 25755
2110 1 9 . 1 1 7 7 VAL N N 7 127.629 127.629 124.636 2.993 25755
2111 1 9 . 1 1 7 7 VAL HA H 7 4.026 4.026 3.964 0.062 25755
2112 1 9 . 1 1 7 7 VAL CA C 7 63.988 63.988 63.138 0.850 25755
2113 1 9 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.385 0.722 25755
2114 1 9 . 1 1 7 7 VAL H H 7 8.837 8.837 8.625 0.212 25755
2115 1 9 . 1 1 8 8 TYR N N 8 130.003 130.003 129.097 0.906 25755
2116 1 9 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.713 -0.254 25755
2117 1 9 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.211 0.509 25755
2118 1 9 . 1 1 8 8 TYR CB C 8 36.018 36.018 37.733 -1.715 25755
2119 1 9 . 1 1 8 8 TYR H H 8 9.251 9.251 8.346 0.905 25755
2120 1 9 . 1 1 9 9 GLU N N 9 130.851 130.851 123.979 6.872 25755
2121 1 9 . 1 1 9 9 GLU HA H 9 4.204 4.204 4.221 -0.017 25755
2122 1 9 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.700 -0.183 25755
2123 1 9 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.510 -0.119 25755
2124 1 9 . 1 1 9 9 GLU H H 9 9.072 9.072 8.376 0.696 25755
2125 1 9 . 1 1 10 10 ASN N N 10 116.120 116.120 117.897 -1.777 25755
2126 1 9 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.550 -0.112 25755
2127 1 9 . 1 1 10 10 ASN CA C 10 54.587 54.587 52.985 1.602 25755
2128 1 9 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.447 -0.169 25755
2129 1 9 . 1 1 10 10 ASN H H 10 9.301 9.301 7.792 1.509 25755
2130 1 9 . 1 1 11 11 TYR N N 11 122.436 122.436 120.860 1.576 25755
2131 1 9 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.633 -0.439 25755
2132 1 9 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.427 2.185 25755
2133 1 9 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.862 -2.395 25755
2134 1 9 . 1 1 11 11 TYR H H 11 7.550 7.550 7.636 -0.086 25755
2135 1 9 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.517 -0.070 25755
2136 1 9 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.504 -0.006 25755
2137 1 9 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.603 -2.012 25755
2138 1 9 . 1 1 13 13 VAL N N 13 124.506 124.506 122.041 2.465 25755
2139 1 9 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.767 0.069 25755
2140 1 9 . 1 1 13 13 VAL CA C 13 65.761 65.761 64.733 1.028 25755
2141 1 9 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.352 0.227 25755
2142 1 9 . 1 1 13 13 VAL H H 13 8.169 8.169 8.482 -0.313 25755
2143 1 9 . 1 1 14 14 SER N N 14 116.625 116.625 116.691 -0.066 25755
2144 1 9 . 1 1 14 14 SER HA H 14 4.206 4.206 4.202 0.004 25755
2145 1 9 . 1 1 14 14 SER CA C 14 61.194 61.194 61.781 -0.587 25755
2146 1 9 . 1 1 14 14 SER CB C 14 62.041 62.041 62.372 -0.331 25755
2147 1 9 . 1 1 14 14 SER H H 14 8.396 8.396 8.259 0.137 25755
2148 1 9 . 1 1 15 15 LYS N N 15 120.843 120.843 122.042 -1.199 25755
2149 1 9 . 1 1 15 15 LYS HA H 15 4.200 4.200 3.996 0.204 25755
2150 1 9 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.258 0.365 25755
2151 1 9 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.133 0.053 25755
2152 1 9 . 1 1 15 15 LYS H H 15 7.791 7.791 7.742 0.049 25755
2153 1 9 . 1 1 16 16 CYS N N 16 115.949 115.949 117.336 -1.387 25755
2154 1 9 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.504 0.389 25755
2155 1 9 . 1 1 16 16 CYS CA C 16 56.570 56.570 61.177 -4.607 25755
2156 1 9 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.453 14.984 25755
2157 1 9 . 1 1 16 16 CYS H H 16 7.870 7.870 7.525 0.345 25755
2158 1 9 . 1 1 17 17 GLN N N 17 117.241 117.241 116.910 0.331 25755
2159 1 9 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.123 0.151 25755
2160 1 9 . 1 1 17 17 GLN CA C 17 56.937 56.937 56.986 -0.049 25755
2161 1 9 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.705 0.482 25755
2162 1 9 . 1 1 17 17 GLN H H 17 7.560 7.560 7.694 -0.134 25755
2163 1 9 . 1 1 18 18 LEU N N 18 120.537 120.537 121.836 -1.299 25755
2164 1 9 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.208 0.232 25755
2165 1 9 . 1 1 18 18 LEU CA C 18 55.448 55.448 54.909 0.539 25755
2166 1 9 . 1 1 18 18 LEU CB C 18 41.837 41.837 40.822 1.015 25755
2167 1 9 . 1 1 18 18 LEU H H 18 7.369 7.369 7.394 -0.025 25755
2168 1 9 . 1 1 19 19 ARG N N 19 121.697 121.697 121.388 0.309 25755
2169 1 9 . 1 1 19 19 ARG HA H 19 4.299 4.299 3.961 0.338 25755
2170 1 9 . 1 1 19 19 ARG CA C 19 57.836 57.836 58.857 -1.021 25755
2171 1 9 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.202 0.190 25755
2172 1 9 . 1 1 19 19 ARG H H 19 8.447 8.447 7.877 0.570 25755
2173 1 9 . 1 1 20 20 ILE N N 20 116.439 116.439 119.056 -2.617 25755
2174 1 9 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.073 0.061 25755
2175 1 9 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.315 0.183 25755
2176 1 9 . 1 1 20 20 ILE CB C 20 38.164 38.164 37.162 1.002 25755
2177 1 9 . 1 1 20 20 ILE H H 20 7.758 7.758 7.800 -0.042 25755
2178 1 9 . 1 1 21 21 ALA N N 21 122.642 122.642 123.287 -0.645 25755
2179 1 9 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.482 -0.100 25755
2180 1 9 . 1 1 21 21 ALA CA C 21 52.395 52.395 50.844 1.551 25755
2181 1 9 . 1 1 21 21 ALA CB C 21 20.098 20.098 17.893 2.205 25755
2182 1 9 . 1 1 21 21 ALA H H 21 7.727 7.727 7.880 -0.153 25755
2183 1 9 . 1 1 22 22 ASN N N 22 116.616 116.616 120.895 -4.279 25755
2184 1 9 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.768 0.023 25755
2185 1 9 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.803 0.073 25755
2186 1 9 . 1 1 22 22 ASN CB C 22 37.554 37.554 38.221 -0.667 25755
2187 1 9 . 1 1 22 22 ASN H H 22 8.307 8.307 8.445 -0.138 25755
2188 1 9 . 1 1 23 23 GLN N N 23 124.357 124.357 123.557 0.800 25755
2189 1 9 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.290 -0.272 25755
2190 1 9 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.599 1.049 25755
2191 1 9 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.718 0.681 25755
2192 1 9 . 1 1 23 23 GLN H H 23 8.542 8.542 8.256 0.286 25755
2193 1 9 . 1 1 24 24 CYS N N 24 118.909 118.909 119.046 -0.137 25755
2194 1 9 . 1 1 24 24 CYS HA H 24 4.284 4.284 4.080 0.204 25755
2195 1 9 . 1 1 24 24 CYS CA C 24 58.406 58.406 62.921 -4.515 25755
2196 1 9 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.996 11.780 25755
2197 1 9 . 1 1 24 24 CYS H H 24 8.352 8.352 8.522 -0.170 25755
2198 1 9 . 1 1 25 25 ASN N N 25 118.182 118.182 119.157 -0.975 25755
2199 1 9 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.351 -0.463 25755
2200 1 9 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.527 1.145 25755
2201 1 9 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.286 2.487 25755
2202 1 9 . 1 1 25 25 ASN H H 25 7.504 7.504 8.478 -0.974 25755
2203 1 9 . 1 1 26 26 TYR N N 26 117.354 117.354 119.226 -1.872 25755
2204 1 9 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.206 -0.241 25755
2205 1 9 . 1 1 26 26 TYR CA C 26 62.162 62.162 61.645 0.517 25755
2206 1 9 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.825 -0.195 25755
2207 1 9 . 1 1 26 26 TYR H H 26 7.322 7.322 7.604 -0.282 25755
2208 1 9 . 1 1 27 27 ASP N N 27 119.874 119.874 120.191 -0.317 25755
2209 1 9 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.306 0.349 25755
2210 1 9 . 1 1 27 27 ASP CB C 27 40.590 40.590 41.082 -0.492 25755
2211 1 9 . 1 1 27 27 ASP H H 27 9.218 9.218 8.210 1.008 25755
2212 1 9 . 1 1 28 28 CYS N N 28 119.782 119.782 119.059 0.723 25755
2213 1 9 . 1 1 28 28 CYS HA H 28 4.168 4.168 3.918 0.250 25755
2214 1 9 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.436 -1.522 25755
2215 1 9 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.258 10.687 25755
2216 1 9 . 1 1 28 28 CYS H H 28 9.171 9.171 8.376 0.795 25755
2217 1 9 . 1 1 29 29 LYS N N 29 119.663 119.663 119.155 0.508 25755
2218 1 9 . 1 1 29 29 LYS HA H 29 4.137 4.137 3.998 0.139 25755
2219 1 9 . 1 1 29 29 LYS CA C 29 59.781 59.781 59.121 0.660 25755
2220 1 9 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.854 0.559 25755
2221 1 9 . 1 1 29 29 LYS H H 29 7.546 7.546 7.500 0.046 25755
2222 1 9 . 1 1 30 30 LEU N N 30 119.987 119.987 120.805 -0.818 25755
2223 1 9 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.781 0.330 25755
2224 1 9 . 1 1 30 30 LEU CA C 30 57.672 57.672 57.841 -0.169 25755
2225 1 9 . 1 1 30 30 LEU CB C 30 42.379 42.379 42.148 0.231 25755
2226 1 9 . 1 1 30 30 LEU H H 30 8.226 8.226 7.639 0.587 25755
2227 1 9 . 1 1 31 31 ASP N N 31 116.853 116.853 115.790 1.063 25755
2228 1 9 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.570 -0.024 25755
2229 1 9 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.624 0.642 25755
2230 1 9 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.143 -0.665 25755
2231 1 9 . 1 1 31 31 ASP H H 31 9.019 9.019 7.710 1.309 25755
2232 1 9 . 1 1 32 32 LYS N N 32 112.075 112.075 118.044 -5.969 25755
2233 1 9 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.139 0.410 25755
2234 1 9 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.621 -4.156 25755
2235 1 9 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.612 -0.747 25755
2236 1 9 . 1 1 32 32 LYS H H 32 6.639 6.639 8.210 -1.571 25755
2237 1 9 . 1 1 33 33 HIS N N 33 112.955 112.955 114.793 -1.838 25755
2238 1 9 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.172 0.451 25755
2239 1 9 . 1 1 33 33 HIS CA C 33 56.486 56.486 55.239 1.247 25755
2240 1 9 . 1 1 33 33 HIS CB C 33 25.694 25.694 28.418 -2.724 25755
2241 1 9 . 1 1 33 33 HIS H H 33 7.065 7.065 8.081 -1.016 25755
2242 1 9 . 1 1 34 34 ALA N N 34 120.177 120.177 119.360 0.817 25755
2243 1 9 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.734 0.415 25755
2244 1 9 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.480 -1.701 25755
2245 1 9 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.624 -0.506 25755
2246 1 9 . 1 1 34 34 ALA H H 34 7.716 7.716 7.164 0.552 25755
2247 1 9 . 1 1 35 35 ARG N N 35 116.636 116.636 117.402 -0.766 25755
2248 1 9 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.073 0.133 25755
2249 1 9 . 1 1 35 35 ARG CA C 35 58.076 58.076 59.898 -1.822 25755
2250 1 9 . 1 1 35 35 ARG CB C 35 30.717 30.717 30.699 0.018 25755
2251 1 9 . 1 1 35 35 ARG H H 35 8.295 8.295 7.959 0.336 25755
2252 1 9 . 1 1 36 36 SER N N 36 109.273 109.273 110.682 -1.409 25755
2253 1 9 . 1 1 36 36 SER HA H 36 4.646 4.646 4.566 0.080 25755
2254 1 9 . 1 1 36 36 SER CA C 36 57.703 57.703 57.800 -0.097 25755
2255 1 9 . 1 1 36 36 SER CB C 36 65.425 65.425 64.919 0.506 25755
2256 1 9 . 1 1 36 36 SER H H 36 8.026 8.026 7.951 0.075 25755
2257 1 9 . 1 1 37 37 GLY N N 37 107.305 107.305 110.727 -3.422 25755
2258 1 9 . 1 1 37 37 GLY CA C 37 47.152 47.152 44.889 2.263 25755
2259 1 9 . 1 1 37 37 GLY H H 37 8.679 8.679 8.022 0.657 25755
2260 1 9 . 1 1 38 38 GLU N N 38 119.065 119.065 122.330 -3.265 25755
2261 1 9 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.579 -0.177 25755
2262 1 9 . 1 1 38 38 GLU CA C 38 55.773 55.773 54.761 1.012 25755
2263 1 9 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.945 -2.123 25755
2264 1 9 . 1 1 38 38 GLU H H 38 8.351 8.351 8.895 -0.544 25755
2265 1 9 . 1 1 39 39 CYS N N 39 121.636 121.636 118.117 3.519 25755
2266 1 9 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.162 0.825 25755
2267 1 9 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.695 -0.967 25755
2268 1 9 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.213 16.806 25755
2269 1 9 . 1 1 39 39 CYS H H 39 8.839 8.839 8.292 0.547 25755
2270 1 9 . 1 1 40 40 PHE N N 40 121.987 121.987 120.850 1.137 25755
2271 1 9 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.885 -0.115 25755
2272 1 9 . 1 1 40 40 PHE CA C 40 56.969 56.969 55.862 1.107 25755
2273 1 9 . 1 1 40 40 PHE CB C 40 43.760 43.760 42.780 0.980 25755
2274 1 9 . 1 1 40 40 PHE H H 40 9.214 9.214 8.731 0.483 25755
2275 1 9 . 1 1 41 41 TYR N N 41 121.905 121.905 119.000 2.905 25755
2276 1 9 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.562 0.398 25755
2277 1 9 . 1 1 41 41 TYR CA C 41 58.532 58.532 59.323 -0.791 25755
2278 1 9 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.202 1.100 25755
2279 1 9 . 1 1 41 41 TYR H H 41 8.557 8.557 8.755 -0.198 25755
2280 1 9 . 1 1 42 42 ASP N N 42 123.133 123.133 121.457 1.676 25755
2281 1 9 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.869 -0.116 25755
2282 1 9 . 1 1 42 42 ASP CA C 42 52.426 52.426 53.126 -0.700 25755
2283 1 9 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.908 -1.288 25755
2284 1 9 . 1 1 42 42 ASP H H 42 8.603 8.603 8.368 0.235 25755
2285 1 9 . 1 1 43 43 GLU N N 43 118.012 118.012 118.924 -0.912 25755
2286 1 9 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.183 0.026 25755
2287 1 9 . 1 1 43 43 GLU CA C 43 58.865 58.865 58.538 0.327 25755
2288 1 9 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.645 -0.408 25755
2289 1 9 . 1 1 43 43 GLU H H 43 9.081 9.081 8.715 0.366 25755
2290 1 9 . 1 1 44 44 LYS N N 44 120.047 120.047 117.421 2.626 25755
2291 1 9 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.400 0.044 25755
2292 1 9 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.617 0.043 25755
2293 1 9 . 1 1 44 44 LYS CB C 44 32.039 32.039 32.357 -0.318 25755
2294 1 9 . 1 1 44 44 LYS H H 44 8.162 8.162 8.083 0.079 25755
2295 1 9 . 1 1 45 45 ARG N N 45 113.453 113.453 116.583 -3.130 25755
2296 1 9 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.139 -0.476 25755
2297 1 9 . 1 1 45 45 ARG CA C 45 57.736 57.736 56.746 0.990 25755
2298 1 9 . 1 1 45 45 ARG CB C 45 26.390 26.390 27.636 -1.246 25755
2299 1 9 . 1 1 45 45 ARG H H 45 8.335 8.335 7.751 0.584 25755
2300 1 9 . 1 1 46 46 ASN N N 46 118.207 118.207 117.136 1.071 25755
2301 1 9 . 1 1 46 46 ASN HA H 46 4.982 4.982 4.950 0.032 25755
2302 1 9 . 1 1 46 46 ASN CA C 46 53.066 53.066 51.831 1.235 25755
2303 1 9 . 1 1 46 46 ASN CB C 46 39.293 39.293 39.089 0.204 25755
2304 1 9 . 1 1 46 46 ASN H H 46 8.745 8.745 8.298 0.447 25755
2305 1 9 . 1 1 47 47 LEU N N 47 125.815 125.815 127.189 -1.374 25755
2306 1 9 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.011 0.268 25755
2307 1 9 . 1 1 47 47 LEU CA C 47 55.290 55.290 55.260 0.030 25755
2308 1 9 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.630 1.676 25755
2309 1 9 . 1 1 47 47 LEU H H 47 8.509 8.509 8.870 -0.361 25755
2310 1 9 . 1 1 48 48 GLN N N 48 120.834 120.834 121.937 -1.103 25755
2311 1 9 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.714 0.022 25755
2312 1 9 . 1 1 48 48 GLN CA C 48 54.105 54.105 53.567 0.538 25755
2313 1 9 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.729 -0.863 25755
2314 1 9 . 1 1 48 48 GLN H H 48 8.589 8.589 8.877 -0.288 25755
2315 1 9 . 1 1 49 49 CYS N N 49 121.829 121.829 123.517 -1.688 25755
2316 1 9 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.603 0.255 25755
2317 1 9 . 1 1 49 49 CYS CA C 49 54.955 54.955 58.823 -3.868 25755
2318 1 9 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.612 12.833 25755
2319 1 9 . 1 1 49 49 CYS H H 49 9.247 9.247 9.057 0.190 25755
2320 1 9 . 1 1 50 50 ILE N N 50 129.010 129.010 130.184 -1.174 25755
2321 1 9 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.472 -0.086 25755
2322 1 9 . 1 1 50 50 ILE CA C 50 60.421 60.421 61.944 -1.523 25755
2323 1 9 . 1 1 50 50 ILE CB C 50 38.404 38.404 39.016 -0.612 25755
2324 1 9 . 1 1 50 50 ILE H H 50 8.787 8.787 7.967 0.820 25755
2325 1 9 . 1 1 51 51 CYS N N 51 126.108 126.108 127.556 -1.448 25755
2326 1 9 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.646 0.691 25755
2327 1 9 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.476 -6.658 25755
2328 1 9 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.684 6.298 25755
2329 1 9 . 1 1 51 51 CYS H H 51 8.556 8.556 9.347 -0.791 25755
2330 1 9 . 1 1 52 52 ASP N N 52 122.342 122.342 120.688 1.654 25755
2331 1 9 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.979 0.534 25755
2332 1 9 . 1 1 52 52 ASP CA C 52 52.583 52.583 54.179 -1.596 25755
2333 1 9 . 1 1 52 52 ASP CB C 52 42.831 42.831 42.988 -0.157 25755
2334 1 9 . 1 1 52 52 ASP H H 52 8.826 8.826 8.504 0.322 25755
2335 1 9 . 1 1 53 53 TYR N N 53 125.370 125.370 123.517 1.853 25755
2336 1 9 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.588 -0.330 25755
2337 1 9 . 1 1 53 53 TYR CA C 53 59.665 59.665 59.070 0.595 25755
2338 1 9 . 1 1 53 53 TYR CB C 53 38.783 38.783 38.959 -0.176 25755
2339 1 9 . 1 1 53 53 TYR H H 53 9.734 9.734 8.745 0.989 25755
2340 1 9 . 1 1 54 54 CYS N N 54 120.418 120.418 120.679 -0.261 25755
2341 1 9 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.433 0.061 25755
2342 1 9 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.701 -4.558 25755
2343 1 9 . 1 1 54 54 CYS CB C 54 44.382 44.382 29.386 14.996 25755
2344 1 9 . 1 1 54 54 CYS H H 54 9.478 9.478 8.882 0.596 25755
2345 1 9 . 1 1 55 55 GLU N N 55 121.097 121.097 118.431 2.666 25755
2346 1 9 . 1 1 55 55 GLU HA H 55 4.312 4.312 3.996 0.316 25755
2347 1 9 . 1 1 55 55 GLU CA C 55 56.010 56.010 57.245 -1.235 25755
2348 1 9 . 1 1 55 55 GLU CB C 55 31.014 31.014 29.879 1.135 25755
2349 1 9 . 1 1 55 55 GLU H H 55 8.423 8.423 7.978 0.445 25755
2350 1 10 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.327 -0.076 25755
2351 1 10 . 1 1 2 2 ASP CA C 2 59.484 59.484 55.286 4.198 25755
2352 1 10 . 1 1 2 2 ASP CB C 2 39.412 39.412 40.635 -1.223 25755
2353 1 10 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.278 0.067 25755
2354 1 10 . 1 1 3 3 LYS CA C 3 57.556 57.556 56.655 0.901 25755
2355 1 10 . 1 1 3 3 LYS CB C 3 32.593 32.593 32.424 0.169 25755
2356 1 10 . 1 1 4 4 CYS N N 4 117.049 117.049 118.781 -1.732 25755
2357 1 10 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.865 -0.137 25755
2358 1 10 . 1 1 4 4 CYS CA C 4 57.415 57.415 57.148 0.267 25755
2359 1 10 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.206 12.637 25755
2360 1 10 . 1 1 4 4 CYS H H 4 8.486 8.486 7.753 0.733 25755
2361 1 10 . 1 1 5 5 LYS N N 5 118.790 118.790 121.440 -2.650 25755
2362 1 10 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.892 0.679 25755
2363 1 10 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.805 -0.515 25755
2364 1 10 . 1 1 5 5 LYS CB C 5 34.606 34.606 34.836 -0.230 25755
2365 1 10 . 1 1 5 5 LYS H H 5 8.007 8.007 8.255 -0.248 25755
2366 1 10 . 1 1 6 6 LYS N N 6 121.177 121.177 120.848 0.329 25755
2367 1 10 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.549 0.236 25755
2368 1 10 . 1 1 6 6 LYS CA C 6 55.542 55.542 55.874 -0.332 25755
2369 1 10 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.263 1.639 25755
2370 1 10 . 1 1 6 6 LYS H H 6 9.014 9.014 8.766 0.248 25755
2371 1 10 . 1 1 7 7 VAL N N 7 127.629 127.629 124.391 3.238 25755
2372 1 10 . 1 1 7 7 VAL HA H 7 4.026 4.026 4.104 -0.078 25755
2373 1 10 . 1 1 7 7 VAL CA C 7 63.988 63.988 62.959 1.029 25755
2374 1 10 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.142 0.965 25755
2375 1 10 . 1 1 7 7 VAL H H 7 8.837 8.837 8.619 0.218 25755
2376 1 10 . 1 1 8 8 TYR N N 8 130.003 130.003 128.701 1.302 25755
2377 1 10 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.682 -0.223 25755
2378 1 10 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.024 0.696 25755
2379 1 10 . 1 1 8 8 TYR CB C 8 36.018 36.018 37.111 -1.093 25755
2380 1 10 . 1 1 8 8 TYR H H 8 9.251 9.251 8.367 0.884 25755
2381 1 10 . 1 1 9 9 GLU N N 9 130.851 130.851 123.204 7.647 25755
2382 1 10 . 1 1 9 9 GLU HA H 9 4.204 4.204 4.388 -0.184 25755
2383 1 10 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.910 -0.393 25755
2384 1 10 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.686 -0.295 25755
2385 1 10 . 1 1 9 9 GLU H H 9 9.072 9.072 8.260 0.812 25755
2386 1 10 . 1 1 10 10 ASN N N 10 116.120 116.120 118.010 -1.890 25755
2387 1 10 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.792 -0.354 25755
2388 1 10 . 1 1 10 10 ASN CA C 10 54.587 54.587 53.297 1.290 25755
2389 1 10 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.742 -0.464 25755
2390 1 10 . 1 1 10 10 ASN H H 10 9.301 9.301 8.585 0.716 25755
2391 1 10 . 1 1 11 11 TYR N N 11 122.436 122.436 119.593 2.843 25755
2392 1 10 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.459 -0.265 25755
2393 1 10 . 1 1 11 11 TYR CA C 11 57.612 57.612 54.758 2.854 25755
2394 1 10 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.392 -1.925 25755
2395 1 10 . 1 1 11 11 TYR H H 11 7.550 7.550 7.529 0.021 25755
2396 1 10 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.538 -0.091 25755
2397 1 10 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.477 0.021 25755
2398 1 10 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.507 -1.916 25755
2399 1 10 . 1 1 13 13 VAL N N 13 124.506 124.506 121.903 2.603 25755
2400 1 10 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.818 0.018 25755
2401 1 10 . 1 1 13 13 VAL CA C 13 65.761 65.761 64.467 1.294 25755
2402 1 10 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.416 0.164 25755
2403 1 10 . 1 1 13 13 VAL H H 13 8.169 8.169 8.442 -0.273 25755
2404 1 10 . 1 1 14 14 SER N N 14 116.625 116.625 116.393 0.232 25755
2405 1 10 . 1 1 14 14 SER HA H 14 4.206 4.206 4.173 0.033 25755
2406 1 10 . 1 1 14 14 SER CA C 14 61.194 61.194 62.111 -0.917 25755
2407 1 10 . 1 1 14 14 SER CB C 14 62.041 62.041 62.555 -0.514 25755
2408 1 10 . 1 1 14 14 SER H H 14 8.396 8.396 8.295 0.101 25755
2409 1 10 . 1 1 15 15 LYS N N 15 120.843 120.843 121.639 -0.796 25755
2410 1 10 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.007 0.193 25755
2411 1 10 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.359 0.264 25755
2412 1 10 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.163 0.023 25755
2413 1 10 . 1 1 15 15 LYS H H 15 7.791 7.791 7.737 0.054 25755
2414 1 10 . 1 1 16 16 CYS N N 16 115.949 115.949 116.352 -0.403 25755
2415 1 10 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.523 0.370 25755
2416 1 10 . 1 1 16 16 CYS CA C 16 56.570 56.570 60.805 -4.235 25755
2417 1 10 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.400 15.037 25755
2418 1 10 . 1 1 16 16 CYS H H 16 7.870 7.870 7.587 0.283 25755
2419 1 10 . 1 1 17 17 GLN N N 17 117.241 117.241 116.888 0.353 25755
2420 1 10 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.207 0.067 25755
2421 1 10 . 1 1 17 17 GLN CA C 17 56.937 56.937 56.487 0.450 25755
2422 1 10 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.884 0.302 25755
2423 1 10 . 1 1 17 17 GLN H H 17 7.560 7.560 7.615 -0.055 25755
2424 1 10 . 1 1 18 18 LEU N N 18 120.537 120.537 122.119 -1.582 25755
2425 1 10 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.195 0.245 25755
2426 1 10 . 1 1 18 18 LEU CA C 18 55.448 55.448 55.099 0.349 25755
2427 1 10 . 1 1 18 18 LEU CB C 18 41.837 41.837 40.860 0.977 25755
2428 1 10 . 1 1 18 18 LEU H H 18 7.369 7.369 7.521 -0.152 25755
2429 1 10 . 1 1 19 19 ARG N N 19 121.697 121.697 122.948 -1.251 25755
2430 1 10 . 1 1 19 19 ARG HA H 19 4.299 4.299 4.019 0.280 25755
2431 1 10 . 1 1 19 19 ARG CA C 19 57.836 57.836 58.706 -0.870 25755
2432 1 10 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.103 0.289 25755
2433 1 10 . 1 1 19 19 ARG H H 19 8.447 8.447 8.091 0.356 25755
2434 1 10 . 1 1 20 20 ILE N N 20 116.439 116.439 116.221 0.218 25755
2435 1 10 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.061 0.073 25755
2436 1 10 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.392 0.105 25755
2437 1 10 . 1 1 20 20 ILE CB C 20 38.164 38.164 38.169 -0.005 25755
2438 1 10 . 1 1 20 20 ILE H H 20 7.758 7.758 7.777 -0.019 25755
2439 1 10 . 1 1 21 21 ALA N N 21 122.642 122.642 122.813 -0.171 25755
2440 1 10 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.583 -0.201 25755
2441 1 10 . 1 1 21 21 ALA CA C 21 52.395 52.395 51.639 0.756 25755
2442 1 10 . 1 1 21 21 ALA CB C 21 20.098 20.098 19.832 0.266 25755
2443 1 10 . 1 1 21 21 ALA H H 21 7.727 7.727 7.363 0.364 25755
2444 1 10 . 1 1 22 22 ASN N N 22 116.616 116.616 121.754 -5.138 25755
2445 1 10 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.693 0.098 25755
2446 1 10 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.264 0.613 25755
2447 1 10 . 1 1 22 22 ASN CB C 22 37.554 37.554 37.758 -0.204 25755
2448 1 10 . 1 1 22 22 ASN H H 22 8.307 8.307 8.600 -0.293 25755
2449 1 10 . 1 1 23 23 GLN N N 23 124.357 124.357 122.834 1.523 25755
2450 1 10 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.291 -0.273 25755
2451 1 10 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.672 0.976 25755
2452 1 10 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.289 1.110 25755
2453 1 10 . 1 1 23 23 GLN H H 23 8.542 8.542 8.221 0.321 25755
2454 1 10 . 1 1 24 24 CYS N N 24 118.909 118.909 119.716 -0.807 25755
2455 1 10 . 1 1 24 24 CYS HA H 24 4.284 4.284 4.146 0.138 25755
2456 1 10 . 1 1 24 24 CYS CA C 24 58.406 58.406 62.951 -4.545 25755
2457 1 10 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.613 12.163 25755
2458 1 10 . 1 1 24 24 CYS H H 24 8.352 8.352 8.370 -0.018 25755
2459 1 10 . 1 1 25 25 ASN N N 25 118.182 118.182 118.659 -0.477 25755
2460 1 10 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.436 -0.548 25755
2461 1 10 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.394 1.278 25755
2462 1 10 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.614 2.159 25755
2463 1 10 . 1 1 25 25 ASN H H 25 7.504 7.504 8.316 -0.812 25755
2464 1 10 . 1 1 26 26 TYR N N 26 117.354 117.354 119.913 -2.559 25755
2465 1 10 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.191 -0.226 25755
2466 1 10 . 1 1 26 26 TYR CA C 26 62.162 62.162 61.734 0.428 25755
2467 1 10 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.846 -0.216 25755
2468 1 10 . 1 1 26 26 TYR H H 26 7.322 7.322 7.587 -0.265 25755
2469 1 10 . 1 1 27 27 ASP N N 27 119.874 119.874 120.070 -0.196 25755
2470 1 10 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.387 0.268 25755
2471 1 10 . 1 1 27 27 ASP CB C 27 40.590 40.590 40.747 -0.157 25755
2472 1 10 . 1 1 27 27 ASP H H 27 9.218 9.218 8.420 0.798 25755
2473 1 10 . 1 1 28 28 CYS N N 28 119.782 119.782 119.089 0.693 25755
2474 1 10 . 1 1 28 28 CYS HA H 28 4.168 4.168 4.074 0.094 25755
2475 1 10 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.847 -1.933 25755
2476 1 10 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.347 10.598 25755
2477 1 10 . 1 1 28 28 CYS H H 28 9.171 9.171 8.451 0.720 25755
2478 1 10 . 1 1 29 29 LYS N N 29 119.663 119.663 118.897 0.766 25755
2479 1 10 . 1 1 29 29 LYS HA H 29 4.137 4.137 4.014 0.123 25755
2480 1 10 . 1 1 29 29 LYS CA C 29 59.781 59.781 59.018 0.763 25755
2481 1 10 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.900 0.513 25755
2482 1 10 . 1 1 29 29 LYS H H 29 7.546 7.546 7.492 0.054 25755
2483 1 10 . 1 1 30 30 LEU N N 30 119.987 119.987 121.047 -1.060 25755
2484 1 10 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.876 0.235 25755
2485 1 10 . 1 1 30 30 LEU CA C 30 57.672 57.672 57.791 -0.119 25755
2486 1 10 . 1 1 30 30 LEU CB C 30 42.379 42.379 42.305 0.074 25755
2487 1 10 . 1 1 30 30 LEU H H 30 8.226 8.226 7.765 0.461 25755
2488 1 10 . 1 1 31 31 ASP N N 31 116.853 116.853 116.205 0.648 25755
2489 1 10 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.523 0.023 25755
2490 1 10 . 1 1 31 31 ASP CA C 31 56.266 56.266 56.075 0.191 25755
2491 1 10 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.765 -1.287 25755
2492 1 10 . 1 1 31 31 ASP H H 31 9.019 9.019 7.908 1.111 25755
2493 1 10 . 1 1 32 32 LYS N N 32 112.075 112.075 118.785 -6.710 25755
2494 1 10 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.189 0.360 25755
2495 1 10 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.565 -4.100 25755
2496 1 10 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.579 -0.714 25755
2497 1 10 . 1 1 32 32 LYS H H 32 6.639 6.639 8.342 -1.703 25755
2498 1 10 . 1 1 33 33 HIS N N 33 112.955 112.955 114.324 -1.369 25755
2499 1 10 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.282 0.341 25755
2500 1 10 . 1 1 33 33 HIS CA C 33 56.486 56.486 56.557 -0.071 25755
2501 1 10 . 1 1 33 33 HIS CB C 33 25.694 25.694 27.508 -1.814 25755
2502 1 10 . 1 1 33 33 HIS H H 33 7.065 7.065 8.061 -0.996 25755
2503 1 10 . 1 1 34 34 ALA N N 34 120.177 120.177 119.744 0.433 25755
2504 1 10 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.814 0.335 25755
2505 1 10 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.382 -1.603 25755
2506 1 10 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.650 -0.532 25755
2507 1 10 . 1 1 34 34 ALA H H 34 7.716 7.716 7.106 0.610 25755
2508 1 10 . 1 1 35 35 ARG N N 35 116.636 116.636 116.840 -0.204 25755
2509 1 10 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.161 0.045 25755
2510 1 10 . 1 1 35 35 ARG CA C 35 58.076 58.076 59.650 -1.574 25755
2511 1 10 . 1 1 35 35 ARG CB C 35 30.717 30.717 30.997 -0.280 25755
2512 1 10 . 1 1 35 35 ARG H H 35 8.295 8.295 8.342 -0.047 25755
2513 1 10 . 1 1 36 36 SER N N 36 109.273 109.273 110.779 -1.506 25755
2514 1 10 . 1 1 36 36 SER HA H 36 4.646 4.646 4.532 0.114 25755
2515 1 10 . 1 1 36 36 SER CA C 36 57.703 57.703 58.367 -0.664 25755
2516 1 10 . 1 1 36 36 SER CB C 36 65.425 65.425 66.566 -1.141 25755
2517 1 10 . 1 1 36 36 SER H H 36 8.026 8.026 8.837 -0.811 25755
2518 1 10 . 1 1 37 37 GLY N N 37 107.305 107.305 109.748 -2.443 25755
2519 1 10 . 1 1 37 37 GLY CA C 37 47.152 47.152 44.884 2.268 25755
2520 1 10 . 1 1 37 37 GLY H H 37 8.679 8.679 8.541 0.138 25755
2521 1 10 . 1 1 38 38 GLU N N 38 119.065 119.065 121.725 -2.660 25755
2522 1 10 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.806 -0.404 25755
2523 1 10 . 1 1 38 38 GLU CA C 38 55.773 55.773 54.753 1.020 25755
2524 1 10 . 1 1 38 38 GLU CB C 38 32.822 32.822 35.135 -2.313 25755
2525 1 10 . 1 1 38 38 GLU H H 38 8.351 8.351 8.729 -0.378 25755
2526 1 10 . 1 1 39 39 CYS N N 39 121.636 121.636 118.078 3.558 25755
2527 1 10 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.277 0.710 25755
2528 1 10 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.580 -0.852 25755
2529 1 10 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.603 16.416 25755
2530 1 10 . 1 1 39 39 CYS H H 39 8.839 8.839 8.297 0.542 25755
2531 1 10 . 1 1 40 40 PHE N N 40 121.987 121.987 120.774 1.213 25755
2532 1 10 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.904 -0.134 25755
2533 1 10 . 1 1 40 40 PHE CA C 40 56.969 56.969 55.855 1.114 25755
2534 1 10 . 1 1 40 40 PHE CB C 40 43.760 43.760 42.840 0.920 25755
2535 1 10 . 1 1 40 40 PHE H H 40 9.214 9.214 8.725 0.489 25755
2536 1 10 . 1 1 41 41 TYR N N 41 121.905 121.905 118.800 3.105 25755
2537 1 10 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.564 0.397 25755
2538 1 10 . 1 1 41 41 TYR CA C 41 58.532 58.532 59.229 -0.697 25755
2539 1 10 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.249 1.053 25755
2540 1 10 . 1 1 41 41 TYR H H 41 8.557 8.557 8.750 -0.193 25755
2541 1 10 . 1 1 42 42 ASP N N 42 123.133 123.133 121.235 1.898 25755
2542 1 10 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.840 -0.087 25755
2543 1 10 . 1 1 42 42 ASP CA C 42 52.426 52.426 52.740 -0.314 25755
2544 1 10 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.782 -1.162 25755
2545 1 10 . 1 1 42 42 ASP H H 42 8.603 8.603 8.375 0.228 25755
2546 1 10 . 1 1 43 43 GLU N N 43 118.012 118.012 118.820 -0.808 25755
2547 1 10 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.185 0.024 25755
2548 1 10 . 1 1 43 43 GLU CA C 43 58.865 58.865 58.408 0.457 25755
2549 1 10 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.689 -0.452 25755
2550 1 10 . 1 1 43 43 GLU H H 43 9.081 9.081 8.723 0.358 25755
2551 1 10 . 1 1 44 44 LYS N N 44 120.047 120.047 117.044 3.003 25755
2552 1 10 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.405 0.039 25755
2553 1 10 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.493 0.168 25755
2554 1 10 . 1 1 44 44 LYS CB C 44 32.039 32.039 32.433 -0.394 25755
2555 1 10 . 1 1 44 44 LYS H H 44 8.162 8.162 8.061 0.101 25755
2556 1 10 . 1 1 45 45 ARG N N 45 113.453 113.453 116.593 -3.140 25755
2557 1 10 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.137 -0.474 25755
2558 1 10 . 1 1 45 45 ARG CA C 45 57.736 57.736 56.766 0.970 25755
2559 1 10 . 1 1 45 45 ARG CB C 45 26.390 26.390 27.640 -1.250 25755
2560 1 10 . 1 1 45 45 ARG H H 45 8.335 8.335 7.738 0.597 25755
2561 1 10 . 1 1 46 46 ASN N N 46 118.207 118.207 117.124 1.083 25755
2562 1 10 . 1 1 46 46 ASN HA H 46 4.982 4.982 4.954 0.028 25755
2563 1 10 . 1 1 46 46 ASN CA C 46 53.066 53.066 51.824 1.242 25755
2564 1 10 . 1 1 46 46 ASN CB C 46 39.293 39.293 39.109 0.184 25755
2565 1 10 . 1 1 46 46 ASN H H 46 8.745 8.745 8.298 0.447 25755
2566 1 10 . 1 1 47 47 LEU N N 47 125.815 125.815 127.083 -1.268 25755
2567 1 10 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.029 0.250 25755
2568 1 10 . 1 1 47 47 LEU CA C 47 55.290 55.290 55.297 -0.007 25755
2569 1 10 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.744 1.562 25755
2570 1 10 . 1 1 47 47 LEU H H 47 8.509 8.509 8.880 -0.371 25755
2571 1 10 . 1 1 48 48 GLN N N 48 120.834 120.834 121.942 -1.108 25755
2572 1 10 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.697 0.039 25755
2573 1 10 . 1 1 48 48 GLN CA C 48 54.105 54.105 53.863 0.242 25755
2574 1 10 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.608 -0.742 25755
2575 1 10 . 1 1 48 48 GLN H H 48 8.589 8.589 9.040 -0.451 25755
2576 1 10 . 1 1 49 49 CYS N N 49 121.829 121.829 123.078 -1.249 25755
2577 1 10 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.600 0.258 25755
2578 1 10 . 1 1 49 49 CYS CA C 49 54.955 54.955 58.987 -4.032 25755
2579 1 10 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.708 12.737 25755
2580 1 10 . 1 1 49 49 CYS H H 49 9.247 9.247 9.089 0.158 25755
2581 1 10 . 1 1 50 50 ILE N N 50 129.010 129.010 130.382 -1.372 25755
2582 1 10 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.618 -0.232 25755
2583 1 10 . 1 1 50 50 ILE CA C 50 60.421 60.421 61.366 -0.945 25755
2584 1 10 . 1 1 50 50 ILE CB C 50 38.404 38.404 39.343 -0.939 25755
2585 1 10 . 1 1 50 50 ILE H H 50 8.787 8.787 8.414 0.373 25755
2586 1 10 . 1 1 51 51 CYS N N 51 126.108 126.108 127.178 -1.070 25755
2587 1 10 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.687 0.650 25755
2588 1 10 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.079 -6.261 25755
2589 1 10 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.525 6.457 25755
2590 1 10 . 1 1 51 51 CYS H H 51 8.556 8.556 9.308 -0.752 25755
2591 1 10 . 1 1 52 52 ASP N N 52 122.342 122.342 119.052 3.290 25755
2592 1 10 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.815 0.698 25755
2593 1 10 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.126 -0.543 25755
2594 1 10 . 1 1 52 52 ASP CB C 52 42.831 42.831 41.152 1.679 25755
2595 1 10 . 1 1 52 52 ASP H H 52 8.826 8.826 8.587 0.239 25755
2596 1 10 . 1 1 53 53 TYR N N 53 125.370 125.370 122.159 3.211 25755
2597 1 10 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.692 -0.434 25755
2598 1 10 . 1 1 53 53 TYR CA C 53 59.665 59.665 59.200 0.465 25755
2599 1 10 . 1 1 53 53 TYR CB C 53 38.783 38.783 39.143 -0.360 25755
2600 1 10 . 1 1 53 53 TYR H H 53 9.734 9.734 8.580 1.154 25755
2601 1 10 . 1 1 54 54 CYS N N 54 120.418 120.418 121.215 -0.797 25755
2602 1 10 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.481 0.013 25755
2603 1 10 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.643 -4.500 25755
2604 1 10 . 1 1 54 54 CYS CB C 54 44.382 44.382 28.949 15.433 25755
2605 1 10 . 1 1 54 54 CYS H H 54 9.478 9.478 8.943 0.535 25755
2606 1 10 . 1 1 55 55 GLU N N 55 121.097 121.097 119.723 1.374 25755
2607 1 10 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.794 -0.482 25755
2608 1 10 . 1 1 55 55 GLU CA C 55 56.010 56.010 56.092 -0.082 25755
2609 1 10 . 1 1 55 55 GLU CB C 55 31.014 31.014 32.002 -0.988 25755
2610 1 10 . 1 1 55 55 GLU H H 55 8.423 8.423 8.271 0.152 25755
2611 1 11 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.769 -0.518 25755
2612 1 11 . 1 1 2 2 ASP CA C 2 59.484 59.484 54.217 5.267 25755
2613 1 11 . 1 1 2 2 ASP CB C 2 39.412 39.412 40.584 -1.171 25755
2614 1 11 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.359 -0.014 25755
2615 1 11 . 1 1 3 3 LYS CA C 3 57.556 57.556 56.334 1.222 25755
2616 1 11 . 1 1 3 3 LYS CB C 3 32.593 32.593 32.174 0.419 25755
2617 1 11 . 1 1 4 4 CYS N N 4 117.049 117.049 118.314 -1.265 25755
2618 1 11 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.888 -0.160 25755
2619 1 11 . 1 1 4 4 CYS CA C 4 57.415 57.415 56.895 0.520 25755
2620 1 11 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.593 12.250 25755
2621 1 11 . 1 1 4 4 CYS H H 4 8.486 8.486 7.949 0.537 25755
2622 1 11 . 1 1 5 5 LYS N N 5 118.790 118.790 121.448 -2.658 25755
2623 1 11 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.893 0.678 25755
2624 1 11 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.786 -0.496 25755
2625 1 11 . 1 1 5 5 LYS CB C 5 34.606 34.606 34.843 -0.237 25755
2626 1 11 . 1 1 5 5 LYS H H 5 8.007 8.007 8.253 -0.246 25755
2627 1 11 . 1 1 6 6 LYS N N 6 121.177 121.177 120.405 0.772 25755
2628 1 11 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.528 0.257 25755
2629 1 11 . 1 1 6 6 LYS CA C 6 55.542 55.542 56.026 -0.484 25755
2630 1 11 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.419 1.483 25755
2631 1 11 . 1 1 6 6 LYS H H 6 9.014 9.014 8.743 0.271 25755
2632 1 11 . 1 1 7 7 VAL N N 7 127.629 127.629 124.509 3.120 25755
2633 1 11 . 1 1 7 7 VAL HA H 7 4.026 4.026 4.164 -0.138 25755
2634 1 11 . 1 1 7 7 VAL CA C 7 63.988 63.988 61.773 2.215 25755
2635 1 11 . 1 1 7 7 VAL CB C 7 33.107 33.107 33.066 0.041 25755
2636 1 11 . 1 1 7 7 VAL H H 7 8.837 8.837 8.535 0.302 25755
2637 1 11 . 1 1 8 8 TYR N N 8 130.003 130.003 128.869 1.134 25755
2638 1 11 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.732 -0.273 25755
2639 1 11 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.448 0.272 25755
2640 1 11 . 1 1 8 8 TYR CB C 8 36.018 36.018 38.012 -1.994 25755
2641 1 11 . 1 1 8 8 TYR H H 8 9.251 9.251 8.267 0.984 25755
2642 1 11 . 1 1 9 9 GLU N N 9 130.851 130.851 125.287 5.564 25755
2643 1 11 . 1 1 9 9 GLU HA H 9 4.204 4.204 4.152 0.052 25755
2644 1 11 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.924 -0.407 25755
2645 1 11 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.712 -0.321 25755
2646 1 11 . 1 1 9 9 GLU H H 9 9.072 9.072 8.545 0.527 25755
2647 1 11 . 1 1 10 10 ASN N N 10 116.120 116.120 117.567 -1.447 25755
2648 1 11 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.899 -0.461 25755
2649 1 11 . 1 1 10 10 ASN CA C 10 54.587 54.587 52.968 1.619 25755
2650 1 11 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.927 -0.649 25755
2651 1 11 . 1 1 10 10 ASN H H 10 9.301 9.301 8.421 0.880 25755
2652 1 11 . 1 1 11 11 TYR N N 11 122.436 122.436 121.797 0.639 25755
2653 1 11 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.481 -0.287 25755
2654 1 11 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.464 2.148 25755
2655 1 11 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.467 -2.000 25755
2656 1 11 . 1 1 11 11 TYR H H 11 7.550 7.550 7.552 -0.002 25755
2657 1 11 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.533 -0.086 25755
2658 1 11 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.573 -0.075 25755
2659 1 11 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.331 -1.740 25755
2660 1 11 . 1 1 13 13 VAL N N 13 124.506 124.506 122.367 2.139 25755
2661 1 11 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.943 -0.107 25755
2662 1 11 . 1 1 13 13 VAL CA C 13 65.761 65.761 64.436 1.325 25755
2663 1 11 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.472 0.108 25755
2664 1 11 . 1 1 13 13 VAL H H 13 8.169 8.169 8.428 -0.259 25755
2665 1 11 . 1 1 14 14 SER N N 14 116.625 116.625 117.087 -0.462 25755
2666 1 11 . 1 1 14 14 SER HA H 14 4.206 4.206 4.364 -0.158 25755
2667 1 11 . 1 1 14 14 SER CA C 14 61.194 61.194 61.813 -0.619 25755
2668 1 11 . 1 1 14 14 SER CB C 14 62.041 62.041 62.828 -0.787 25755
2669 1 11 . 1 1 14 14 SER H H 14 8.396 8.396 8.140 0.256 25755
2670 1 11 . 1 1 15 15 LYS N N 15 120.843 120.843 120.969 -0.126 25755
2671 1 11 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.026 0.174 25755
2672 1 11 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.053 0.570 25755
2673 1 11 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.123 0.063 25755
2674 1 11 . 1 1 15 15 LYS H H 15 7.791 7.791 7.976 -0.185 25755
2675 1 11 . 1 1 16 16 CYS N N 16 115.949 115.949 116.592 -0.643 25755
2676 1 11 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.365 0.528 25755
2677 1 11 . 1 1 16 16 CYS CA C 16 56.570 56.570 60.581 -4.011 25755
2678 1 11 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.678 14.759 25755
2679 1 11 . 1 1 16 16 CYS H H 16 7.870 7.870 7.645 0.225 25755
2680 1 11 . 1 1 17 17 GLN N N 17 117.241 117.241 117.480 -0.239 25755
2681 1 11 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.114 0.160 25755
2682 1 11 . 1 1 17 17 GLN CA C 17 56.937 56.937 57.091 -0.154 25755
2683 1 11 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.696 0.491 25755
2684 1 11 . 1 1 17 17 GLN H H 17 7.560 7.560 7.749 -0.189 25755
2685 1 11 . 1 1 18 18 LEU N N 18 120.537 120.537 121.258 -0.721 25755
2686 1 11 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.131 0.309 25755
2687 1 11 . 1 1 18 18 LEU CA C 18 55.448 55.448 55.181 0.267 25755
2688 1 11 . 1 1 18 18 LEU CB C 18 41.837 41.837 41.029 0.809 25755
2689 1 11 . 1 1 18 18 LEU H H 18 7.369 7.369 7.424 -0.055 25755
2690 1 11 . 1 1 19 19 ARG N N 19 121.697 121.697 123.455 -1.758 25755
2691 1 11 . 1 1 19 19 ARG HA H 19 4.299 4.299 4.024 0.275 25755
2692 1 11 . 1 1 19 19 ARG CA C 19 57.836 57.836 59.032 -1.196 25755
2693 1 11 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.324 0.068 25755
2694 1 11 . 1 1 19 19 ARG H H 19 8.447 8.447 7.967 0.480 25755
2695 1 11 . 1 1 20 20 ILE N N 20 116.439 116.439 116.482 -0.043 25755
2696 1 11 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.020 0.114 25755
2697 1 11 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.394 0.103 25755
2698 1 11 . 1 1 20 20 ILE CB C 20 38.164 38.164 38.183 -0.019 25755
2699 1 11 . 1 1 20 20 ILE H H 20 7.758 7.758 7.783 -0.025 25755
2700 1 11 . 1 1 21 21 ALA N N 21 122.642 122.642 122.807 -0.165 25755
2701 1 11 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.544 -0.162 25755
2702 1 11 . 1 1 21 21 ALA CA C 21 52.395 52.395 51.560 0.835 25755
2703 1 11 . 1 1 21 21 ALA CB C 21 20.098 20.098 19.772 0.326 25755
2704 1 11 . 1 1 21 21 ALA H H 21 7.727 7.727 7.244 0.483 25755
2705 1 11 . 1 1 22 22 ASN N N 22 116.616 116.616 121.359 -4.743 25755
2706 1 11 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.688 0.103 25755
2707 1 11 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.385 0.492 25755
2708 1 11 . 1 1 22 22 ASN CB C 22 37.554 37.554 37.993 -0.439 25755
2709 1 11 . 1 1 22 22 ASN H H 22 8.307 8.307 8.550 -0.243 25755
2710 1 11 . 1 1 23 23 GLN N N 23 124.357 124.357 122.776 1.581 25755
2711 1 11 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.321 -0.303 25755
2712 1 11 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.357 1.291 25755
2713 1 11 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.316 1.083 25755
2714 1 11 . 1 1 23 23 GLN H H 23 8.542 8.542 8.132 0.410 25755
2715 1 11 . 1 1 24 24 CYS N N 24 118.909 118.909 118.981 -0.072 25755
2716 1 11 . 1 1 24 24 CYS HA H 24 4.284 4.284 4.076 0.208 25755
2717 1 11 . 1 1 24 24 CYS CA C 24 58.406 58.406 63.111 -4.705 25755
2718 1 11 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.467 12.309 25755
2719 1 11 . 1 1 24 24 CYS H H 24 8.352 8.352 8.605 -0.253 25755
2720 1 11 . 1 1 25 25 ASN N N 25 118.182 118.182 118.254 -0.072 25755
2721 1 11 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.318 -0.430 25755
2722 1 11 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.848 0.824 25755
2723 1 11 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.574 2.199 25755
2724 1 11 . 1 1 25 25 ASN H H 25 7.504 7.504 8.411 -0.907 25755
2725 1 11 . 1 1 26 26 TYR N N 26 117.354 117.354 120.052 -2.698 25755
2726 1 11 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.181 -0.216 25755
2727 1 11 . 1 1 26 26 TYR CA C 26 62.162 62.162 61.816 0.346 25755
2728 1 11 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.765 -0.135 25755
2729 1 11 . 1 1 26 26 TYR H H 26 7.322 7.322 7.553 -0.231 25755
2730 1 11 . 1 1 27 27 ASP N N 27 119.874 119.874 120.197 -0.323 25755
2731 1 11 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.368 0.287 25755
2732 1 11 . 1 1 27 27 ASP CB C 27 40.590 40.590 41.230 -0.639 25755
2733 1 11 . 1 1 27 27 ASP H H 27 9.218 9.218 8.170 1.048 25755
2734 1 11 . 1 1 28 28 CYS N N 28 119.782 119.782 119.065 0.717 25755
2735 1 11 . 1 1 28 28 CYS HA H 28 4.168 4.168 4.078 0.090 25755
2736 1 11 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.615 -1.701 25755
2737 1 11 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.339 10.606 25755
2738 1 11 . 1 1 28 28 CYS H H 28 9.171 9.171 8.321 0.850 25755
2739 1 11 . 1 1 29 29 LYS N N 29 119.663 119.663 118.820 0.843 25755
2740 1 11 . 1 1 29 29 LYS HA H 29 4.137 4.137 3.876 0.261 25755
2741 1 11 . 1 1 29 29 LYS CA C 29 59.781 59.781 58.941 0.839 25755
2742 1 11 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.705 0.708 25755
2743 1 11 . 1 1 29 29 LYS H H 29 7.546 7.546 7.430 0.116 25755
2744 1 11 . 1 1 30 30 LEU N N 30 119.987 119.987 120.339 -0.352 25755
2745 1 11 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.760 0.351 25755
2746 1 11 . 1 1 30 30 LEU CA C 30 57.672 57.672 57.908 -0.236 25755
2747 1 11 . 1 1 30 30 LEU CB C 30 42.379 42.379 42.124 0.255 25755
2748 1 11 . 1 1 30 30 LEU H H 30 8.226 8.226 7.511 0.715 25755
2749 1 11 . 1 1 31 31 ASP N N 31 116.853 116.853 116.034 0.819 25755
2750 1 11 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.562 -0.016 25755
2751 1 11 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.650 0.616 25755
2752 1 11 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.927 -1.449 25755
2753 1 11 . 1 1 31 31 ASP H H 31 9.019 9.019 7.909 1.110 25755
2754 1 11 . 1 1 32 32 LYS N N 32 112.075 112.075 118.495 -6.420 25755
2755 1 11 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.171 0.378 25755
2756 1 11 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.830 -4.365 25755
2757 1 11 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.589 -0.724 25755
2758 1 11 . 1 1 32 32 LYS H H 32 6.639 6.639 8.416 -1.777 25755
2759 1 11 . 1 1 33 33 HIS N N 33 112.955 112.955 114.385 -1.430 25755
2760 1 11 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.152 0.471 25755
2761 1 11 . 1 1 33 33 HIS CA C 33 56.486 56.486 55.699 0.787 25755
2762 1 11 . 1 1 33 33 HIS CB C 33 25.694 25.694 28.122 -2.428 25755
2763 1 11 . 1 1 33 33 HIS H H 33 7.065 7.065 8.025 -0.960 25755
2764 1 11 . 1 1 34 34 ALA N N 34 120.177 120.177 119.504 0.673 25755
2765 1 11 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.768 0.381 25755
2766 1 11 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.432 -1.653 25755
2767 1 11 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.748 -0.630 25755
2768 1 11 . 1 1 34 34 ALA H H 34 7.716 7.716 7.112 0.604 25755
2769 1 11 . 1 1 35 35 ARG N N 35 116.636 116.636 117.236 -0.600 25755
2770 1 11 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.102 0.104 25755
2771 1 11 . 1 1 35 35 ARG CA C 35 58.076 58.076 59.411 -1.335 25755
2772 1 11 . 1 1 35 35 ARG CB C 35 30.717 30.717 31.162 -0.445 25755
2773 1 11 . 1 1 35 35 ARG H H 35 8.295 8.295 8.256 0.039 25755
2774 1 11 . 1 1 36 36 SER N N 36 109.273 109.273 111.529 -2.256 25755
2775 1 11 . 1 1 36 36 SER HA H 36 4.646 4.646 4.418 0.228 25755
2776 1 11 . 1 1 36 36 SER CA C 36 57.703 57.703 57.789 -0.086 25755
2777 1 11 . 1 1 36 36 SER CB C 36 65.425 65.425 66.368 -0.943 25755
2778 1 11 . 1 1 36 36 SER H H 36 8.026 8.026 8.809 -0.783 25755
2779 1 11 . 1 1 37 37 GLY N N 37 107.305 107.305 112.219 -4.914 25755
2780 1 11 . 1 1 37 37 GLY CA C 37 47.152 47.152 45.169 1.983 25755
2781 1 11 . 1 1 37 37 GLY H H 37 8.679 8.679 8.427 0.252 25755
2782 1 11 . 1 1 38 38 GLU N N 38 119.065 119.065 122.219 -3.154 25755
2783 1 11 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.564 -0.162 25755
2784 1 11 . 1 1 38 38 GLU CA C 38 55.773 55.773 54.740 1.033 25755
2785 1 11 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.951 -2.129 25755
2786 1 11 . 1 1 38 38 GLU H H 38 8.351 8.351 8.644 -0.293 25755
2787 1 11 . 1 1 39 39 CYS N N 39 121.636 121.636 118.535 3.101 25755
2788 1 11 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.437 0.550 25755
2789 1 11 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.697 -0.969 25755
2790 1 11 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.872 16.147 25755
2791 1 11 . 1 1 39 39 CYS H H 39 8.839 8.839 8.291 0.548 25755
2792 1 11 . 1 1 40 40 PHE N N 40 121.987 121.987 120.311 1.676 25755
2793 1 11 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.767 0.003 25755
2794 1 11 . 1 1 40 40 PHE CA C 40 56.969 56.969 56.513 0.456 25755
2795 1 11 . 1 1 40 40 PHE CB C 40 43.760 43.760 43.014 0.746 25755
2796 1 11 . 1 1 40 40 PHE H H 40 9.214 9.214 8.840 0.374 25755
2797 1 11 . 1 1 41 41 TYR N N 41 121.905 121.905 119.688 2.217 25755
2798 1 11 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.633 0.327 25755
2799 1 11 . 1 1 41 41 TYR CA C 41 58.532 58.532 59.340 -0.808 25755
2800 1 11 . 1 1 41 41 TYR CB C 41 40.302 40.302 38.997 1.305 25755
2801 1 11 . 1 1 41 41 TYR H H 41 8.557 8.557 8.681 -0.124 25755
2802 1 11 . 1 1 42 42 ASP N N 42 123.133 123.133 121.781 1.352 25755
2803 1 11 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.845 -0.092 25755
2804 1 11 . 1 1 42 42 ASP CA C 42 52.426 52.426 53.127 -0.701 25755
2805 1 11 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.837 -1.217 25755
2806 1 11 . 1 1 42 42 ASP H H 42 8.603 8.603 8.059 0.544 25755
2807 1 11 . 1 1 43 43 GLU N N 43 118.012 118.012 119.658 -1.646 25755
2808 1 11 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.107 0.102 25755
2809 1 11 . 1 1 43 43 GLU CA C 43 58.865 58.865 58.842 0.023 25755
2810 1 11 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.616 -0.379 25755
2811 1 11 . 1 1 43 43 GLU H H 43 9.081 9.081 8.657 0.424 25755
2812 1 11 . 1 1 44 44 LYS N N 44 120.047 120.047 117.175 2.872 25755
2813 1 11 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.423 0.021 25755
2814 1 11 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.495 0.167 25755
2815 1 11 . 1 1 44 44 LYS CB C 44 32.039 32.039 32.626 -0.587 25755
2816 1 11 . 1 1 44 44 LYS H H 44 8.162 8.162 7.822 0.340 25755
2817 1 11 . 1 1 45 45 ARG N N 45 113.453 113.453 115.741 -2.288 25755
2818 1 11 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.050 -0.387 25755
2819 1 11 . 1 1 45 45 ARG CA C 45 57.736 57.736 56.845 0.891 25755
2820 1 11 . 1 1 45 45 ARG CB C 45 26.390 26.390 27.474 -1.084 25755
2821 1 11 . 1 1 45 45 ARG H H 45 8.335 8.335 7.804 0.531 25755
2822 1 11 . 1 1 46 46 ASN N N 46 118.207 118.207 116.447 1.760 25755
2823 1 11 . 1 1 46 46 ASN HA H 46 4.982 4.982 4.967 0.015 25755
2824 1 11 . 1 1 46 46 ASN CA C 46 53.066 53.066 52.204 0.862 25755
2825 1 11 . 1 1 46 46 ASN CB C 46 39.293 39.293 38.910 0.383 25755
2826 1 11 . 1 1 46 46 ASN H H 46 8.745 8.745 8.246 0.499 25755
2827 1 11 . 1 1 47 47 LEU N N 47 125.815 125.815 126.819 -1.004 25755
2828 1 11 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.036 0.243 25755
2829 1 11 . 1 1 47 47 LEU CA C 47 55.290 55.290 55.249 0.041 25755
2830 1 11 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.077 2.229 25755
2831 1 11 . 1 1 47 47 LEU H H 47 8.509 8.509 8.859 -0.350 25755
2832 1 11 . 1 1 48 48 GLN N N 48 120.834 120.834 122.593 -1.759 25755
2833 1 11 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.666 0.070 25755
2834 1 11 . 1 1 48 48 GLN CA C 48 54.105 54.105 54.613 -0.508 25755
2835 1 11 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.138 -0.272 25755
2836 1 11 . 1 1 48 48 GLN H H 48 8.589 8.589 8.867 -0.278 25755
2837 1 11 . 1 1 49 49 CYS N N 49 121.829 121.829 121.766 0.063 25755
2838 1 11 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.518 0.340 25755
2839 1 11 . 1 1 49 49 CYS CA C 49 54.955 54.955 59.049 -4.094 25755
2840 1 11 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.635 12.810 25755
2841 1 11 . 1 1 49 49 CYS H H 49 9.247 9.247 8.991 0.256 25755
2842 1 11 . 1 1 50 50 ILE N N 50 129.010 129.010 129.409 -0.399 25755
2843 1 11 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.546 -0.160 25755
2844 1 11 . 1 1 50 50 ILE CA C 50 60.421 60.421 61.351 -0.930 25755
2845 1 11 . 1 1 50 50 ILE CB C 50 38.404 38.404 39.133 -0.729 25755
2846 1 11 . 1 1 50 50 ILE H H 50 8.787 8.787 8.403 0.384 25755
2847 1 11 . 1 1 51 51 CYS N N 51 126.108 126.108 127.304 -1.196 25755
2848 1 11 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.624 0.713 25755
2849 1 11 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.121 -6.303 25755
2850 1 11 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.255 6.727 25755
2851 1 11 . 1 1 51 51 CYS H H 51 8.556 8.556 9.295 -0.739 25755
2852 1 11 . 1 1 52 52 ASP N N 52 122.342 122.342 118.974 3.368 25755
2853 1 11 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.817 0.696 25755
2854 1 11 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.108 -0.525 25755
2855 1 11 . 1 1 52 52 ASP CB C 52 42.831 42.831 41.235 1.596 25755
2856 1 11 . 1 1 52 52 ASP H H 52 8.826 8.826 8.561 0.265 25755
2857 1 11 . 1 1 53 53 TYR N N 53 125.370 125.370 122.010 3.360 25755
2858 1 11 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.693 -0.435 25755
2859 1 11 . 1 1 53 53 TYR CA C 53 59.665 59.665 59.123 0.541 25755
2860 1 11 . 1 1 53 53 TYR CB C 53 38.783 38.783 39.181 -0.398 25755
2861 1 11 . 1 1 53 53 TYR H H 53 9.734 9.734 8.568 1.166 25755
2862 1 11 . 1 1 54 54 CYS N N 54 120.418 120.418 121.149 -0.731 25755
2863 1 11 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.472 0.022 25755
2864 1 11 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.650 -4.506 25755
2865 1 11 . 1 1 54 54 CYS CB C 54 44.382 44.382 28.971 15.411 25755
2866 1 11 . 1 1 54 54 CYS H H 54 9.478 9.478 8.930 0.548 25755
2867 1 11 . 1 1 55 55 GLU N N 55 121.097 121.097 119.729 1.368 25755
2868 1 11 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.746 -0.434 25755
2869 1 11 . 1 1 55 55 GLU CA C 55 56.010 56.010 56.029 -0.019 25755
2870 1 11 . 1 1 55 55 GLU CB C 55 31.014 31.014 31.174 -0.160 25755
2871 1 11 . 1 1 55 55 GLU H H 55 8.423 8.423 8.274 0.149 25755
2872 1 12 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.798 -0.547 25755
2873 1 12 . 1 1 2 2 ASP CA C 2 59.484 59.484 54.180 5.304 25755
2874 1 12 . 1 1 2 2 ASP CB C 2 39.412 39.412 40.942 -1.530 25755
2875 1 12 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.204 0.141 25755
2876 1 12 . 1 1 3 3 LYS CA C 3 57.556 57.556 57.268 0.288 25755
2877 1 12 . 1 1 3 3 LYS CB C 3 32.593 32.593 32.772 -0.179 25755
2878 1 12 . 1 1 4 4 CYS N N 4 117.049 117.049 117.962 -0.913 25755
2879 1 12 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.910 -0.182 25755
2880 1 12 . 1 1 4 4 CYS CA C 4 57.415 57.415 56.303 1.112 25755
2881 1 12 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.317 12.526 25755
2882 1 12 . 1 1 4 4 CYS H H 4 8.486 8.486 7.942 0.544 25755
2883 1 12 . 1 1 5 5 LYS N N 5 118.790 118.790 121.186 -2.396 25755
2884 1 12 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.843 0.728 25755
2885 1 12 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.736 -0.446 25755
2886 1 12 . 1 1 5 5 LYS CB C 5 34.606 34.606 34.892 -0.287 25755
2887 1 12 . 1 1 5 5 LYS H H 5 8.007 8.007 8.198 -0.191 25755
2888 1 12 . 1 1 6 6 LYS N N 6 121.177 121.177 120.220 0.957 25755
2889 1 12 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.581 0.204 25755
2890 1 12 . 1 1 6 6 LYS CA C 6 55.542 55.542 56.019 -0.477 25755
2891 1 12 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.732 1.170 25755
2892 1 12 . 1 1 6 6 LYS H H 6 9.014 9.014 8.753 0.261 25755
2893 1 12 . 1 1 7 7 VAL N N 7 127.629 127.629 124.179 3.450 25755
2894 1 12 . 1 1 7 7 VAL HA H 7 4.026 4.026 4.034 -0.008 25755
2895 1 12 . 1 1 7 7 VAL CA C 7 63.988 63.988 62.084 1.904 25755
2896 1 12 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.744 0.363 25755
2897 1 12 . 1 1 7 7 VAL H H 7 8.837 8.837 8.636 0.201 25755
2898 1 12 . 1 1 8 8 TYR N N 8 130.003 130.003 129.354 0.649 25755
2899 1 12 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.758 -0.299 25755
2900 1 12 . 1 1 8 8 TYR CA C 8 55.720 55.720 56.059 -0.339 25755
2901 1 12 . 1 1 8 8 TYR CB C 8 36.018 36.018 37.970 -1.952 25755
2902 1 12 . 1 1 8 8 TYR H H 8 9.251 9.251 8.290 0.961 25755
2903 1 12 . 1 1 9 9 GLU N N 9 130.851 130.851 125.601 5.250 25755
2904 1 12 . 1 1 9 9 GLU HA H 9 4.204 4.204 4.159 0.045 25755
2905 1 12 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.136 0.381 25755
2906 1 12 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.516 -0.125 25755
2907 1 12 . 1 1 9 9 GLU H H 9 9.072 9.072 8.560 0.512 25755
2908 1 12 . 1 1 10 10 ASN N N 10 116.120 116.120 117.259 -1.139 25755
2909 1 12 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.676 -0.238 25755
2910 1 12 . 1 1 10 10 ASN CA C 10 54.587 54.587 52.622 1.965 25755
2911 1 12 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.859 -0.581 25755
2912 1 12 . 1 1 10 10 ASN H H 10 9.301 9.301 7.623 1.678 25755
2913 1 12 . 1 1 11 11 TYR N N 11 122.436 122.436 119.970 2.466 25755
2914 1 12 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.618 -0.424 25755
2915 1 12 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.614 1.998 25755
2916 1 12 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.992 -2.525 25755
2917 1 12 . 1 1 11 11 TYR H H 11 7.550 7.550 7.233 0.317 25755
2918 1 12 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.573 -0.126 25755
2919 1 12 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.690 -0.192 25755
2920 1 12 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.779 -2.188 25755
2921 1 12 . 1 1 13 13 VAL N N 13 124.506 124.506 122.191 2.315 25755
2922 1 12 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.770 0.066 25755
2923 1 12 . 1 1 13 13 VAL CA C 13 65.761 65.761 65.014 0.747 25755
2924 1 12 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.629 -0.049 25755
2925 1 12 . 1 1 13 13 VAL H H 13 8.169 8.169 8.404 -0.235 25755
2926 1 12 . 1 1 14 14 SER N N 14 116.625 116.625 116.880 -0.255 25755
2927 1 12 . 1 1 14 14 SER HA H 14 4.206 4.206 4.390 -0.184 25755
2928 1 12 . 1 1 14 14 SER CA C 14 61.194 61.194 61.897 -0.703 25755
2929 1 12 . 1 1 14 14 SER CB C 14 62.041 62.041 62.538 -0.497 25755
2930 1 12 . 1 1 14 14 SER H H 14 8.396 8.396 8.296 0.100 25755
2931 1 12 . 1 1 15 15 LYS N N 15 120.843 120.843 122.080 -1.237 25755
2932 1 12 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.038 0.162 25755
2933 1 12 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.227 0.396 25755
2934 1 12 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.037 0.149 25755
2935 1 12 . 1 1 15 15 LYS H H 15 7.791 7.791 7.696 0.095 25755
2936 1 12 . 1 1 16 16 CYS N N 16 115.949 115.949 117.437 -1.488 25755
2937 1 12 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.496 0.397 25755
2938 1 12 . 1 1 16 16 CYS CA C 16 56.570 56.570 61.042 -4.473 25755
2939 1 12 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.781 14.656 25755
2940 1 12 . 1 1 16 16 CYS H H 16 7.870 7.870 7.557 0.313 25755
2941 1 12 . 1 1 17 17 GLN N N 17 117.241 117.241 117.393 -0.152 25755
2942 1 12 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.085 0.189 25755
2943 1 12 . 1 1 17 17 GLN CA C 17 56.937 56.937 57.197 -0.260 25755
2944 1 12 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.654 0.533 25755
2945 1 12 . 1 1 17 17 GLN H H 17 7.560 7.560 7.680 -0.120 25755
2946 1 12 . 1 1 18 18 LEU N N 18 120.537 120.537 121.126 -0.589 25755
2947 1 12 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.138 0.302 25755
2948 1 12 . 1 1 18 18 LEU CA C 18 55.448 55.448 55.338 0.110 25755
2949 1 12 . 1 1 18 18 LEU CB C 18 41.837 41.837 41.008 0.829 25755
2950 1 12 . 1 1 18 18 LEU H H 18 7.369 7.369 7.406 -0.037 25755
2951 1 12 . 1 1 19 19 ARG N N 19 121.697 121.697 122.472 -0.775 25755
2952 1 12 . 1 1 19 19 ARG HA H 19 4.299 4.299 4.052 0.247 25755
2953 1 12 . 1 1 19 19 ARG CA C 19 57.836 57.836 58.851 -1.015 25755
2954 1 12 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.313 0.079 25755
2955 1 12 . 1 1 19 19 ARG H H 19 8.447 8.447 7.990 0.457 25755
2956 1 12 . 1 1 20 20 ILE N N 20 116.439 116.439 116.656 -0.217 25755
2957 1 12 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.064 0.070 25755
2958 1 12 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.370 0.127 25755
2959 1 12 . 1 1 20 20 ILE CB C 20 38.164 38.164 38.203 -0.039 25755
2960 1 12 . 1 1 20 20 ILE H H 20 7.758 7.758 7.760 -0.002 25755
2961 1 12 . 1 1 21 21 ALA N N 21 122.642 122.642 122.996 -0.354 25755
2962 1 12 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.556 -0.174 25755
2963 1 12 . 1 1 21 21 ALA CA C 21 52.395 52.395 51.602 0.793 25755
2964 1 12 . 1 1 21 21 ALA CB C 21 20.098 20.098 19.693 0.405 25755
2965 1 12 . 1 1 21 21 ALA H H 21 7.727 7.727 7.240 0.487 25755
2966 1 12 . 1 1 22 22 ASN N N 22 116.616 116.616 121.819 -5.203 25755
2967 1 12 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.932 -0.141 25755
2968 1 12 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.315 0.562 25755
2969 1 12 . 1 1 22 22 ASN CB C 22 37.554 37.554 38.090 -0.536 25755
2970 1 12 . 1 1 22 22 ASN H H 22 8.307 8.307 8.527 -0.220 25755
2971 1 12 . 1 1 23 23 GLN N N 23 124.357 124.357 124.027 0.330 25755
2972 1 12 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.318 -0.300 25755
2973 1 12 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.286 1.362 25755
2974 1 12 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.634 0.765 25755
2975 1 12 . 1 1 23 23 GLN H H 23 8.542 8.542 8.282 0.260 25755
2976 1 12 . 1 1 24 24 CYS N N 24 118.909 118.909 119.386 -0.477 25755
2977 1 12 . 1 1 24 24 CYS HA H 24 4.284 4.284 3.988 0.296 25755
2978 1 12 . 1 1 24 24 CYS CA C 24 58.406 58.406 63.186 -4.780 25755
2979 1 12 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.642 12.134 25755
2980 1 12 . 1 1 24 24 CYS H H 24 8.352 8.352 8.716 -0.364 25755
2981 1 12 . 1 1 25 25 ASN N N 25 118.182 118.182 119.270 -1.088 25755
2982 1 12 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.231 -0.343 25755
2983 1 12 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.479 1.193 25755
2984 1 12 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.259 2.514 25755
2985 1 12 . 1 1 25 25 ASN H H 25 7.504 7.504 8.459 -0.955 25755
2986 1 12 . 1 1 26 26 TYR N N 26 117.354 117.354 119.272 -1.918 25755
2987 1 12 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.161 -0.196 25755
2988 1 12 . 1 1 26 26 TYR CA C 26 62.162 62.162 61.888 0.274 25755
2989 1 12 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.832 -0.202 25755
2990 1 12 . 1 1 26 26 TYR H H 26 7.322 7.322 7.565 -0.243 25755
2991 1 12 . 1 1 27 27 ASP N N 27 119.874 119.874 120.090 -0.216 25755
2992 1 12 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.390 0.265 25755
2993 1 12 . 1 1 27 27 ASP CB C 27 40.590 40.590 40.607 -0.017 25755
2994 1 12 . 1 1 27 27 ASP H H 27 9.218 9.218 8.207 1.011 25755
2995 1 12 . 1 1 28 28 CYS N N 28 119.782 119.782 118.967 0.815 25755
2996 1 12 . 1 1 28 28 CYS HA H 28 4.168 4.168 3.896 0.272 25755
2997 1 12 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.705 -1.791 25755
2998 1 12 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.203 10.742 25755
2999 1 12 . 1 1 28 28 CYS H H 28 9.171 9.171 8.350 0.821 25755
3000 1 12 . 1 1 29 29 LYS N N 29 119.663 119.663 119.088 0.575 25755
3001 1 12 . 1 1 29 29 LYS HA H 29 4.137 4.137 3.930 0.207 25755
3002 1 12 . 1 1 29 29 LYS CA C 29 59.781 59.781 59.071 0.710 25755
3003 1 12 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.836 0.577 25755
3004 1 12 . 1 1 29 29 LYS H H 29 7.546 7.546 7.461 0.085 25755
3005 1 12 . 1 1 30 30 LEU N N 30 119.987 119.987 120.910 -0.923 25755
3006 1 12 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.951 0.160 25755
3007 1 12 . 1 1 30 30 LEU CA C 30 57.672 57.672 57.807 -0.135 25755
3008 1 12 . 1 1 30 30 LEU CB C 30 42.379 42.379 42.209 0.170 25755
3009 1 12 . 1 1 30 30 LEU H H 30 8.226 8.226 7.733 0.493 25755
3010 1 12 . 1 1 31 31 ASP N N 31 116.853 116.853 117.791 -0.938 25755
3011 1 12 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.593 -0.047 25755
3012 1 12 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.194 1.073 25755
3013 1 12 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.060 -0.582 25755
3014 1 12 . 1 1 31 31 ASP H H 31 9.019 9.019 7.952 1.067 25755
3015 1 12 . 1 1 32 32 LYS N N 32 112.075 112.075 118.674 -6.599 25755
3016 1 12 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.134 0.415 25755
3017 1 12 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.651 -4.186 25755
3018 1 12 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.645 -0.780 25755
3019 1 12 . 1 1 32 32 LYS H H 32 6.639 6.639 8.153 -1.514 25755
3020 1 12 . 1 1 33 33 HIS N N 33 112.955 112.955 115.167 -2.212 25755
3021 1 12 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.136 0.487 25755
3022 1 12 . 1 1 33 33 HIS CA C 33 56.486 56.486 55.478 1.008 25755
3023 1 12 . 1 1 33 33 HIS CB C 33 25.694 25.694 28.404 -2.710 25755
3024 1 12 . 1 1 33 33 HIS H H 33 7.065 7.065 8.119 -1.054 25755
3025 1 12 . 1 1 34 34 ALA N N 34 120.177 120.177 119.568 0.609 25755
3026 1 12 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.663 0.486 25755
3027 1 12 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.336 -1.556 25755
3028 1 12 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.506 -0.388 25755
3029 1 12 . 1 1 34 34 ALA H H 34 7.716 7.716 7.060 0.656 25755
3030 1 12 . 1 1 35 35 ARG N N 35 116.636 116.636 117.559 -0.923 25755
3031 1 12 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.031 0.175 25755
3032 1 12 . 1 1 35 35 ARG CA C 35 58.076 58.076 58.434 -0.357 25755
3033 1 12 . 1 1 35 35 ARG CB C 35 30.717 30.717 30.258 0.459 25755
3034 1 12 . 1 1 35 35 ARG H H 35 8.295 8.295 8.015 0.280 25755
3035 1 12 . 1 1 36 36 SER N N 36 109.273 109.273 111.691 -2.418 25755
3036 1 12 . 1 1 36 36 SER HA H 36 4.646 4.646 4.366 0.280 25755
3037 1 12 . 1 1 36 36 SER CA C 36 57.703 57.703 58.351 -0.648 25755
3038 1 12 . 1 1 36 36 SER CB C 36 65.425 65.425 65.378 0.047 25755
3039 1 12 . 1 1 36 36 SER H H 36 8.026 8.026 8.240 -0.214 25755
3040 1 12 . 1 1 37 37 GLY N N 37 107.305 107.305 111.279 -3.974 25755
3041 1 12 . 1 1 37 37 GLY CA C 37 47.152 47.152 45.032 2.120 25755
3042 1 12 . 1 1 37 37 GLY H H 37 8.679 8.679 7.824 0.855 25755
3043 1 12 . 1 1 38 38 GLU N N 38 119.065 119.065 122.467 -3.402 25755
3044 1 12 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.570 -0.168 25755
3045 1 12 . 1 1 38 38 GLU CA C 38 55.773 55.773 55.468 0.305 25755
3046 1 12 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.902 -2.080 25755
3047 1 12 . 1 1 38 38 GLU H H 38 8.351 8.351 8.782 -0.431 25755
3048 1 12 . 1 1 39 39 CYS N N 39 121.636 121.636 118.299 3.337 25755
3049 1 12 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.291 0.696 25755
3050 1 12 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.809 -1.081 25755
3051 1 12 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.310 16.709 25755
3052 1 12 . 1 1 39 39 CYS H H 39 8.839 8.839 8.302 0.537 25755
3053 1 12 . 1 1 40 40 PHE N N 40 121.987 121.987 120.409 1.578 25755
3054 1 12 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.770 -0.000 25755
3055 1 12 . 1 1 40 40 PHE CA C 40 56.969 56.969 56.154 0.816 25755
3056 1 12 . 1 1 40 40 PHE CB C 40 43.760 43.760 42.994 0.766 25755
3057 1 12 . 1 1 40 40 PHE H H 40 9.214 9.214 8.639 0.575 25755
3058 1 12 . 1 1 41 41 TYR N N 41 121.905 121.905 120.259 1.646 25755
3059 1 12 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.703 0.257 25755
3060 1 12 . 1 1 41 41 TYR CA C 41 58.532 58.532 58.636 -0.104 25755
3061 1 12 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.253 1.049 25755
3062 1 12 . 1 1 41 41 TYR H H 41 8.557 8.557 8.751 -0.194 25755
3063 1 12 . 1 1 42 42 ASP N N 42 123.133 123.133 121.757 1.376 25755
3064 1 12 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.815 -0.062 25755
3065 1 12 . 1 1 42 42 ASP CA C 42 52.426 52.426 52.509 -0.083 25755
3066 1 12 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.524 -0.904 25755
3067 1 12 . 1 1 42 42 ASP H H 42 8.603 8.603 8.484 0.119 25755
3068 1 12 . 1 1 43 43 GLU N N 43 118.012 118.012 119.106 -1.094 25755
3069 1 12 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.105 0.104 25755
3070 1 12 . 1 1 43 43 GLU CA C 43 58.865 58.865 59.592 -0.727 25755
3071 1 12 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.545 -0.308 25755
3072 1 12 . 1 1 43 43 GLU H H 43 9.081 9.081 8.753 0.328 25755
3073 1 12 . 1 1 44 44 LYS N N 44 120.047 120.047 116.964 3.083 25755
3074 1 12 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.344 0.100 25755
3075 1 12 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.790 -0.129 25755
3076 1 12 . 1 1 44 44 LYS CB C 44 32.039 32.039 31.772 0.267 25755
3077 1 12 . 1 1 44 44 LYS H H 44 8.162 8.162 8.422 -0.260 25755
3078 1 12 . 1 1 45 45 ARG N N 45 113.453 113.453 115.390 -1.937 25755
3079 1 12 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.063 -0.400 25755
3080 1 12 . 1 1 45 45 ARG CA C 45 57.736 57.736 57.112 0.624 25755
3081 1 12 . 1 1 45 45 ARG CB C 45 26.390 26.390 26.949 -0.559 25755
3082 1 12 . 1 1 45 45 ARG H H 45 8.335 8.335 8.115 0.220 25755
3083 1 12 . 1 1 46 46 ASN N N 46 118.207 118.207 117.627 0.580 25755
3084 1 12 . 1 1 46 46 ASN HA H 46 4.982 4.982 5.024 -0.042 25755
3085 1 12 . 1 1 46 46 ASN CA C 46 53.066 53.066 51.840 1.226 25755
3086 1 12 . 1 1 46 46 ASN CB C 46 39.293 39.293 39.697 -0.404 25755
3087 1 12 . 1 1 46 46 ASN H H 46 8.745 8.745 9.022 -0.277 25755
3088 1 12 . 1 1 47 47 LEU N N 47 125.815 125.815 126.984 -1.169 25755
3089 1 12 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.080 0.199 25755
3090 1 12 . 1 1 47 47 LEU CA C 47 55.290 55.290 54.919 0.371 25755
3091 1 12 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.630 1.676 25755
3092 1 12 . 1 1 47 47 LEU H H 47 8.509 8.509 8.819 -0.310 25755
3093 1 12 . 1 1 48 48 GLN N N 48 120.834 120.834 122.214 -1.380 25755
3094 1 12 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.668 0.068 25755
3095 1 12 . 1 1 48 48 GLN CA C 48 54.105 54.105 53.900 0.205 25755
3096 1 12 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.492 -0.626 25755
3097 1 12 . 1 1 48 48 GLN H H 48 8.589 8.589 8.860 -0.271 25755
3098 1 12 . 1 1 49 49 CYS N N 49 121.829 121.829 123.239 -1.410 25755
3099 1 12 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.521 0.337 25755
3100 1 12 . 1 1 49 49 CYS CA C 49 54.955 54.955 59.169 -4.214 25755
3101 1 12 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.555 12.890 25755
3102 1 12 . 1 1 49 49 CYS H H 49 9.247 9.247 8.883 0.364 25755
3103 1 12 . 1 1 50 50 ILE N N 50 129.010 129.010 130.040 -1.030 25755
3104 1 12 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.456 -0.070 25755
3105 1 12 . 1 1 50 50 ILE CA C 50 60.421 60.421 61.953 -1.532 25755
3106 1 12 . 1 1 50 50 ILE CB C 50 38.404 38.404 38.970 -0.566 25755
3107 1 12 . 1 1 50 50 ILE H H 50 8.787 8.787 7.938 0.849 25755
3108 1 12 . 1 1 51 51 CYS N N 51 126.108 126.108 127.982 -1.874 25755
3109 1 12 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.660 0.677 25755
3110 1 12 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.254 -6.436 25755
3111 1 12 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.646 6.336 25755
3112 1 12 . 1 1 51 51 CYS H H 51 8.556 8.556 9.271 -0.715 25755
3113 1 12 . 1 1 52 52 ASP N N 52 122.342 122.342 120.191 2.151 25755
3114 1 12 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.978 0.535 25755
3115 1 12 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.672 -1.089 25755
3116 1 12 . 1 1 52 52 ASP CB C 52 42.831 42.831 42.465 0.366 25755
3117 1 12 . 1 1 52 52 ASP H H 52 8.826 8.826 8.539 0.287 25755
3118 1 12 . 1 1 53 53 TYR N N 53 125.370 125.370 122.198 3.172 25755
3119 1 12 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.579 -0.321 25755
3120 1 12 . 1 1 53 53 TYR CA C 53 59.665 59.665 59.043 0.622 25755
3121 1 12 . 1 1 53 53 TYR CB C 53 38.783 38.783 39.238 -0.455 25755
3122 1 12 . 1 1 53 53 TYR H H 53 9.734 9.734 8.662 1.072 25755
3123 1 12 . 1 1 54 54 CYS N N 54 120.418 120.418 121.185 -0.767 25755
3124 1 12 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.434 0.060 25755
3125 1 12 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.660 -4.517 25755
3126 1 12 . 1 1 54 54 CYS CB C 54 44.382 44.382 28.558 15.824 25755
3127 1 12 . 1 1 54 54 CYS H H 54 9.478 9.478 8.759 0.719 25755
3128 1 12 . 1 1 55 55 GLU N N 55 121.097 121.097 120.460 0.637 25755
3129 1 12 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.403 -0.091 25755
3130 1 12 . 1 1 55 55 GLU CA C 55 56.010 56.010 57.608 -1.598 25755
3131 1 12 . 1 1 55 55 GLU CB C 55 31.014 31.014 30.477 0.537 25755
3132 1 12 . 1 1 55 55 GLU H H 55 8.423 8.423 8.227 0.196 25755
3133 1 13 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.370 -0.119 25755
3134 1 13 . 1 1 2 2 ASP CA C 2 59.484 59.484 55.018 4.466 25755
3135 1 13 . 1 1 2 2 ASP CB C 2 39.412 39.412 39.903 -0.491 25755
3136 1 13 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.368 -0.023 25755
3137 1 13 . 1 1 3 3 LYS CA C 3 57.556 57.556 56.533 1.023 25755
3138 1 13 . 1 1 3 3 LYS CB C 3 32.593 32.593 32.947 -0.354 25755
3139 1 13 . 1 1 4 4 CYS N N 4 117.049 117.049 118.890 -1.841 25755
3140 1 13 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.880 -0.152 25755
3141 1 13 . 1 1 4 4 CYS CA C 4 57.415 57.415 57.220 0.195 25755
3142 1 13 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.240 12.603 25755
3143 1 13 . 1 1 4 4 CYS H H 4 8.486 8.486 7.790 0.696 25755
3144 1 13 . 1 1 5 5 LYS N N 5 118.790 118.790 121.513 -2.723 25755
3145 1 13 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.904 0.667 25755
3146 1 13 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.837 -0.547 25755
3147 1 13 . 1 1 5 5 LYS CB C 5 34.606 34.606 34.843 -0.236 25755
3148 1 13 . 1 1 5 5 LYS H H 5 8.007 8.007 8.268 -0.261 25755
3149 1 13 . 1 1 6 6 LYS N N 6 121.177 121.177 120.443 0.734 25755
3150 1 13 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.571 0.214 25755
3151 1 13 . 1 1 6 6 LYS CA C 6 55.542 55.542 55.996 -0.454 25755
3152 1 13 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.525 1.377 25755
3153 1 13 . 1 1 6 6 LYS H H 6 9.014 9.014 8.776 0.238 25755
3154 1 13 . 1 1 7 7 VAL N N 7 127.629 127.629 124.863 2.766 25755
3155 1 13 . 1 1 7 7 VAL HA H 7 4.026 4.026 4.147 -0.121 25755
3156 1 13 . 1 1 7 7 VAL CA C 7 63.988 63.988 62.202 1.786 25755
3157 1 13 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.723 0.384 25755
3158 1 13 . 1 1 7 7 VAL H H 7 8.837 8.837 8.691 0.146 25755
3159 1 13 . 1 1 8 8 TYR N N 8 130.003 130.003 129.979 0.024 25755
3160 1 13 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.731 -0.272 25755
3161 1 13 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.535 0.185 25755
3162 1 13 . 1 1 8 8 TYR CB C 8 36.018 36.018 38.147 -2.129 25755
3163 1 13 . 1 1 8 8 TYR H H 8 9.251 9.251 8.519 0.732 25755
3164 1 13 . 1 1 9 9 GLU N N 9 130.851 130.851 124.659 6.192 25755
3165 1 13 . 1 1 9 9 GLU HA H 9 4.204 4.204 4.045 0.159 25755
3166 1 13 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.230 0.287 25755
3167 1 13 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.333 0.058 25755
3168 1 13 . 1 1 9 9 GLU H H 9 9.072 9.072 8.488 0.584 25755
3169 1 13 . 1 1 10 10 ASN N N 10 116.120 116.120 117.558 -1.438 25755
3170 1 13 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.596 -0.158 25755
3171 1 13 . 1 1 10 10 ASN CA C 10 54.587 54.587 52.794 1.793 25755
3172 1 13 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.410 -0.133 25755
3173 1 13 . 1 1 10 10 ASN H H 10 9.301 9.301 7.621 1.680 25755
3174 1 13 . 1 1 11 11 TYR N N 11 122.436 122.436 120.288 2.148 25755
3175 1 13 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.637 -0.443 25755
3176 1 13 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.246 2.366 25755
3177 1 13 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.821 -2.354 25755
3178 1 13 . 1 1 11 11 TYR H H 11 7.550 7.550 7.594 -0.044 25755
3179 1 13 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.553 -0.106 25755
3180 1 13 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.493 0.005 25755
3181 1 13 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.586 -1.995 25755
3182 1 13 . 1 1 13 13 VAL N N 13 124.506 124.506 121.805 2.701 25755
3183 1 13 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.832 0.004 25755
3184 1 13 . 1 1 13 13 VAL CA C 13 65.761 65.761 64.588 1.173 25755
3185 1 13 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.441 0.139 25755
3186 1 13 . 1 1 13 13 VAL H H 13 8.169 8.169 8.445 -0.276 25755
3187 1 13 . 1 1 14 14 SER N N 14 116.625 116.625 117.073 -0.448 25755
3188 1 13 . 1 1 14 14 SER HA H 14 4.206 4.206 4.421 -0.215 25755
3189 1 13 . 1 1 14 14 SER CA C 14 61.194 61.194 62.168 -0.974 25755
3190 1 13 . 1 1 14 14 SER CB C 14 62.041 62.041 62.871 -0.830 25755
3191 1 13 . 1 1 14 14 SER H H 14 8.396 8.396 8.137 0.259 25755
3192 1 13 . 1 1 15 15 LYS N N 15 120.843 120.843 121.215 -0.372 25755
3193 1 13 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.063 0.137 25755
3194 1 13 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.094 0.529 25755
3195 1 13 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.115 0.070 25755
3196 1 13 . 1 1 15 15 LYS H H 15 7.791 7.791 8.107 -0.316 25755
3197 1 13 . 1 1 16 16 CYS N N 16 115.949 115.949 117.595 -1.646 25755
3198 1 13 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.477 0.416 25755
3199 1 13 . 1 1 16 16 CYS CA C 16 56.570 56.570 61.379 -4.809 25755
3200 1 13 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.605 14.832 25755
3201 1 13 . 1 1 16 16 CYS H H 16 7.870 7.870 7.590 0.280 25755
3202 1 13 . 1 1 17 17 GLN N N 17 117.241 117.241 117.447 -0.206 25755
3203 1 13 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.067 0.207 25755
3204 1 13 . 1 1 17 17 GLN CA C 17 56.937 56.937 57.424 -0.487 25755
3205 1 13 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.625 0.562 25755
3206 1 13 . 1 1 17 17 GLN H H 17 7.560 7.560 7.590 -0.030 25755
3207 1 13 . 1 1 18 18 LEU N N 18 120.537 120.537 121.319 -0.782 25755
3208 1 13 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.126 0.314 25755
3209 1 13 . 1 1 18 18 LEU CA C 18 55.448 55.448 55.238 0.210 25755
3210 1 13 . 1 1 18 18 LEU CB C 18 41.837 41.837 40.946 0.892 25755
3211 1 13 . 1 1 18 18 LEU H H 18 7.369 7.369 7.318 0.051 25755
3212 1 13 . 1 1 19 19 ARG N N 19 121.697 121.697 121.292 0.405 25755
3213 1 13 . 1 1 19 19 ARG HA H 19 4.299 4.299 3.987 0.312 25755
3214 1 13 . 1 1 19 19 ARG CA C 19 57.836 57.836 58.681 -0.845 25755
3215 1 13 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.241 0.151 25755
3216 1 13 . 1 1 19 19 ARG H H 19 8.447 8.447 7.924 0.523 25755
3217 1 13 . 1 1 20 20 ILE N N 20 116.439 116.439 119.050 -2.611 25755
3218 1 13 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.107 0.027 25755
3219 1 13 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.187 0.310 25755
3220 1 13 . 1 1 20 20 ILE CB C 20 38.164 38.164 37.184 0.980 25755
3221 1 13 . 1 1 20 20 ILE H H 20 7.758 7.758 7.745 0.013 25755
3222 1 13 . 1 1 21 21 ALA N N 21 122.642 122.642 123.343 -0.701 25755
3223 1 13 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.478 -0.096 25755
3224 1 13 . 1 1 21 21 ALA CA C 21 52.395 52.395 50.890 1.505 25755
3225 1 13 . 1 1 21 21 ALA CB C 21 20.098 20.098 17.803 2.295 25755
3226 1 13 . 1 1 21 21 ALA H H 21 7.727 7.727 7.900 -0.173 25755
3227 1 13 . 1 1 22 22 ASN N N 22 116.616 116.616 120.767 -4.151 25755
3228 1 13 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.880 -0.089 25755
3229 1 13 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.503 0.374 25755
3230 1 13 . 1 1 22 22 ASN CB C 22 37.554 37.554 38.271 -0.717 25755
3231 1 13 . 1 1 22 22 ASN H H 22 8.307 8.307 8.307 0.000 25755
3232 1 13 . 1 1 23 23 GLN N N 23 124.357 124.357 123.617 0.740 25755
3233 1 13 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.272 -0.254 25755
3234 1 13 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.767 0.881 25755
3235 1 13 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.757 0.642 25755
3236 1 13 . 1 1 23 23 GLN H H 23 8.542 8.542 8.256 0.286 25755
3237 1 13 . 1 1 24 24 CYS N N 24 118.909 118.909 119.476 -0.567 25755
3238 1 13 . 1 1 24 24 CYS HA H 24 4.284 4.284 3.898 0.386 25755
3239 1 13 . 1 1 24 24 CYS CA C 24 58.406 58.406 62.932 -4.526 25755
3240 1 13 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.899 11.877 25755
3241 1 13 . 1 1 24 24 CYS H H 24 8.352 8.352 8.513 -0.161 25755
3242 1 13 . 1 1 25 25 ASN N N 25 118.182 118.182 118.978 -0.796 25755
3243 1 13 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.256 -0.368 25755
3244 1 13 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.590 1.082 25755
3245 1 13 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.459 2.314 25755
3246 1 13 . 1 1 25 25 ASN H H 25 7.504 7.504 8.416 -0.912 25755
3247 1 13 . 1 1 26 26 TYR N N 26 117.354 117.354 119.365 -2.011 25755
3248 1 13 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.219 -0.254 25755
3249 1 13 . 1 1 26 26 TYR CA C 26 62.162 62.162 61.304 0.858 25755
3250 1 13 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.755 -0.125 25755
3251 1 13 . 1 1 26 26 TYR H H 26 7.322 7.322 7.608 -0.286 25755
3252 1 13 . 1 1 27 27 ASP N N 27 119.874 119.874 120.185 -0.311 25755
3253 1 13 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.357 0.298 25755
3254 1 13 . 1 1 27 27 ASP CB C 27 40.590 40.590 40.875 -0.285 25755
3255 1 13 . 1 1 27 27 ASP H H 27 9.218 9.218 8.203 1.015 25755
3256 1 13 . 1 1 28 28 CYS N N 28 119.782 119.782 119.071 0.711 25755
3257 1 13 . 1 1 28 28 CYS HA H 28 4.168 4.168 3.912 0.256 25755
3258 1 13 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.709 -1.795 25755
3259 1 13 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.227 10.718 25755
3260 1 13 . 1 1 28 28 CYS H H 28 9.171 9.171 8.270 0.901 25755
3261 1 13 . 1 1 29 29 LYS N N 29 119.663 119.663 118.802 0.861 25755
3262 1 13 . 1 1 29 29 LYS HA H 29 4.137 4.137 3.920 0.217 25755
3263 1 13 . 1 1 29 29 LYS CA C 29 59.781 59.781 59.220 0.561 25755
3264 1 13 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.802 0.611 25755
3265 1 13 . 1 1 29 29 LYS H H 29 7.546 7.546 7.413 0.133 25755
3266 1 13 . 1 1 30 30 LEU N N 30 119.987 119.987 120.096 -0.109 25755
3267 1 13 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.842 0.269 25755
3268 1 13 . 1 1 30 30 LEU CA C 30 57.672 57.672 58.010 -0.338 25755
3269 1 13 . 1 1 30 30 LEU CB C 30 42.379 42.379 42.047 0.332 25755
3270 1 13 . 1 1 30 30 LEU H H 30 8.226 8.226 7.577 0.649 25755
3271 1 13 . 1 1 31 31 ASP N N 31 116.853 116.853 116.259 0.594 25755
3272 1 13 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.550 -0.004 25755
3273 1 13 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.242 1.024 25755
3274 1 13 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.502 -1.024 25755
3275 1 13 . 1 1 31 31 ASP H H 31 9.019 9.019 7.871 1.148 25755
3276 1 13 . 1 1 32 32 LYS N N 32 112.075 112.075 118.426 -6.351 25755
3277 1 13 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.135 0.414 25755
3278 1 13 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.701 -4.236 25755
3279 1 13 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.651 -0.786 25755
3280 1 13 . 1 1 32 32 LYS H H 32 6.639 6.639 8.254 -1.615 25755
3281 1 13 . 1 1 33 33 HIS N N 33 112.955 112.955 114.372 -1.417 25755
3282 1 13 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.173 0.450 25755
3283 1 13 . 1 1 33 33 HIS CA C 33 56.486 56.486 56.347 0.139 25755
3284 1 13 . 1 1 33 33 HIS CB C 33 25.694 25.694 27.697 -2.003 25755
3285 1 13 . 1 1 33 33 HIS H H 33 7.065 7.065 8.104 -1.039 25755
3286 1 13 . 1 1 34 34 ALA N N 34 120.177 120.177 119.279 0.898 25755
3287 1 13 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.730 0.419 25755
3288 1 13 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.254 -1.475 25755
3289 1 13 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.644 -0.526 25755
3290 1 13 . 1 1 34 34 ALA H H 34 7.716 7.716 7.058 0.658 25755
3291 1 13 . 1 1 35 35 ARG N N 35 116.636 116.636 116.923 -0.287 25755
3292 1 13 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.019 0.187 25755
3293 1 13 . 1 1 35 35 ARG CA C 35 58.076 58.076 59.552 -1.476 25755
3294 1 13 . 1 1 35 35 ARG CB C 35 30.717 30.717 31.083 -0.366 25755
3295 1 13 . 1 1 35 35 ARG H H 35 8.295 8.295 8.313 -0.018 25755
3296 1 13 . 1 1 36 36 SER N N 36 109.273 109.273 111.489 -2.216 25755
3297 1 13 . 1 1 36 36 SER HA H 36 4.646 4.646 4.457 0.189 25755
3298 1 13 . 1 1 36 36 SER CA C 36 57.703 57.703 58.270 -0.567 25755
3299 1 13 . 1 1 36 36 SER CB C 36 65.425 65.425 66.171 -0.746 25755
3300 1 13 . 1 1 36 36 SER H H 36 8.026 8.026 8.692 -0.666 25755
3301 1 13 . 1 1 37 37 GLY N N 37 107.305 107.305 111.646 -4.341 25755
3302 1 13 . 1 1 37 37 GLY CA C 37 47.152 47.152 45.122 2.030 25755
3303 1 13 . 1 1 37 37 GLY H H 37 8.679 8.679 8.401 0.278 25755
3304 1 13 . 1 1 38 38 GLU N N 38 119.065 119.065 122.231 -3.166 25755
3305 1 13 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.552 -0.150 25755
3306 1 13 . 1 1 38 38 GLU CA C 38 55.773 55.773 54.748 1.025 25755
3307 1 13 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.964 -2.142 25755
3308 1 13 . 1 1 38 38 GLU H H 38 8.351 8.351 8.744 -0.393 25755
3309 1 13 . 1 1 39 39 CYS N N 39 121.636 121.636 118.439 3.197 25755
3310 1 13 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.378 0.609 25755
3311 1 13 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.681 -0.953 25755
3312 1 13 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.589 16.430 25755
3313 1 13 . 1 1 39 39 CYS H H 39 8.839 8.839 8.265 0.574 25755
3314 1 13 . 1 1 40 40 PHE N N 40 121.987 121.987 120.085 1.902 25755
3315 1 13 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.820 -0.050 25755
3316 1 13 . 1 1 40 40 PHE CA C 40 56.969 56.969 56.532 0.437 25755
3317 1 13 . 1 1 40 40 PHE CB C 40 43.760 43.760 42.810 0.950 25755
3318 1 13 . 1 1 40 40 PHE H H 40 9.214 9.214 8.964 0.250 25755
3319 1 13 . 1 1 41 41 TYR N N 41 121.905 121.905 120.295 1.610 25755
3320 1 13 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.826 0.134 25755
3321 1 13 . 1 1 41 41 TYR CA C 41 58.532 58.532 58.594 -0.062 25755
3322 1 13 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.199 1.103 25755
3323 1 13 . 1 1 41 41 TYR H H 41 8.557 8.557 8.831 -0.274 25755
3324 1 13 . 1 1 42 42 ASP N N 42 123.133 123.133 121.638 1.495 25755
3325 1 13 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.859 -0.106 25755
3326 1 13 . 1 1 42 42 ASP CA C 42 52.426 52.426 52.369 0.057 25755
3327 1 13 . 1 1 42 42 ASP CB C 42 41.620 41.620 41.729 -0.109 25755
3328 1 13 . 1 1 42 42 ASP H H 42 8.603 8.603 8.587 0.016 25755
3329 1 13 . 1 1 43 43 GLU N N 43 118.012 118.012 116.548 1.464 25755
3330 1 13 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.108 0.101 25755
3331 1 13 . 1 1 43 43 GLU CA C 43 58.865 58.865 58.320 0.545 25755
3332 1 13 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.344 -0.107 25755
3333 1 13 . 1 1 43 43 GLU H H 43 9.081 9.081 8.636 0.445 25755
3334 1 13 . 1 1 44 44 LYS N N 44 120.047 120.047 118.422 1.625 25755
3335 1 13 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.400 0.044 25755
3336 1 13 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.105 0.555 25755
3337 1 13 . 1 1 44 44 LYS CB C 44 32.039 32.039 32.655 -0.616 25755
3338 1 13 . 1 1 44 44 LYS H H 44 8.162 8.162 7.994 0.168 25755
3339 1 13 . 1 1 45 45 ARG N N 45 113.453 113.453 114.773 -1.320 25755
3340 1 13 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.043 -0.380 25755
3341 1 13 . 1 1 45 45 ARG CA C 45 57.736 57.736 56.956 0.780 25755
3342 1 13 . 1 1 45 45 ARG CB C 45 26.390 26.390 26.761 -0.371 25755
3343 1 13 . 1 1 45 45 ARG H H 45 8.335 8.335 7.960 0.375 25755
3344 1 13 . 1 1 46 46 ASN N N 46 118.207 118.207 117.862 0.345 25755
3345 1 13 . 1 1 46 46 ASN HA H 46 4.982 4.982 5.033 -0.051 25755
3346 1 13 . 1 1 46 46 ASN CA C 46 53.066 53.066 51.631 1.435 25755
3347 1 13 . 1 1 46 46 ASN CB C 46 39.293 39.293 40.075 -0.783 25755
3348 1 13 . 1 1 46 46 ASN H H 46 8.745 8.745 9.090 -0.345 25755
3349 1 13 . 1 1 47 47 LEU N N 47 125.815 125.815 126.466 -0.651 25755
3350 1 13 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.021 0.258 25755
3351 1 13 . 1 1 47 47 LEU CA C 47 55.290 55.290 55.070 0.220 25755
3352 1 13 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.846 1.460 25755
3353 1 13 . 1 1 47 47 LEU H H 47 8.509 8.509 8.772 -0.263 25755
3354 1 13 . 1 1 48 48 GLN N N 48 120.834 120.834 122.458 -1.624 25755
3355 1 13 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.666 0.070 25755
3356 1 13 . 1 1 48 48 GLN CA C 48 54.105 54.105 54.385 -0.280 25755
3357 1 13 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.513 -0.647 25755
3358 1 13 . 1 1 48 48 GLN H H 48 8.589 8.589 8.996 -0.407 25755
3359 1 13 . 1 1 49 49 CYS N N 49 121.829 121.829 123.075 -1.246 25755
3360 1 13 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.572 0.286 25755
3361 1 13 . 1 1 49 49 CYS CA C 49 54.955 54.955 59.143 -4.188 25755
3362 1 13 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.721 12.724 25755
3363 1 13 . 1 1 49 49 CYS H H 49 9.247 9.247 9.021 0.226 25755
3364 1 13 . 1 1 50 50 ILE N N 50 129.010 129.010 130.194 -1.184 25755
3365 1 13 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.536 -0.150 25755
3366 1 13 . 1 1 50 50 ILE CA C 50 60.421 60.421 61.518 -1.097 25755
3367 1 13 . 1 1 50 50 ILE CB C 50 38.404 38.404 39.179 -0.776 25755
3368 1 13 . 1 1 50 50 ILE H H 50 8.787 8.787 8.455 0.332 25755
3369 1 13 . 1 1 51 51 CYS N N 51 126.108 126.108 127.405 -1.297 25755
3370 1 13 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.638 0.699 25755
3371 1 13 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.148 -6.330 25755
3372 1 13 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.246 6.736 25755
3373 1 13 . 1 1 51 51 CYS H H 51 8.556 8.556 9.283 -0.727 25755
3374 1 13 . 1 1 52 52 ASP N N 52 122.342 122.342 118.982 3.360 25755
3375 1 13 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.820 0.693 25755
3376 1 13 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.094 -0.511 25755
3377 1 13 . 1 1 52 52 ASP CB C 52 42.831 42.831 41.250 1.581 25755
3378 1 13 . 1 1 52 52 ASP H H 52 8.826 8.826 8.560 0.266 25755
3379 1 13 . 1 1 53 53 TYR N N 53 125.370 125.370 122.105 3.265 25755
3380 1 13 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.698 -0.440 25755
3381 1 13 . 1 1 53 53 TYR CA C 53 59.665 59.665 59.080 0.585 25755
3382 1 13 . 1 1 53 53 TYR CB C 53 38.783 38.783 39.559 -0.776 25755
3383 1 13 . 1 1 53 53 TYR H H 53 9.734 9.734 8.526 1.208 25755
3384 1 13 . 1 1 54 54 CYS N N 54 120.418 120.418 120.764 -0.346 25755
3385 1 13 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.421 0.073 25755
3386 1 13 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.795 -4.652 25755
3387 1 13 . 1 1 54 54 CYS CB C 54 44.382 44.382 28.855 15.527 25755
3388 1 13 . 1 1 54 54 CYS H H 54 9.478 9.478 8.915 0.563 25755
3389 1 13 . 1 1 55 55 GLU N N 55 121.097 121.097 118.771 2.326 25755
3390 1 13 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.042 0.270 25755
3391 1 13 . 1 1 55 55 GLU CA C 55 56.010 56.010 57.270 -1.260 25755
3392 1 13 . 1 1 55 55 GLU CB C 55 31.014 31.014 29.857 1.157 25755
3393 1 13 . 1 1 55 55 GLU H H 55 8.423 8.423 8.148 0.275 25755
3394 1 14 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.635 -0.384 25755
3395 1 14 . 1 1 2 2 ASP CA C 2 59.484 59.484 54.542 4.942 25755
3396 1 14 . 1 1 2 2 ASP CB C 2 39.412 39.412 40.405 -0.993 25755
3397 1 14 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.308 0.037 25755
3398 1 14 . 1 1 3 3 LYS CA C 3 57.556 57.556 56.709 0.847 25755
3399 1 14 . 1 1 3 3 LYS CB C 3 32.593 32.593 32.437 0.156 25755
3400 1 14 . 1 1 4 4 CYS N N 4 117.049 117.049 117.675 -0.626 25755
3401 1 14 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.923 -0.195 25755
3402 1 14 . 1 1 4 4 CYS CA C 4 57.415 57.415 56.819 0.596 25755
3403 1 14 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.571 12.272 25755
3404 1 14 . 1 1 4 4 CYS H H 4 8.486 8.486 7.996 0.490 25755
3405 1 14 . 1 1 5 5 LYS N N 5 118.790 118.790 121.136 -2.346 25755
3406 1 14 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.822 0.749 25755
3407 1 14 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.706 -0.416 25755
3408 1 14 . 1 1 5 5 LYS CB C 5 34.606 34.606 35.004 -0.398 25755
3409 1 14 . 1 1 5 5 LYS H H 5 8.007 8.007 8.191 -0.184 25755
3410 1 14 . 1 1 6 6 LYS N N 6 121.177 121.177 120.410 0.767 25755
3411 1 14 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.521 0.264 25755
3412 1 14 . 1 1 6 6 LYS CA C 6 55.542 55.542 56.059 -0.517 25755
3413 1 14 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.710 1.192 25755
3414 1 14 . 1 1 6 6 LYS H H 6 9.014 9.014 8.720 0.294 25755
3415 1 14 . 1 1 7 7 VAL N N 7 127.629 127.629 125.338 2.291 25755
3416 1 14 . 1 1 7 7 VAL HA H 7 4.026 4.026 4.253 -0.227 25755
3417 1 14 . 1 1 7 7 VAL CA C 7 63.988 63.988 61.487 2.501 25755
3418 1 14 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.583 0.524 25755
3419 1 14 . 1 1 7 7 VAL H H 7 8.837 8.837 8.583 0.254 25755
3420 1 14 . 1 1 8 8 TYR N N 8 130.003 130.003 130.209 -0.206 25755
3421 1 14 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.753 -0.294 25755
3422 1 14 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.591 0.129 25755
3423 1 14 . 1 1 8 8 TYR CB C 8 36.018 36.018 38.181 -2.163 25755
3424 1 14 . 1 1 8 8 TYR H H 8 9.251 9.251 8.558 0.693 25755
3425 1 14 . 1 1 9 9 GLU N N 9 130.851 130.851 125.193 5.658 25755
3426 1 14 . 1 1 9 9 GLU HA H 9 4.204 4.204 3.990 0.214 25755
3427 1 14 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.943 -0.426 25755
3428 1 14 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.427 -0.036 25755
3429 1 14 . 1 1 9 9 GLU H H 9 9.072 9.072 8.405 0.666 25755
3430 1 14 . 1 1 10 10 ASN N N 10 116.120 116.120 116.969 -0.849 25755
3431 1 14 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.578 -0.140 25755
3432 1 14 . 1 1 10 10 ASN CA C 10 54.587 54.587 52.982 1.605 25755
3433 1 14 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.169 0.109 25755
3434 1 14 . 1 1 10 10 ASN H H 10 9.301 9.301 7.643 1.658 25755
3435 1 14 . 1 1 11 11 TYR N N 11 122.436 122.436 120.887 1.549 25755
3436 1 14 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.669 -0.475 25755
3437 1 14 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.509 2.103 25755
3438 1 14 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.970 -2.503 25755
3439 1 14 . 1 1 11 11 TYR H H 11 7.550 7.550 7.586 -0.036 25755
3440 1 14 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.577 -0.130 25755
3441 1 14 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.613 -0.115 25755
3442 1 14 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.906 -2.315 25755
3443 1 14 . 1 1 13 13 VAL N N 13 124.506 124.506 120.974 3.532 25755
3444 1 14 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.872 -0.036 25755
3445 1 14 . 1 1 13 13 VAL CA C 13 65.761 65.761 64.518 1.243 25755
3446 1 14 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.758 -0.178 25755
3447 1 14 . 1 1 13 13 VAL H H 13 8.169 8.169 8.357 -0.188 25755
3448 1 14 . 1 1 14 14 SER N N 14 116.625 116.625 116.419 0.206 25755
3449 1 14 . 1 1 14 14 SER HA H 14 4.206 4.206 4.209 -0.003 25755
3450 1 14 . 1 1 14 14 SER CA C 14 61.194 61.194 61.557 -0.363 25755
3451 1 14 . 1 1 14 14 SER CB C 14 62.041 62.041 62.649 -0.608 25755
3452 1 14 . 1 1 14 14 SER H H 14 8.396 8.396 8.185 0.211 25755
3453 1 14 . 1 1 15 15 LYS N N 15 120.843 120.843 122.208 -1.365 25755
3454 1 14 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.043 0.157 25755
3455 1 14 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.133 0.490 25755
3456 1 14 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.127 0.059 25755
3457 1 14 . 1 1 15 15 LYS H H 15 7.791 7.791 7.959 -0.168 25755
3458 1 14 . 1 1 16 16 CYS N N 16 115.949 115.949 115.035 0.914 25755
3459 1 14 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.411 0.482 25755
3460 1 14 . 1 1 16 16 CYS CA C 16 56.570 56.570 60.351 -3.781 25755
3461 1 14 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.350 15.087 25755
3462 1 14 . 1 1 16 16 CYS H H 16 7.870 7.870 7.575 0.295 25755
3463 1 14 . 1 1 17 17 GLN N N 17 117.241 117.241 116.997 0.244 25755
3464 1 14 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.284 -0.010 25755
3465 1 14 . 1 1 17 17 GLN CA C 17 56.937 56.937 55.889 1.048 25755
3466 1 14 . 1 1 17 17 GLN CB C 17 29.187 29.187 29.201 -0.014 25755
3467 1 14 . 1 1 17 17 GLN H H 17 7.560 7.560 7.669 -0.109 25755
3468 1 14 . 1 1 18 18 LEU N N 18 120.537 120.537 122.614 -2.077 25755
3469 1 14 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.127 0.313 25755
3470 1 14 . 1 1 18 18 LEU CA C 18 55.448 55.448 55.539 -0.091 25755
3471 1 14 . 1 1 18 18 LEU CB C 18 41.837 41.837 41.069 0.768 25755
3472 1 14 . 1 1 18 18 LEU H H 18 7.369 7.369 7.384 -0.015 25755
3473 1 14 . 1 1 19 19 ARG N N 19 121.697 121.697 122.373 -0.676 25755
3474 1 14 . 1 1 19 19 ARG HA H 19 4.299 4.299 4.040 0.259 25755
3475 1 14 . 1 1 19 19 ARG CA C 19 57.836 57.836 58.083 -0.247 25755
3476 1 14 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.109 0.283 25755
3477 1 14 . 1 1 19 19 ARG H H 19 8.447 8.447 8.011 0.436 25755
3478 1 14 . 1 1 20 20 ILE N N 20 116.439 116.439 117.162 -0.723 25755
3479 1 14 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.042 0.092 25755
3480 1 14 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.463 0.034 25755
3481 1 14 . 1 1 20 20 ILE CB C 20 38.164 38.164 38.145 0.019 25755
3482 1 14 . 1 1 20 20 ILE H H 20 7.758 7.758 7.780 -0.022 25755
3483 1 14 . 1 1 21 21 ALA N N 21 122.642 122.642 123.069 -0.427 25755
3484 1 14 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.523 -0.141 25755
3485 1 14 . 1 1 21 21 ALA CA C 21 52.395 52.395 51.437 0.959 25755
3486 1 14 . 1 1 21 21 ALA CB C 21 20.098 20.098 19.542 0.556 25755
3487 1 14 . 1 1 21 21 ALA H H 21 7.727 7.727 7.230 0.497 25755
3488 1 14 . 1 1 22 22 ASN N N 22 116.616 116.616 121.642 -5.026 25755
3489 1 14 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.682 0.109 25755
3490 1 14 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.786 0.091 25755
3491 1 14 . 1 1 22 22 ASN CB C 22 37.554 37.554 37.964 -0.410 25755
3492 1 14 . 1 1 22 22 ASN H H 22 8.307 8.307 8.575 -0.268 25755
3493 1 14 . 1 1 23 23 GLN N N 23 124.357 124.357 123.151 1.206 25755
3494 1 14 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.305 -0.287 25755
3495 1 14 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.848 0.800 25755
3496 1 14 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.694 0.705 25755
3497 1 14 . 1 1 23 23 GLN H H 23 8.542 8.542 8.160 0.382 25755
3498 1 14 . 1 1 24 24 CYS N N 24 118.909 118.909 119.215 -0.306 25755
3499 1 14 . 1 1 24 24 CYS HA H 24 4.284 4.284 4.094 0.190 25755
3500 1 14 . 1 1 24 24 CYS CA C 24 58.406 58.406 63.337 -4.931 25755
3501 1 14 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.673 12.103 25755
3502 1 14 . 1 1 24 24 CYS H H 24 8.352 8.352 8.660 -0.308 25755
3503 1 14 . 1 1 25 25 ASN N N 25 118.182 118.182 117.425 0.757 25755
3504 1 14 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.427 -0.539 25755
3505 1 14 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.834 0.838 25755
3506 1 14 . 1 1 25 25 ASN CB C 25 39.773 39.773 38.455 1.318 25755
3507 1 14 . 1 1 25 25 ASN H H 25 7.504 7.504 8.381 -0.877 25755
3508 1 14 . 1 1 26 26 TYR N N 26 117.354 117.354 118.968 -1.614 25755
3509 1 14 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.167 -0.202 25755
3510 1 14 . 1 1 26 26 TYR CA C 26 62.162 62.162 61.844 0.318 25755
3511 1 14 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.962 -0.332 25755
3512 1 14 . 1 1 26 26 TYR H H 26 7.322 7.322 7.544 -0.222 25755
3513 1 14 . 1 1 27 27 ASP N N 27 119.874 119.874 120.278 -0.404 25755
3514 1 14 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.271 0.384 25755
3515 1 14 . 1 1 27 27 ASP CB C 27 40.590 40.590 40.904 -0.314 25755
3516 1 14 . 1 1 27 27 ASP H H 27 9.218 9.218 8.495 0.723 25755
3517 1 14 . 1 1 28 28 CYS N N 28 119.782 119.782 118.731 1.051 25755
3518 1 14 . 1 1 28 28 CYS HA H 28 4.168 4.168 3.937 0.231 25755
3519 1 14 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.567 -1.653 25755
3520 1 14 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.398 10.547 25755
3521 1 14 . 1 1 28 28 CYS H H 28 9.171 9.171 8.284 0.887 25755
3522 1 14 . 1 1 29 29 LYS N N 29 119.663 119.663 118.765 0.898 25755
3523 1 14 . 1 1 29 29 LYS HA H 29 4.137 4.137 3.940 0.197 25755
3524 1 14 . 1 1 29 29 LYS CA C 29 59.781 59.781 58.787 0.994 25755
3525 1 14 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.887 0.526 25755
3526 1 14 . 1 1 29 29 LYS H H 29 7.546 7.546 7.386 0.160 25755
3527 1 14 . 1 1 30 30 LEU N N 30 119.987 119.987 121.266 -1.279 25755
3528 1 14 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.794 0.317 25755
3529 1 14 . 1 1 30 30 LEU CA C 30 57.672 57.672 57.777 -0.105 25755
3530 1 14 . 1 1 30 30 LEU CB C 30 42.379 42.379 42.231 0.148 25755
3531 1 14 . 1 1 30 30 LEU H H 30 8.226 8.226 8.041 0.185 25755
3532 1 14 . 1 1 31 31 ASP N N 31 116.853 116.853 115.189 1.664 25755
3533 1 14 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.528 0.018 25755
3534 1 14 . 1 1 31 31 ASP CA C 31 56.266 56.266 56.054 0.212 25755
3535 1 14 . 1 1 31 31 ASP CB C 31 40.478 40.478 42.275 -1.797 25755
3536 1 14 . 1 1 31 31 ASP H H 31 9.019 9.019 7.810 1.209 25755
3537 1 14 . 1 1 32 32 LYS N N 32 112.075 112.075 117.394 -5.319 25755
3538 1 14 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.112 0.437 25755
3539 1 14 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.699 -4.234 25755
3540 1 14 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.739 -0.874 25755
3541 1 14 . 1 1 32 32 LYS H H 32 6.639 6.639 8.199 -1.560 25755
3542 1 14 . 1 1 33 33 HIS N N 33 112.955 112.955 114.601 -1.646 25755
3543 1 14 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.127 0.496 25755
3544 1 14 . 1 1 33 33 HIS CA C 33 56.486 56.486 55.495 0.991 25755
3545 1 14 . 1 1 33 33 HIS CB C 33 25.694 25.694 28.376 -2.682 25755
3546 1 14 . 1 1 33 33 HIS H H 33 7.065 7.065 8.002 -0.937 25755
3547 1 14 . 1 1 34 34 ALA N N 34 120.177 120.177 119.100 1.077 25755
3548 1 14 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.725 0.424 25755
3549 1 14 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.382 -1.603 25755
3550 1 14 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.587 -0.469 25755
3551 1 14 . 1 1 34 34 ALA H H 34 7.716 7.716 7.004 0.712 25755
3552 1 14 . 1 1 35 35 ARG N N 35 116.636 116.636 117.236 -0.600 25755
3553 1 14 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.014 0.192 25755
3554 1 14 . 1 1 35 35 ARG CA C 35 58.076 58.076 59.533 -1.457 25755
3555 1 14 . 1 1 35 35 ARG CB C 35 30.717 30.717 30.747 -0.031 25755
3556 1 14 . 1 1 35 35 ARG H H 35 8.295 8.295 7.991 0.304 25755
3557 1 14 . 1 1 36 36 SER N N 36 109.273 109.273 111.075 -1.802 25755
3558 1 14 . 1 1 36 36 SER HA H 36 4.646 4.646 4.409 0.237 25755
3559 1 14 . 1 1 36 36 SER CA C 36 57.703 57.703 58.117 -0.414 25755
3560 1 14 . 1 1 36 36 SER CB C 36 65.425 65.425 65.084 0.341 25755
3561 1 14 . 1 1 36 36 SER H H 36 8.026 8.026 7.977 0.049 25755
3562 1 14 . 1 1 37 37 GLY N N 37 107.305 107.305 110.165 -2.860 25755
3563 1 14 . 1 1 37 37 GLY CA C 37 47.152 47.152 44.855 2.297 25755
3564 1 14 . 1 1 37 37 GLY H H 37 8.679 8.679 7.845 0.834 25755
3565 1 14 . 1 1 38 38 GLU N N 38 119.065 119.065 122.354 -3.289 25755
3566 1 14 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.547 -0.145 25755
3567 1 14 . 1 1 38 38 GLU CA C 38 55.773 55.773 54.638 1.135 25755
3568 1 14 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.910 -2.088 25755
3569 1 14 . 1 1 38 38 GLU H H 38 8.351 8.351 8.802 -0.451 25755
3570 1 14 . 1 1 39 39 CYS N N 39 121.636 121.636 118.372 3.264 25755
3571 1 14 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.430 0.557 25755
3572 1 14 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.784 -1.056 25755
3573 1 14 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.752 16.267 25755
3574 1 14 . 1 1 39 39 CYS H H 39 8.839 8.839 8.300 0.539 25755
3575 1 14 . 1 1 40 40 PHE N N 40 121.987 121.987 120.293 1.694 25755
3576 1 14 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.814 -0.044 25755
3577 1 14 . 1 1 40 40 PHE CA C 40 56.969 56.969 56.529 0.440 25755
3578 1 14 . 1 1 40 40 PHE CB C 40 43.760 43.760 42.895 0.865 25755
3579 1 14 . 1 1 40 40 PHE H H 40 9.214 9.214 8.970 0.244 25755
3580 1 14 . 1 1 41 41 TYR N N 41 121.905 121.905 119.680 2.225 25755
3581 1 14 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.599 0.361 25755
3582 1 14 . 1 1 41 41 TYR CA C 41 58.532 58.532 59.437 -0.905 25755
3583 1 14 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.024 1.278 25755
3584 1 14 . 1 1 41 41 TYR H H 41 8.557 8.557 8.672 -0.115 25755
3585 1 14 . 1 1 42 42 ASP N N 42 123.133 123.133 120.553 2.580 25755
3586 1 14 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.808 -0.055 25755
3587 1 14 . 1 1 42 42 ASP CA C 42 52.426 52.426 53.139 -0.713 25755
3588 1 14 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.815 -1.195 25755
3589 1 14 . 1 1 42 42 ASP H H 42 8.603 8.603 8.251 0.352 25755
3590 1 14 . 1 1 43 43 GLU N N 43 118.012 118.012 119.313 -1.301 25755
3591 1 14 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.126 0.083 25755
3592 1 14 . 1 1 43 43 GLU CA C 43 58.865 58.865 58.773 0.092 25755
3593 1 14 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.572 -0.335 25755
3594 1 14 . 1 1 43 43 GLU H H 43 9.081 9.081 8.723 0.358 25755
3595 1 14 . 1 1 44 44 LYS N N 44 120.047 120.047 117.424 2.623 25755
3596 1 14 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.396 0.048 25755
3597 1 14 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.323 0.338 25755
3598 1 14 . 1 1 44 44 LYS CB C 44 32.039 32.039 32.631 -0.592 25755
3599 1 14 . 1 1 44 44 LYS H H 44 8.162 8.162 7.778 0.384 25755
3600 1 14 . 1 1 45 45 ARG N N 45 113.453 113.453 116.414 -2.961 25755
3601 1 14 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.142 -0.479 25755
3602 1 14 . 1 1 45 45 ARG CA C 45 57.736 57.736 56.793 0.943 25755
3603 1 14 . 1 1 45 45 ARG CB C 45 26.390 26.390 27.500 -1.111 25755
3604 1 14 . 1 1 45 45 ARG H H 45 8.335 8.335 7.806 0.529 25755
3605 1 14 . 1 1 46 46 ASN N N 46 118.207 118.207 116.402 1.805 25755
3606 1 14 . 1 1 46 46 ASN HA H 46 4.982 4.982 4.944 0.038 25755
3607 1 14 . 1 1 46 46 ASN CA C 46 53.066 53.066 51.909 1.157 25755
3608 1 14 . 1 1 46 46 ASN CB C 46 39.293 39.293 39.067 0.226 25755
3609 1 14 . 1 1 46 46 ASN H H 46 8.745 8.745 8.274 0.471 25755
3610 1 14 . 1 1 47 47 LEU N N 47 125.815 125.815 126.719 -0.904 25755
3611 1 14 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.024 0.255 25755
3612 1 14 . 1 1 47 47 LEU CA C 47 55.290 55.290 55.225 0.065 25755
3613 1 14 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.135 2.171 25755
3614 1 14 . 1 1 47 47 LEU H H 47 8.509 8.509 8.751 -0.242 25755
3615 1 14 . 1 1 48 48 GLN N N 48 120.834 120.834 122.854 -2.020 25755
3616 1 14 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.632 0.104 25755
3617 1 14 . 1 1 48 48 GLN CA C 48 54.105 54.105 54.675 -0.570 25755
3618 1 14 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.186 -0.320 25755
3619 1 14 . 1 1 48 48 GLN H H 48 8.589 8.589 8.990 -0.401 25755
3620 1 14 . 1 1 49 49 CYS N N 49 121.829 121.829 121.870 -0.041 25755
3621 1 14 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.575 0.283 25755
3622 1 14 . 1 1 49 49 CYS CA C 49 54.955 54.955 59.047 -4.092 25755
3623 1 14 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.724 12.721 25755
3624 1 14 . 1 1 49 49 CYS H H 49 9.247 9.247 9.022 0.225 25755
3625 1 14 . 1 1 50 50 ILE N N 50 129.010 129.010 129.152 -0.142 25755
3626 1 14 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.456 -0.070 25755
3627 1 14 . 1 1 50 50 ILE CA C 50 60.421 60.421 61.730 -1.309 25755
3628 1 14 . 1 1 50 50 ILE CB C 50 38.404 38.404 38.977 -0.573 25755
3629 1 14 . 1 1 50 50 ILE H H 50 8.787 8.787 8.470 0.317 25755
3630 1 14 . 1 1 51 51 CYS N N 51 126.108 126.108 127.284 -1.176 25755
3631 1 14 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.702 0.635 25755
3632 1 14 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.384 -6.566 25755
3633 1 14 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.805 6.178 25755
3634 1 14 . 1 1 51 51 CYS H H 51 8.556 8.556 9.316 -0.760 25755
3635 1 14 . 1 1 52 52 ASP N N 52 122.342 122.342 120.351 1.991 25755
3636 1 14 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.856 0.657 25755
3637 1 14 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.807 -1.224 25755
3638 1 14 . 1 1 52 52 ASP CB C 52 42.831 42.831 43.205 -0.374 25755
3639 1 14 . 1 1 52 52 ASP H H 52 8.826 8.826 8.441 0.385 25755
3640 1 14 . 1 1 53 53 TYR N N 53 125.370 125.370 122.993 2.377 25755
3641 1 14 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.571 -0.313 25755
3642 1 14 . 1 1 53 53 TYR CA C 53 59.665 59.665 58.889 0.776 25755
3643 1 14 . 1 1 53 53 TYR CB C 53 38.783 38.783 39.244 -0.461 25755
3644 1 14 . 1 1 53 53 TYR H H 53 9.734 9.734 8.707 1.027 25755
3645 1 14 . 1 1 54 54 CYS N N 54 120.418 120.418 121.362 -0.944 25755
3646 1 14 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.470 0.024 25755
3647 1 14 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.627 -4.484 25755
3648 1 14 . 1 1 54 54 CYS CB C 54 44.382 44.382 28.967 15.415 25755
3649 1 14 . 1 1 54 54 CYS H H 54 9.478 9.478 8.849 0.629 25755
3650 1 14 . 1 1 55 55 GLU N N 55 121.097 121.097 118.956 2.141 25755
3651 1 14 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.693 -0.381 25755
3652 1 14 . 1 1 55 55 GLU CA C 55 56.010 56.010 56.057 -0.047 25755
3653 1 14 . 1 1 55 55 GLU CB C 55 31.014 31.014 32.499 -1.485 25755
3654 1 14 . 1 1 55 55 GLU H H 55 8.423 8.423 7.996 0.427 25755
3655 1 15 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.347 -0.096 25755
3656 1 15 . 1 1 2 2 ASP CA C 2 59.484 59.484 55.180 4.304 25755
3657 1 15 . 1 1 2 2 ASP CB C 2 39.412 39.412 39.932 -0.520 25755
3658 1 15 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.329 0.016 25755
3659 1 15 . 1 1 3 3 LYS CA C 3 57.556 57.556 56.542 1.014 25755
3660 1 15 . 1 1 3 3 LYS CB C 3 32.593 32.593 32.343 0.250 25755
3661 1 15 . 1 1 4 4 CYS N N 4 117.049 117.049 117.934 -0.885 25755
3662 1 15 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.909 -0.181 25755
3663 1 15 . 1 1 4 4 CYS CA C 4 57.415 57.415 57.222 0.193 25755
3664 1 15 . 1 1 4 4 CYS CB C 4 41.843 41.843 28.819 13.024 25755
3665 1 15 . 1 1 4 4 CYS H H 4 8.486 8.486 7.695 0.791 25755
3666 1 15 . 1 1 5 5 LYS N N 5 118.790 118.790 121.415 -2.625 25755
3667 1 15 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.860 0.711 25755
3668 1 15 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.815 -0.525 25755
3669 1 15 . 1 1 5 5 LYS CB C 5 34.606 34.606 34.814 -0.208 25755
3670 1 15 . 1 1 5 5 LYS H H 5 8.007 8.007 8.223 -0.216 25755
3671 1 15 . 1 1 6 6 LYS N N 6 121.177 121.177 120.618 0.559 25755
3672 1 15 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.633 0.152 25755
3673 1 15 . 1 1 6 6 LYS CA C 6 55.542 55.542 56.298 -0.756 25755
3674 1 15 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.756 1.146 25755
3675 1 15 . 1 1 6 6 LYS H H 6 9.014 9.014 8.833 0.181 25755
3676 1 15 . 1 1 7 7 VAL N N 7 127.629 127.629 125.158 2.471 25755
3677 1 15 . 1 1 7 7 VAL HA H 7 4.026 4.026 4.028 -0.002 25755
3678 1 15 . 1 1 7 7 VAL CA C 7 63.988 63.988 63.223 0.765 25755
3679 1 15 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.564 0.543 25755
3680 1 15 . 1 1 7 7 VAL H H 7 8.837 8.837 8.622 0.215 25755
3681 1 15 . 1 1 8 8 TYR N N 8 130.003 130.003 129.109 0.894 25755
3682 1 15 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.714 -0.255 25755
3683 1 15 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.509 0.211 25755
3684 1 15 . 1 1 8 8 TYR CB C 8 36.018 36.018 38.018 -2.000 25755
3685 1 15 . 1 1 8 8 TYR H H 8 9.251 9.251 8.267 0.984 25755
3686 1 15 . 1 1 9 9 GLU N N 9 130.851 130.851 124.506 6.345 25755
3687 1 15 . 1 1 9 9 GLU HA H 9 4.204 4.204 4.075 0.129 25755
3688 1 15 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.502 0.015 25755
3689 1 15 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.499 -0.108 25755
3690 1 15 . 1 1 9 9 GLU H H 9 9.072 9.072 8.458 0.614 25755
3691 1 15 . 1 1 10 10 ASN N N 10 116.120 116.120 117.499 -1.379 25755
3692 1 15 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.582 -0.144 25755
3693 1 15 . 1 1 10 10 ASN CA C 10 54.587 54.587 52.689 1.898 25755
3694 1 15 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.393 -0.115 25755
3695 1 15 . 1 1 10 10 ASN H H 10 9.301 9.301 7.654 1.647 25755
3696 1 15 . 1 1 11 11 TYR N N 11 122.436 122.436 119.431 3.005 25755
3697 1 15 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.610 -0.416 25755
3698 1 15 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.380 2.232 25755
3699 1 15 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.821 -2.354 25755
3700 1 15 . 1 1 11 11 TYR H H 11 7.550 7.550 7.344 0.206 25755
3701 1 15 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.553 -0.106 25755
3702 1 15 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.647 -0.149 25755
3703 1 15 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.725 -2.135 25755
3704 1 15 . 1 1 13 13 VAL N N 13 124.506 124.506 122.357 2.149 25755
3705 1 15 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.844 -0.008 25755
3706 1 15 . 1 1 13 13 VAL CA C 13 65.761 65.761 65.011 0.750 25755
3707 1 15 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.630 -0.050 25755
3708 1 15 . 1 1 13 13 VAL H H 13 8.169 8.169 8.401 -0.232 25755
3709 1 15 . 1 1 14 14 SER N N 14 116.625 116.625 116.696 -0.071 25755
3710 1 15 . 1 1 14 14 SER HA H 14 4.206 4.206 4.388 -0.182 25755
3711 1 15 . 1 1 14 14 SER CA C 14 61.194 61.194 62.128 -0.934 25755
3712 1 15 . 1 1 14 14 SER CB C 14 62.041 62.041 62.663 -0.623 25755
3713 1 15 . 1 1 14 14 SER H H 14 8.396 8.396 8.276 0.120 25755
3714 1 15 . 1 1 15 15 LYS N N 15 120.843 120.843 121.929 -1.086 25755
3715 1 15 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.033 0.167 25755
3716 1 15 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.145 0.478 25755
3717 1 15 . 1 1 15 15 LYS CB C 15 32.186 32.186 31.970 0.216 25755
3718 1 15 . 1 1 15 15 LYS H H 15 7.791 7.791 7.667 0.124 25755
3719 1 15 . 1 1 16 16 CYS N N 16 115.949 115.949 117.552 -1.603 25755
3720 1 15 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.510 0.383 25755
3721 1 15 . 1 1 16 16 CYS CA C 16 56.570 56.570 61.155 -4.585 25755
3722 1 15 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.746 14.691 25755
3723 1 15 . 1 1 16 16 CYS H H 16 7.870 7.870 7.539 0.331 25755
3724 1 15 . 1 1 17 17 GLN N N 17 117.241 117.241 117.343 -0.102 25755
3725 1 15 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.081 0.193 25755
3726 1 15 . 1 1 17 17 GLN CA C 17 56.937 56.937 57.215 -0.279 25755
3727 1 15 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.639 0.548 25755
3728 1 15 . 1 1 17 17 GLN H H 17 7.560 7.560 7.654 -0.094 25755
3729 1 15 . 1 1 18 18 LEU N N 18 120.537 120.537 121.282 -0.745 25755
3730 1 15 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.132 0.308 25755
3731 1 15 . 1 1 18 18 LEU CA C 18 55.448 55.448 55.355 0.093 25755
3732 1 15 . 1 1 18 18 LEU CB C 18 41.837 41.837 41.043 0.794 25755
3733 1 15 . 1 1 18 18 LEU H H 18 7.369 7.369 7.364 0.005 25755
3734 1 15 . 1 1 19 19 ARG N N 19 121.697 121.697 122.674 -0.977 25755
3735 1 15 . 1 1 19 19 ARG HA H 19 4.299 4.299 4.053 0.246 25755
3736 1 15 . 1 1 19 19 ARG CA C 19 57.836 57.836 58.486 -0.650 25755
3737 1 15 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.235 0.157 25755
3738 1 15 . 1 1 19 19 ARG H H 19 8.447 8.447 8.008 0.439 25755
3739 1 15 . 1 1 20 20 ILE N N 20 116.439 116.439 116.609 -0.170 25755
3740 1 15 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.045 0.089 25755
3741 1 15 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.392 0.106 25755
3742 1 15 . 1 1 20 20 ILE CB C 20 38.164 38.164 38.185 -0.021 25755
3743 1 15 . 1 1 20 20 ILE H H 20 7.758 7.758 7.750 0.008 25755
3744 1 15 . 1 1 21 21 ALA N N 21 122.642 122.642 122.966 -0.324 25755
3745 1 15 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.526 -0.144 25755
3746 1 15 . 1 1 21 21 ALA CA C 21 52.395 52.395 51.578 0.817 25755
3747 1 15 . 1 1 21 21 ALA CB C 21 20.098 20.098 19.677 0.421 25755
3748 1 15 . 1 1 21 21 ALA H H 21 7.727 7.727 7.223 0.504 25755
3749 1 15 . 1 1 22 22 ASN N N 22 116.616 116.616 121.809 -5.193 25755
3750 1 15 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.933 -0.142 25755
3751 1 15 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.237 0.640 25755
3752 1 15 . 1 1 22 22 ASN CB C 22 37.554 37.554 38.062 -0.508 25755
3753 1 15 . 1 1 22 22 ASN H H 22 8.307 8.307 8.492 -0.185 25755
3754 1 15 . 1 1 23 23 GLN N N 23 124.357 124.357 123.739 0.618 25755
3755 1 15 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.266 -0.248 25755
3756 1 15 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.671 0.977 25755
3757 1 15 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.787 0.612 25755
3758 1 15 . 1 1 23 23 GLN H H 23 8.542 8.542 8.337 0.205 25755
3759 1 15 . 1 1 24 24 CYS N N 24 118.909 118.909 119.019 -0.110 25755
3760 1 15 . 1 1 24 24 CYS HA H 24 4.284 4.284 4.010 0.274 25755
3761 1 15 . 1 1 24 24 CYS CA C 24 58.406 58.406 62.859 -4.453 25755
3762 1 15 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.991 11.785 25755
3763 1 15 . 1 1 24 24 CYS H H 24 8.352 8.352 8.492 -0.140 25755
3764 1 15 . 1 1 25 25 ASN N N 25 118.182 118.182 119.287 -1.105 25755
3765 1 15 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.256 -0.368 25755
3766 1 15 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.477 1.195 25755
3767 1 15 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.285 2.488 25755
3768 1 15 . 1 1 25 25 ASN H H 25 7.504 7.504 8.439 -0.935 25755
3769 1 15 . 1 1 26 26 TYR N N 26 117.354 117.354 119.270 -1.916 25755
3770 1 15 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.173 -0.208 25755
3771 1 15 . 1 1 26 26 TYR CA C 26 62.162 62.162 61.624 0.537 25755
3772 1 15 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.770 -0.140 25755
3773 1 15 . 1 1 26 26 TYR H H 26 7.322 7.322 7.600 -0.278 25755
3774 1 15 . 1 1 27 27 ASP N N 27 119.874 119.874 120.150 -0.276 25755
3775 1 15 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.320 0.335 25755
3776 1 15 . 1 1 27 27 ASP CB C 27 40.590 40.590 40.719 -0.130 25755
3777 1 15 . 1 1 27 27 ASP H H 27 9.218 9.218 8.140 1.078 25755
3778 1 15 . 1 1 28 28 CYS N N 28 119.782 119.782 119.009 0.773 25755
3779 1 15 . 1 1 28 28 CYS HA H 28 4.168 4.168 3.870 0.298 25755
3780 1 15 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.663 -1.749 25755
3781 1 15 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.204 10.741 25755
3782 1 15 . 1 1 28 28 CYS H H 28 9.171 9.171 8.264 0.907 25755
3783 1 15 . 1 1 29 29 LYS N N 29 119.663 119.663 118.944 0.719 25755
3784 1 15 . 1 1 29 29 LYS HA H 29 4.137 4.137 3.841 0.296 25755
3785 1 15 . 1 1 29 29 LYS CA C 29 59.781 59.781 58.958 0.823 25755
3786 1 15 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.710 0.703 25755
3787 1 15 . 1 1 29 29 LYS H H 29 7.546 7.546 7.414 0.132 25755
3788 1 15 . 1 1 30 30 LEU N N 30 119.987 119.987 120.349 -0.362 25755
3789 1 15 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.785 0.326 25755
3790 1 15 . 1 1 30 30 LEU CA C 30 57.672 57.672 57.992 -0.320 25755
3791 1 15 . 1 1 30 30 LEU CB C 30 42.379 42.379 42.145 0.234 25755
3792 1 15 . 1 1 30 30 LEU H H 30 8.226 8.226 7.521 0.705 25755
3793 1 15 . 1 1 31 31 ASP N N 31 116.853 116.853 116.683 0.170 25755
3794 1 15 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.634 -0.088 25755
3795 1 15 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.726 0.540 25755
3796 1 15 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.542 -1.064 25755
3797 1 15 . 1 1 31 31 ASP H H 31 9.019 9.019 7.739 1.280 25755
3798 1 15 . 1 1 32 32 LYS N N 32 112.075 112.075 118.389 -6.314 25755
3799 1 15 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.159 0.390 25755
3800 1 15 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.718 -4.253 25755
3801 1 15 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.589 -0.724 25755
3802 1 15 . 1 1 32 32 LYS H H 32 6.639 6.639 8.298 -1.659 25755
3803 1 15 . 1 1 33 33 HIS N N 33 112.955 112.955 114.854 -1.899 25755
3804 1 15 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.161 0.462 25755
3805 1 15 . 1 1 33 33 HIS CA C 33 56.486 56.486 55.959 0.527 25755
3806 1 15 . 1 1 33 33 HIS CB C 33 25.694 25.694 28.107 -2.413 25755
3807 1 15 . 1 1 33 33 HIS H H 33 7.065 7.065 8.021 -0.956 25755
3808 1 15 . 1 1 34 34 ALA N N 34 120.177 120.177 119.103 1.074 25755
3809 1 15 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.819 0.330 25755
3810 1 15 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.440 -1.661 25755
3811 1 15 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.541 -0.423 25755
3812 1 15 . 1 1 34 34 ALA H H 34 7.716 7.716 7.016 0.700 25755
3813 1 15 . 1 1 35 35 ARG N N 35 116.636 116.636 117.098 -0.462 25755
3814 1 15 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.130 0.076 25755
3815 1 15 . 1 1 35 35 ARG CA C 35 58.076 58.076 59.407 -1.331 25755
3816 1 15 . 1 1 35 35 ARG CB C 35 30.717 30.717 31.115 -0.398 25755
3817 1 15 . 1 1 35 35 ARG H H 35 8.295 8.295 8.284 0.011 25755
3818 1 15 . 1 1 36 36 SER N N 36 109.273 109.273 111.275 -2.002 25755
3819 1 15 . 1 1 36 36 SER HA H 36 4.646 4.646 4.465 0.181 25755
3820 1 15 . 1 1 36 36 SER CA C 36 57.703 57.703 58.535 -0.832 25755
3821 1 15 . 1 1 36 36 SER CB C 36 65.425 65.425 66.518 -1.093 25755
3822 1 15 . 1 1 36 36 SER H H 36 8.026 8.026 8.840 -0.814 25755
3823 1 15 . 1 1 37 37 GLY N N 37 107.305 107.305 112.591 -5.286 25755
3824 1 15 . 1 1 37 37 GLY CA C 37 47.152 47.152 45.260 1.892 25755
3825 1 15 . 1 1 37 37 GLY H H 37 8.679 8.679 8.399 0.280 25755
3826 1 15 . 1 1 38 38 GLU N N 38 119.065 119.065 122.533 -3.468 25755
3827 1 15 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.583 -0.181 25755
3828 1 15 . 1 1 38 38 GLU CA C 38 55.773 55.773 55.421 0.352 25755
3829 1 15 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.914 -2.092 25755
3830 1 15 . 1 1 38 38 GLU H H 38 8.351 8.351 8.807 -0.456 25755
3831 1 15 . 1 1 39 39 CYS N N 39 121.636 121.636 118.702 2.934 25755
3832 1 15 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.310 0.677 25755
3833 1 15 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.895 -1.167 25755
3834 1 15 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.359 16.660 25755
3835 1 15 . 1 1 39 39 CYS H H 39 8.839 8.839 8.267 0.572 25755
3836 1 15 . 1 1 40 40 PHE N N 40 121.987 121.987 120.289 1.698 25755
3837 1 15 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.740 0.030 25755
3838 1 15 . 1 1 40 40 PHE CA C 40 56.969 56.969 56.569 0.400 25755
3839 1 15 . 1 1 40 40 PHE CB C 40 43.760 43.760 42.880 0.880 25755
3840 1 15 . 1 1 40 40 PHE H H 40 9.214 9.214 8.839 0.375 25755
3841 1 15 . 1 1 41 41 TYR N N 41 121.905 121.905 120.077 1.828 25755
3842 1 15 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.690 0.270 25755
3843 1 15 . 1 1 41 41 TYR CA C 41 58.532 58.532 58.548 -0.016 25755
3844 1 15 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.286 1.016 25755
3845 1 15 . 1 1 41 41 TYR H H 41 8.557 8.557 8.579 -0.022 25755
3846 1 15 . 1 1 42 42 ASP N N 42 123.133 123.133 119.576 3.557 25755
3847 1 15 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.692 0.061 25755
3848 1 15 . 1 1 42 42 ASP CA C 42 52.426 52.426 52.771 -0.345 25755
3849 1 15 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.567 -0.947 25755
3850 1 15 . 1 1 42 42 ASP H H 42 8.603 8.603 8.345 0.258 25755
3851 1 15 . 1 1 43 43 GLU N N 43 118.012 118.012 119.364 -1.352 25755
3852 1 15 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.105 0.104 25755
3853 1 15 . 1 1 43 43 GLU CA C 43 58.865 58.865 59.234 -0.369 25755
3854 1 15 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.360 -0.123 25755
3855 1 15 . 1 1 43 43 GLU H H 43 9.081 9.081 8.711 0.370 25755
3856 1 15 . 1 1 44 44 LYS N N 44 120.047 120.047 116.609 3.438 25755
3857 1 15 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.349 0.095 25755
3858 1 15 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.584 0.077 25755
3859 1 15 . 1 1 44 44 LYS CB C 44 32.039 32.039 32.714 -0.675 25755
3860 1 15 . 1 1 44 44 LYS H H 44 8.162 8.162 8.535 -0.373 25755
3861 1 15 . 1 1 45 45 ARG N N 45 113.453 113.453 115.836 -2.383 25755
3862 1 15 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.106 -0.443 25755
3863 1 15 . 1 1 45 45 ARG CA C 45 57.736 57.736 56.850 0.886 25755
3864 1 15 . 1 1 45 45 ARG CB C 45 26.390 26.390 26.555 -0.165 25755
3865 1 15 . 1 1 45 45 ARG H H 45 8.335 8.335 8.080 0.255 25755
3866 1 15 . 1 1 46 46 ASN N N 46 118.207 118.207 117.736 0.471 25755
3867 1 15 . 1 1 46 46 ASN HA H 46 4.982 4.982 5.041 -0.059 25755
3868 1 15 . 1 1 46 46 ASN CA C 46 53.066 53.066 52.074 0.992 25755
3869 1 15 . 1 1 46 46 ASN CB C 46 39.293 39.293 39.633 -0.340 25755
3870 1 15 . 1 1 46 46 ASN H H 46 8.745 8.745 9.167 -0.422 25755
3871 1 15 . 1 1 47 47 LEU N N 47 125.815 125.815 127.145 -1.330 25755
3872 1 15 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.028 0.251 25755
3873 1 15 . 1 1 47 47 LEU CA C 47 55.290 55.290 55.120 0.170 25755
3874 1 15 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.154 2.152 25755
3875 1 15 . 1 1 47 47 LEU H H 47 8.509 8.509 8.920 -0.411 25755
3876 1 15 . 1 1 48 48 GLN N N 48 120.834 120.834 122.354 -1.520 25755
3877 1 15 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.660 0.076 25755
3878 1 15 . 1 1 48 48 GLN CA C 48 54.105 54.105 53.891 0.214 25755
3879 1 15 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.102 -0.236 25755
3880 1 15 . 1 1 48 48 GLN H H 48 8.589 8.589 8.910 -0.321 25755
3881 1 15 . 1 1 49 49 CYS N N 49 121.829 121.829 123.546 -1.717 25755
3882 1 15 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.549 0.309 25755
3883 1 15 . 1 1 49 49 CYS CA C 49 54.955 54.955 58.944 -3.989 25755
3884 1 15 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.542 12.903 25755
3885 1 15 . 1 1 49 49 CYS H H 49 9.247 9.247 8.937 0.310 25755
3886 1 15 . 1 1 50 50 ILE N N 50 129.010 129.010 130.028 -1.018 25755
3887 1 15 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.458 -0.072 25755
3888 1 15 . 1 1 50 50 ILE CA C 50 60.421 60.421 62.030 -1.609 25755
3889 1 15 . 1 1 50 50 ILE CB C 50 38.404 38.404 39.215 -0.811 25755
3890 1 15 . 1 1 50 50 ILE H H 50 8.787 8.787 7.919 0.868 25755
3891 1 15 . 1 1 51 51 CYS N N 51 126.108 126.108 126.863 -0.755 25755
3892 1 15 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.675 0.662 25755
3893 1 15 . 1 1 51 51 CYS CA C 51 51.818 51.818 57.920 -6.102 25755
3894 1 15 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.675 6.307 25755
3895 1 15 . 1 1 51 51 CYS H H 51 8.556 8.556 9.258 -0.702 25755
3896 1 15 . 1 1 52 52 ASP N N 52 122.342 122.342 119.043 3.299 25755
3897 1 15 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.955 0.558 25755
3898 1 15 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.089 -0.506 25755
3899 1 15 . 1 1 52 52 ASP CB C 52 42.831 42.831 41.186 1.645 25755
3900 1 15 . 1 1 52 52 ASP H H 52 8.826 8.826 8.564 0.262 25755
3901 1 15 . 1 1 53 53 TYR N N 53 125.370 125.370 122.168 3.202 25755
3902 1 15 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.706 -0.448 25755
3903 1 15 . 1 1 53 53 TYR CA C 53 59.665 59.665 59.228 0.437 25755
3904 1 15 . 1 1 53 53 TYR CB C 53 38.783 38.783 39.179 -0.396 25755
3905 1 15 . 1 1 53 53 TYR H H 53 9.734 9.734 8.591 1.143 25755
3906 1 15 . 1 1 54 54 CYS N N 54 120.418 120.418 120.931 -0.513 25755
3907 1 15 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.473 0.021 25755
3908 1 15 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.796 -4.653 25755
3909 1 15 . 1 1 54 54 CYS CB C 54 44.382 44.382 29.024 15.358 25755
3910 1 15 . 1 1 54 54 CYS H H 54 9.478 9.478 8.979 0.499 25755
3911 1 15 . 1 1 55 55 GLU N N 55 121.097 121.097 119.621 1.476 25755
3912 1 15 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.979 -0.667 25755
3913 1 15 . 1 1 55 55 GLU CA C 55 56.010 56.010 56.059 -0.049 25755
3914 1 15 . 1 1 55 55 GLU CB C 55 31.014 31.014 32.344 -1.330 25755
3915 1 15 . 1 1 55 55 GLU H H 55 8.423 8.423 8.208 0.215 25755
3916 1 16 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.772 -0.521 25755
3917 1 16 . 1 1 2 2 ASP CA C 2 59.484 59.484 54.363 5.121 25755
3918 1 16 . 1 1 2 2 ASP CB C 2 39.412 39.412 40.857 -1.445 25755
3919 1 16 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.444 -0.099 25755
3920 1 16 . 1 1 3 3 LYS CA C 3 57.556 57.556 56.319 1.237 25755
3921 1 16 . 1 1 3 3 LYS CB C 3 32.593 32.593 32.489 0.104 25755
3922 1 16 . 1 1 4 4 CYS N N 4 117.049 117.049 120.079 -3.030 25755
3923 1 16 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.863 -0.135 25755
3924 1 16 . 1 1 4 4 CYS CA C 4 57.415 57.415 58.044 -0.629 25755
3925 1 16 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.060 12.783 25755
3926 1 16 . 1 1 4 4 CYS H H 4 8.486 8.486 8.287 0.199 25755
3927 1 16 . 1 1 5 5 LYS N N 5 118.790 118.790 120.999 -2.209 25755
3928 1 16 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.850 0.721 25755
3929 1 16 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.472 -0.182 25755
3930 1 16 . 1 1 5 5 LYS CB C 5 34.606 34.606 35.200 -0.595 25755
3931 1 16 . 1 1 5 5 LYS H H 5 8.007 8.007 8.289 -0.282 25755
3932 1 16 . 1 1 6 6 LYS N N 6 121.177 121.177 120.119 1.058 25755
3933 1 16 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.558 0.227 25755
3934 1 16 . 1 1 6 6 LYS CA C 6 55.542 55.542 56.281 -0.739 25755
3935 1 16 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.912 0.990 25755
3936 1 16 . 1 1 6 6 LYS H H 6 9.014 9.014 8.691 0.323 25755
3937 1 16 . 1 1 7 7 VAL N N 7 127.629 127.629 124.801 2.828 25755
3938 1 16 . 1 1 7 7 VAL HA H 7 4.026 4.026 4.138 -0.112 25755
3939 1 16 . 1 1 7 7 VAL CA C 7 63.988 63.988 62.534 1.454 25755
3940 1 16 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.887 0.220 25755
3941 1 16 . 1 1 7 7 VAL H H 7 8.837 8.837 8.587 0.250 25755
3942 1 16 . 1 1 8 8 TYR N N 8 130.003 130.003 130.056 -0.053 25755
3943 1 16 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.745 -0.286 25755
3944 1 16 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.413 0.307 25755
3945 1 16 . 1 1 8 8 TYR CB C 8 36.018 36.018 38.218 -2.200 25755
3946 1 16 . 1 1 8 8 TYR H H 8 9.251 9.251 8.423 0.828 25755
3947 1 16 . 1 1 9 9 GLU N N 9 130.851 130.851 124.690 6.161 25755
3948 1 16 . 1 1 9 9 GLU HA H 9 4.204 4.204 3.997 0.207 25755
3949 1 16 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.906 -0.389 25755
3950 1 16 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.410 -0.019 25755
3951 1 16 . 1 1 9 9 GLU H H 9 9.072 9.072 8.419 0.653 25755
3952 1 16 . 1 1 10 10 ASN N N 10 116.120 116.120 117.191 -1.071 25755
3953 1 16 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.589 -0.151 25755
3954 1 16 . 1 1 10 10 ASN CA C 10 54.587 54.587 52.875 1.712 25755
3955 1 16 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.256 0.022 25755
3956 1 16 . 1 1 10 10 ASN H H 10 9.301 9.301 7.644 1.657 25755
3957 1 16 . 1 1 11 11 TYR N N 11 122.436 122.436 120.484 1.952 25755
3958 1 16 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.624 -0.430 25755
3959 1 16 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.247 2.365 25755
3960 1 16 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.812 -2.345 25755
3961 1 16 . 1 1 11 11 TYR H H 11 7.550 7.550 7.648 -0.098 25755
3962 1 16 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.542 -0.095 25755
3963 1 16 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.479 0.019 25755
3964 1 16 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.529 -1.938 25755
3965 1 16 . 1 1 13 13 VAL N N 13 124.506 124.506 121.448 3.058 25755
3966 1 16 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.842 -0.006 25755
3967 1 16 . 1 1 13 13 VAL CA C 13 65.761 65.761 64.685 1.076 25755
3968 1 16 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.451 0.129 25755
3969 1 16 . 1 1 13 13 VAL H H 13 8.169 8.169 8.452 -0.283 25755
3970 1 16 . 1 1 14 14 SER N N 14 116.625 116.625 117.292 -0.667 25755
3971 1 16 . 1 1 14 14 SER HA H 14 4.206 4.206 4.436 -0.230 25755
3972 1 16 . 1 1 14 14 SER CA C 14 61.194 61.194 61.669 -0.475 25755
3973 1 16 . 1 1 14 14 SER CB C 14 62.041 62.041 62.639 -0.598 25755
3974 1 16 . 1 1 14 14 SER H H 14 8.396 8.396 8.194 0.202 25755
3975 1 16 . 1 1 15 15 LYS N N 15 120.843 120.843 121.640 -0.797 25755
3976 1 16 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.030 0.170 25755
3977 1 16 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.202 0.421 25755
3978 1 16 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.164 0.022 25755
3979 1 16 . 1 1 15 15 LYS H H 15 7.791 7.791 8.091 -0.300 25755
3980 1 16 . 1 1 16 16 CYS N N 16 115.949 115.949 117.597 -1.648 25755
3981 1 16 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.462 0.431 25755
3982 1 16 . 1 1 16 16 CYS CA C 16 56.570 56.570 61.377 -4.807 25755
3983 1 16 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.639 14.798 25755
3984 1 16 . 1 1 16 16 CYS H H 16 7.870 7.870 7.576 0.294 25755
3985 1 16 . 1 1 17 17 GLN N N 17 117.241 117.241 117.527 -0.286 25755
3986 1 16 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.064 0.210 25755
3987 1 16 . 1 1 17 17 GLN CA C 17 56.937 56.937 57.490 -0.553 25755
3988 1 16 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.624 0.563 25755
3989 1 16 . 1 1 17 17 GLN H H 17 7.560 7.560 7.632 -0.072 25755
3990 1 16 . 1 1 18 18 LEU N N 18 120.537 120.537 121.615 -1.078 25755
3991 1 16 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.136 0.304 25755
3992 1 16 . 1 1 18 18 LEU CA C 18 55.448 55.448 55.146 0.302 25755
3993 1 16 . 1 1 18 18 LEU CB C 18 41.837 41.837 40.896 0.941 25755
3994 1 16 . 1 1 18 18 LEU H H 18 7.369 7.369 7.341 0.028 25755
3995 1 16 . 1 1 19 19 ARG N N 19 121.697 121.697 121.237 0.460 25755
3996 1 16 . 1 1 19 19 ARG HA H 19 4.299 4.299 3.999 0.300 25755
3997 1 16 . 1 1 19 19 ARG CA C 19 57.836 57.836 58.417 -0.581 25755
3998 1 16 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.014 0.378 25755
3999 1 16 . 1 1 19 19 ARG H H 19 8.447 8.447 7.992 0.455 25755
4000 1 16 . 1 1 20 20 ILE N N 20 116.439 116.439 119.023 -2.584 25755
4001 1 16 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.104 0.030 25755
4002 1 16 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.249 0.248 25755
4003 1 16 . 1 1 20 20 ILE CB C 20 38.164 38.164 37.095 1.069 25755
4004 1 16 . 1 1 20 20 ILE H H 20 7.758 7.758 7.793 -0.035 25755
4005 1 16 . 1 1 21 21 ALA N N 21 122.642 122.642 123.257 -0.615 25755
4006 1 16 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.519 -0.137 25755
4007 1 16 . 1 1 21 21 ALA CA C 21 52.395 52.395 50.899 1.496 25755
4008 1 16 . 1 1 21 21 ALA CB C 21 20.098 20.098 17.933 2.165 25755
4009 1 16 . 1 1 21 21 ALA H H 21 7.727 7.727 7.887 -0.160 25755
4010 1 16 . 1 1 22 22 ASN N N 22 116.616 116.616 120.908 -4.292 25755
4011 1 16 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.819 -0.028 25755
4012 1 16 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.797 0.080 25755
4013 1 16 . 1 1 22 22 ASN CB C 22 37.554 37.554 38.218 -0.664 25755
4014 1 16 . 1 1 22 22 ASN H H 22 8.307 8.307 8.478 -0.171 25755
4015 1 16 . 1 1 23 23 GLN N N 23 124.357 124.357 123.269 1.088 25755
4016 1 16 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.356 -0.338 25755
4017 1 16 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.637 1.011 25755
4018 1 16 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.655 0.744 25755
4019 1 16 . 1 1 23 23 GLN H H 23 8.542 8.542 8.189 0.353 25755
4020 1 16 . 1 1 24 24 CYS N N 24 118.909 118.909 119.607 -0.698 25755
4021 1 16 . 1 1 24 24 CYS HA H 24 4.284 4.284 3.958 0.326 25755
4022 1 16 . 1 1 24 24 CYS CA C 24 58.406 58.406 62.926 -4.520 25755
4023 1 16 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.590 12.186 25755
4024 1 16 . 1 1 24 24 CYS H H 24 8.352 8.352 8.834 -0.482 25755
4025 1 16 . 1 1 25 25 ASN N N 25 118.182 118.182 119.790 -1.608 25755
4026 1 16 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.260 -0.372 25755
4027 1 16 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.724 0.948 25755
4028 1 16 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.217 2.557 25755
4029 1 16 . 1 1 25 25 ASN H H 25 7.504 7.504 8.493 -0.989 25755
4030 1 16 . 1 1 26 26 TYR N N 26 117.354 117.354 120.393 -3.039 25755
4031 1 16 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.178 -0.213 25755
4032 1 16 . 1 1 26 26 TYR CA C 26 62.162 62.162 62.008 0.154 25755
4033 1 16 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.848 -0.218 25755
4034 1 16 . 1 1 26 26 TYR H H 26 7.322 7.322 7.562 -0.240 25755
4035 1 16 . 1 1 27 27 ASP N N 27 119.874 119.874 119.977 -0.103 25755
4036 1 16 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.350 0.305 25755
4037 1 16 . 1 1 27 27 ASP CB C 27 40.590 40.590 40.784 -0.194 25755
4038 1 16 . 1 1 27 27 ASP H H 27 9.218 9.218 8.296 0.922 25755
4039 1 16 . 1 1 28 28 CYS N N 28 119.782 119.782 119.004 0.778 25755
4040 1 16 . 1 1 28 28 CYS HA H 28 4.168 4.168 3.928 0.240 25755
4041 1 16 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.714 -1.800 25755
4042 1 16 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.217 10.728 25755
4043 1 16 . 1 1 28 28 CYS H H 28 9.171 9.171 8.310 0.861 25755
4044 1 16 . 1 1 29 29 LYS N N 29 119.663 119.663 119.130 0.533 25755
4045 1 16 . 1 1 29 29 LYS HA H 29 4.137 4.137 4.026 0.111 25755
4046 1 16 . 1 1 29 29 LYS CA C 29 59.781 59.781 59.121 0.660 25755
4047 1 16 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.915 0.498 25755
4048 1 16 . 1 1 29 29 LYS H H 29 7.546 7.546 7.490 0.056 25755
4049 1 16 . 1 1 30 30 LEU N N 30 119.987 119.987 120.988 -1.001 25755
4050 1 16 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.916 0.195 25755
4051 1 16 . 1 1 30 30 LEU CA C 30 57.672 57.672 57.774 -0.102 25755
4052 1 16 . 1 1 30 30 LEU CB C 30 42.379 42.379 42.292 0.087 25755
4053 1 16 . 1 1 30 30 LEU H H 30 8.226 8.226 7.801 0.425 25755
4054 1 16 . 1 1 31 31 ASP N N 31 116.853 116.853 116.591 0.262 25755
4055 1 16 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.638 -0.092 25755
4056 1 16 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.436 0.830 25755
4057 1 16 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.104 -0.626 25755
4058 1 16 . 1 1 31 31 ASP H H 31 9.019 9.019 7.845 1.174 25755
4059 1 16 . 1 1 32 32 LYS N N 32 112.075 112.075 118.775 -6.700 25755
4060 1 16 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.169 0.380 25755
4061 1 16 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.596 -4.131 25755
4062 1 16 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.653 -0.788 25755
4063 1 16 . 1 1 32 32 LYS H H 32 6.639 6.639 8.236 -1.597 25755
4064 1 16 . 1 1 33 33 HIS N N 33 112.955 112.955 114.912 -1.957 25755
4065 1 16 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.184 0.439 25755
4066 1 16 . 1 1 33 33 HIS CA C 33 56.486 56.486 55.285 1.201 25755
4067 1 16 . 1 1 33 33 HIS CB C 33 25.694 25.694 28.410 -2.716 25755
4068 1 16 . 1 1 33 33 HIS H H 33 7.065 7.065 8.127 -1.062 25755
4069 1 16 . 1 1 34 34 ALA N N 34 120.177 120.177 119.668 0.509 25755
4070 1 16 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.702 0.447 25755
4071 1 16 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.451 -1.672 25755
4072 1 16 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.640 -0.522 25755
4073 1 16 . 1 1 34 34 ALA H H 34 7.716 7.716 7.140 0.576 25755
4074 1 16 . 1 1 35 35 ARG N N 35 116.636 116.636 116.975 -0.339 25755
4075 1 16 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.422 -0.216 25755
4076 1 16 . 1 1 35 35 ARG CA C 35 58.076 58.076 58.976 -0.900 25755
4077 1 16 . 1 1 35 35 ARG CB C 35 30.717 30.717 30.844 -0.127 25755
4078 1 16 . 1 1 35 35 ARG H H 35 8.295 8.295 7.993 0.302 25755
4079 1 16 . 1 1 36 36 SER N N 36 109.273 109.273 111.704 -2.431 25755
4080 1 16 . 1 1 36 36 SER HA H 36 4.646 4.646 4.463 0.183 25755
4081 1 16 . 1 1 36 36 SER CA C 36 57.703 57.703 57.918 -0.215 25755
4082 1 16 . 1 1 36 36 SER CB C 36 65.425 65.425 65.103 0.322 25755
4083 1 16 . 1 1 36 36 SER H H 36 8.026 8.026 8.033 -0.007 25755
4084 1 16 . 1 1 37 37 GLY N N 37 107.305 107.305 110.499 -3.194 25755
4085 1 16 . 1 1 37 37 GLY CA C 37 47.152 47.152 44.898 2.254 25755
4086 1 16 . 1 1 37 37 GLY H H 37 8.679 8.679 7.824 0.855 25755
4087 1 16 . 1 1 38 38 GLU N N 38 119.065 119.065 122.086 -3.021 25755
4088 1 16 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.560 -0.158 25755
4089 1 16 . 1 1 38 38 GLU CA C 38 55.773 55.773 54.805 0.968 25755
4090 1 16 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.965 -2.143 25755
4091 1 16 . 1 1 38 38 GLU H H 38 8.351 8.351 8.908 -0.557 25755
4092 1 16 . 1 1 39 39 CYS N N 39 121.636 121.636 118.119 3.517 25755
4093 1 16 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.260 0.728 25755
4094 1 16 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.694 -0.966 25755
4095 1 16 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.326 16.693 25755
4096 1 16 . 1 1 39 39 CYS H H 39 8.839 8.839 8.266 0.573 25755
4097 1 16 . 1 1 40 40 PHE N N 40 121.987 121.987 120.135 1.852 25755
4098 1 16 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.844 -0.074 25755
4099 1 16 . 1 1 40 40 PHE CA C 40 56.969 56.969 55.950 1.020 25755
4100 1 16 . 1 1 40 40 PHE CB C 40 43.760 43.760 42.761 0.999 25755
4101 1 16 . 1 1 40 40 PHE H H 40 9.214 9.214 8.752 0.462 25755
4102 1 16 . 1 1 41 41 TYR N N 41 121.905 121.905 118.454 3.451 25755
4103 1 16 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.831 0.129 25755
4104 1 16 . 1 1 41 41 TYR CA C 41 58.532 58.532 59.102 -0.570 25755
4105 1 16 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.246 1.056 25755
4106 1 16 . 1 1 41 41 TYR H H 41 8.557 8.557 8.760 -0.203 25755
4107 1 16 . 1 1 42 42 ASP N N 42 123.133 123.133 121.211 1.922 25755
4108 1 16 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.893 -0.140 25755
4109 1 16 . 1 1 42 42 ASP CA C 42 52.426 52.426 52.594 -0.168 25755
4110 1 16 . 1 1 42 42 ASP CB C 42 41.620 41.620 43.314 -1.694 25755
4111 1 16 . 1 1 42 42 ASP H H 42 8.603 8.603 8.560 0.043 25755
4112 1 16 . 1 1 43 43 GLU N N 43 118.012 118.012 119.663 -1.651 25755
4113 1 16 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.166 0.043 25755
4114 1 16 . 1 1 43 43 GLU CA C 43 58.865 58.865 58.588 0.277 25755
4115 1 16 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.587 -0.350 25755
4116 1 16 . 1 1 43 43 GLU H H 43 9.081 9.081 8.779 0.302 25755
4117 1 16 . 1 1 44 44 LYS N N 44 120.047 120.047 117.385 2.662 25755
4118 1 16 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.426 0.018 25755
4119 1 16 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.693 -0.032 25755
4120 1 16 . 1 1 44 44 LYS CB C 44 32.039 32.039 32.413 -0.374 25755
4121 1 16 . 1 1 44 44 LYS H H 44 8.162 8.162 7.936 0.226 25755
4122 1 16 . 1 1 45 45 ARG N N 45 113.453 113.453 115.860 -2.407 25755
4123 1 16 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.064 -0.401 25755
4124 1 16 . 1 1 45 45 ARG CA C 45 57.736 57.736 56.774 0.962 25755
4125 1 16 . 1 1 45 45 ARG CB C 45 26.390 26.390 27.064 -0.674 25755
4126 1 16 . 1 1 45 45 ARG H H 45 8.335 8.335 7.910 0.425 25755
4127 1 16 . 1 1 46 46 ASN N N 46 118.207 118.207 116.374 1.833 25755
4128 1 16 . 1 1 46 46 ASN HA H 46 4.982 4.982 4.968 0.014 25755
4129 1 16 . 1 1 46 46 ASN CA C 46 53.066 53.066 51.793 1.273 25755
4130 1 16 . 1 1 46 46 ASN CB C 46 39.293 39.293 39.709 -0.416 25755
4131 1 16 . 1 1 46 46 ASN H H 46 8.745 8.745 8.148 0.597 25755
4132 1 16 . 1 1 47 47 LEU N N 47 125.815 125.815 126.770 -0.955 25755
4133 1 16 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.109 0.170 25755
4134 1 16 . 1 1 47 47 LEU CA C 47 55.290 55.290 54.978 0.312 25755
4135 1 16 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.861 1.445 25755
4136 1 16 . 1 1 47 47 LEU H H 47 8.509 8.509 8.825 -0.316 25755
4137 1 16 . 1 1 48 48 GLN N N 48 120.834 120.834 122.374 -1.540 25755
4138 1 16 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.707 0.029 25755
4139 1 16 . 1 1 48 48 GLN CA C 48 54.105 54.105 54.234 -0.129 25755
4140 1 16 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.520 -0.654 25755
4141 1 16 . 1 1 48 48 GLN H H 48 8.589 8.589 8.977 -0.388 25755
4142 1 16 . 1 1 49 49 CYS N N 49 121.829 121.829 122.946 -1.117 25755
4143 1 16 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.613 0.245 25755
4144 1 16 . 1 1 49 49 CYS CA C 49 54.955 54.955 58.986 -4.031 25755
4145 1 16 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.665 12.780 25755
4146 1 16 . 1 1 49 49 CYS H H 49 9.247 9.247 9.036 0.211 25755
4147 1 16 . 1 1 50 50 ILE N N 50 129.010 129.010 129.983 -0.973 25755
4148 1 16 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.477 -0.091 25755
4149 1 16 . 1 1 50 50 ILE CA C 50 60.421 60.421 61.825 -1.403 25755
4150 1 16 . 1 1 50 50 ILE CB C 50 38.404 38.404 38.897 -0.493 25755
4151 1 16 . 1 1 50 50 ILE H H 50 8.787 8.787 8.385 0.402 25755
4152 1 16 . 1 1 51 51 CYS N N 51 126.108 126.108 127.463 -1.355 25755
4153 1 16 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.633 0.704 25755
4154 1 16 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.548 -6.730 25755
4155 1 16 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.719 6.263 25755
4156 1 16 . 1 1 51 51 CYS H H 51 8.556 8.556 9.335 -0.779 25755
4157 1 16 . 1 1 52 52 ASP N N 52 122.342 122.342 120.318 2.024 25755
4158 1 16 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.995 0.518 25755
4159 1 16 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.819 -1.236 25755
4160 1 16 . 1 1 52 52 ASP CB C 52 42.831 42.831 43.239 -0.408 25755
4161 1 16 . 1 1 52 52 ASP H H 52 8.826 8.826 8.435 0.391 25755
4162 1 16 . 1 1 53 53 TYR N N 53 125.370 125.370 123.737 1.633 25755
4163 1 16 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.549 -0.291 25755
4164 1 16 . 1 1 53 53 TYR CA C 53 59.665 59.665 59.044 0.621 25755
4165 1 16 . 1 1 53 53 TYR CB C 53 38.783 38.783 38.713 0.070 25755
4166 1 16 . 1 1 53 53 TYR H H 53 9.734 9.734 8.740 0.994 25755
4167 1 16 . 1 1 54 54 CYS N N 54 120.418 120.418 120.826 -0.408 25755
4168 1 16 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.457 0.037 25755
4169 1 16 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.569 -4.426 25755
4170 1 16 . 1 1 54 54 CYS CB C 54 44.382 44.382 29.353 15.029 25755
4171 1 16 . 1 1 54 54 CYS H H 54 9.478 9.478 8.885 0.593 25755
4172 1 16 . 1 1 55 55 GLU N N 55 121.097 121.097 119.663 1.434 25755
4173 1 16 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.597 -0.285 25755
4174 1 16 . 1 1 55 55 GLU CA C 55 56.010 56.010 55.326 0.684 25755
4175 1 16 . 1 1 55 55 GLU CB C 55 31.014 31.014 31.793 -0.779 25755
4176 1 16 . 1 1 55 55 GLU H H 55 8.423 8.423 7.770 0.653 25755
4177 1 17 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.703 -0.452 25755
4178 1 17 . 1 1 2 2 ASP CA C 2 59.484 59.484 53.889 5.595 25755
4179 1 17 . 1 1 2 2 ASP CB C 2 39.412 39.412 40.020 -0.608 25755
4180 1 17 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.107 0.238 25755
4181 1 17 . 1 1 3 3 LYS CA C 3 57.556 57.556 57.508 0.048 25755
4182 1 17 . 1 1 3 3 LYS CB C 3 32.593 32.593 32.834 -0.241 25755
4183 1 17 . 1 1 4 4 CYS N N 4 117.049 117.049 117.150 -0.101 25755
4184 1 17 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.857 -0.130 25755
4185 1 17 . 1 1 4 4 CYS CA C 4 57.415 57.415 55.842 1.573 25755
4186 1 17 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.729 12.114 25755
4187 1 17 . 1 1 4 4 CYS H H 4 8.486 8.486 8.015 0.471 25755
4188 1 17 . 1 1 5 5 LYS N N 5 118.790 118.790 121.040 -2.250 25755
4189 1 17 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.880 0.691 25755
4190 1 17 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.698 -0.408 25755
4191 1 17 . 1 1 5 5 LYS CB C 5 34.606 34.606 35.019 -0.413 25755
4192 1 17 . 1 1 5 5 LYS H H 5 8.007 8.007 8.237 -0.230 25755
4193 1 17 . 1 1 6 6 LYS N N 6 121.177 121.177 120.458 0.719 25755
4194 1 17 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.559 0.226 25755
4195 1 17 . 1 1 6 6 LYS CA C 6 55.542 55.542 55.751 -0.209 25755
4196 1 17 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.370 1.532 25755
4197 1 17 . 1 1 6 6 LYS H H 6 9.014 9.014 8.793 0.221 25755
4198 1 17 . 1 1 7 7 VAL N N 7 127.629 127.629 123.750 3.879 25755
4199 1 17 . 1 1 7 7 VAL HA H 7 4.026 4.026 4.110 -0.084 25755
4200 1 17 . 1 1 7 7 VAL CA C 7 63.988 63.988 61.750 2.238 25755
4201 1 17 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.922 0.184 25755
4202 1 17 . 1 1 7 7 VAL H H 7 8.837 8.837 8.621 0.216 25755
4203 1 17 . 1 1 8 8 TYR N N 8 130.003 130.003 128.494 1.509 25755
4204 1 17 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.709 -0.250 25755
4205 1 17 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.197 0.523 25755
4206 1 17 . 1 1 8 8 TYR CB C 8 36.018 36.018 37.743 -1.725 25755
4207 1 17 . 1 1 8 8 TYR H H 8 9.251 9.251 8.036 1.215 25755
4208 1 17 . 1 1 9 9 GLU N N 9 130.851 130.851 124.991 5.860 25755
4209 1 17 . 1 1 9 9 GLU HA H 9 4.204 4.204 4.156 0.048 25755
4210 1 17 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.473 0.044 25755
4211 1 17 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.590 -0.199 25755
4212 1 17 . 1 1 9 9 GLU H H 9 9.072 9.072 8.559 0.513 25755
4213 1 17 . 1 1 10 10 ASN N N 10 116.120 116.120 118.251 -2.131 25755
4214 1 17 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.881 -0.443 25755
4215 1 17 . 1 1 10 10 ASN CA C 10 54.587 54.587 52.841 1.746 25755
4216 1 17 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.795 -0.517 25755
4217 1 17 . 1 1 10 10 ASN H H 10 9.301 9.301 8.405 0.896 25755
4218 1 17 . 1 1 11 11 TYR N N 11 122.436 122.436 122.001 0.435 25755
4219 1 17 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.458 -0.264 25755
4220 1 17 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.477 2.135 25755
4221 1 17 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.449 -1.982 25755
4222 1 17 . 1 1 11 11 TYR H H 11 7.550 7.550 7.570 -0.020 25755
4223 1 17 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.513 -0.066 25755
4224 1 17 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.606 -0.108 25755
4225 1 17 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.382 -1.791 25755
4226 1 17 . 1 1 13 13 VAL N N 13 124.506 124.506 122.275 2.231 25755
4227 1 17 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.827 0.009 25755
4228 1 17 . 1 1 13 13 VAL CA C 13 65.761 65.761 64.819 0.942 25755
4229 1 17 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.696 -0.116 25755
4230 1 17 . 1 1 13 13 VAL H H 13 8.169 8.169 8.368 -0.199 25755
4231 1 17 . 1 1 14 14 SER N N 14 116.625 116.625 116.402 0.223 25755
4232 1 17 . 1 1 14 14 SER HA H 14 4.206 4.206 4.188 0.018 25755
4233 1 17 . 1 1 14 14 SER CA C 14 61.194 61.194 61.782 -0.588 25755
4234 1 17 . 1 1 14 14 SER CB C 14 62.041 62.041 62.417 -0.376 25755
4235 1 17 . 1 1 14 14 SER H H 14 8.396 8.396 8.277 0.119 25755
4236 1 17 . 1 1 15 15 LYS N N 15 120.843 120.843 121.636 -0.793 25755
4237 1 17 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.021 0.179 25755
4238 1 17 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.264 0.359 25755
4239 1 17 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.136 0.050 25755
4240 1 17 . 1 1 15 15 LYS H H 15 7.791 7.791 7.987 -0.196 25755
4241 1 17 . 1 1 16 16 CYS N N 16 115.949 115.949 116.853 -0.904 25755
4242 1 17 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.754 0.139 25755
4243 1 17 . 1 1 16 16 CYS CA C 16 56.570 56.570 60.826 -4.256 25755
4244 1 17 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.670 14.767 25755
4245 1 17 . 1 1 16 16 CYS H H 16 7.870 7.870 7.562 0.308 25755
4246 1 17 . 1 1 17 17 GLN N N 17 117.241 117.241 116.853 0.388 25755
4247 1 17 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.212 0.062 25755
4248 1 17 . 1 1 17 17 GLN CA C 17 56.937 56.937 56.358 0.580 25755
4249 1 17 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.780 0.407 25755
4250 1 17 . 1 1 17 17 GLN H H 17 7.560 7.560 7.599 -0.039 25755
4251 1 17 . 1 1 18 18 LEU N N 18 120.537 120.537 121.708 -1.171 25755
4252 1 17 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.198 0.242 25755
4253 1 17 . 1 1 18 18 LEU CA C 18 55.448 55.448 54.988 0.460 25755
4254 1 17 . 1 1 18 18 LEU CB C 18 41.837 41.837 40.664 1.173 25755
4255 1 17 . 1 1 18 18 LEU H H 18 7.369 7.369 7.473 -0.104 25755
4256 1 17 . 1 1 19 19 ARG N N 19 121.697 121.697 122.624 -0.927 25755
4257 1 17 . 1 1 19 19 ARG HA H 19 4.299 4.299 3.998 0.301 25755
4258 1 17 . 1 1 19 19 ARG CA C 19 57.836 57.836 59.266 -1.429 25755
4259 1 17 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.190 0.202 25755
4260 1 17 . 1 1 19 19 ARG H H 19 8.447 8.447 8.033 0.414 25755
4261 1 17 . 1 1 20 20 ILE N N 20 116.439 116.439 116.370 0.069 25755
4262 1 17 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.041 0.093 25755
4263 1 17 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.216 0.281 25755
4264 1 17 . 1 1 20 20 ILE CB C 20 38.164 38.164 38.137 0.027 25755
4265 1 17 . 1 1 20 20 ILE H H 20 7.758 7.758 7.842 -0.084 25755
4266 1 17 . 1 1 21 21 ALA N N 21 122.642 122.642 122.812 -0.170 25755
4267 1 17 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.571 -0.189 25755
4268 1 17 . 1 1 21 21 ALA CA C 21 52.395 52.395 51.687 0.708 25755
4269 1 17 . 1 1 21 21 ALA CB C 21 20.098 20.098 19.812 0.286 25755
4270 1 17 . 1 1 21 21 ALA H H 21 7.727 7.727 7.354 0.373 25755
4271 1 17 . 1 1 22 22 ASN N N 22 116.616 116.616 121.853 -5.237 25755
4272 1 17 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.925 -0.134 25755
4273 1 17 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.321 0.556 25755
4274 1 17 . 1 1 22 22 ASN CB C 22 37.554 37.554 38.066 -0.512 25755
4275 1 17 . 1 1 22 22 ASN H H 22 8.307 8.307 8.521 -0.214 25755
4276 1 17 . 1 1 23 23 GLN N N 23 124.357 124.357 123.876 0.481 25755
4277 1 17 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.265 -0.247 25755
4278 1 17 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.658 0.990 25755
4279 1 17 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.701 0.698 25755
4280 1 17 . 1 1 23 23 GLN H H 23 8.542 8.542 8.315 0.227 25755
4281 1 17 . 1 1 24 24 CYS N N 24 118.909 118.909 118.793 0.116 25755
4282 1 17 . 1 1 24 24 CYS HA H 24 4.284 4.284 4.231 0.053 25755
4283 1 17 . 1 1 24 24 CYS CA C 24 58.406 58.406 62.405 -3.999 25755
4284 1 17 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.855 11.921 25755
4285 1 17 . 1 1 24 24 CYS H H 24 8.352 8.352 8.511 -0.159 25755
4286 1 17 . 1 1 25 25 ASN N N 25 118.182 118.182 119.137 -0.955 25755
4287 1 17 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.270 -0.382 25755
4288 1 17 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.485 1.187 25755
4289 1 17 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.255 2.518 25755
4290 1 17 . 1 1 25 25 ASN H H 25 7.504 7.504 8.424 -0.920 25755
4291 1 17 . 1 1 26 26 TYR N N 26 117.354 117.354 119.370 -2.016 25755
4292 1 17 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.179 -0.214 25755
4293 1 17 . 1 1 26 26 TYR CA C 26 62.162 62.162 61.933 0.229 25755
4294 1 17 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.848 -0.218 25755
4295 1 17 . 1 1 26 26 TYR H H 26 7.322 7.322 7.543 -0.221 25755
4296 1 17 . 1 1 27 27 ASP N N 27 119.874 119.874 120.275 -0.401 25755
4297 1 17 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.417 0.238 25755
4298 1 17 . 1 1 27 27 ASP CB C 27 40.590 40.590 41.203 -0.612 25755
4299 1 17 . 1 1 27 27 ASP H H 27 9.218 9.218 8.271 0.947 25755
4300 1 17 . 1 1 28 28 CYS N N 28 119.782 119.782 118.740 1.042 25755
4301 1 17 . 1 1 28 28 CYS HA H 28 4.168 4.168 4.099 0.069 25755
4302 1 17 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.571 -1.657 25755
4303 1 17 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.334 10.611 25755
4304 1 17 . 1 1 28 28 CYS H H 28 9.171 9.171 8.312 0.859 25755
4305 1 17 . 1 1 29 29 LYS N N 29 119.663 119.663 119.048 0.615 25755
4306 1 17 . 1 1 29 29 LYS HA H 29 4.137 4.137 3.896 0.241 25755
4307 1 17 . 1 1 29 29 LYS CA C 29 59.781 59.781 58.980 0.801 25755
4308 1 17 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.780 0.633 25755
4309 1 17 . 1 1 29 29 LYS H H 29 7.546 7.546 7.462 0.084 25755
4310 1 17 . 1 1 30 30 LEU N N 30 119.987 119.987 120.958 -0.971 25755
4311 1 17 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.893 0.218 25755
4312 1 17 . 1 1 30 30 LEU CA C 30 57.672 57.672 57.808 -0.136 25755
4313 1 17 . 1 1 30 30 LEU CB C 30 42.379 42.379 42.313 0.066 25755
4314 1 17 . 1 1 30 30 LEU H H 30 8.226 8.226 7.802 0.424 25755
4315 1 17 . 1 1 31 31 ASP N N 31 116.853 116.853 115.786 1.067 25755
4316 1 17 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.613 -0.067 25755
4317 1 17 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.729 0.537 25755
4318 1 17 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.674 -1.196 25755
4319 1 17 . 1 1 31 31 ASP H H 31 9.019 9.019 7.854 1.165 25755
4320 1 17 . 1 1 32 32 LYS N N 32 112.075 112.075 118.414 -6.339 25755
4321 1 17 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.168 0.381 25755
4322 1 17 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.698 -4.233 25755
4323 1 17 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.683 -0.818 25755
4324 1 17 . 1 1 32 32 LYS H H 32 6.639 6.639 8.320 -1.681 25755
4325 1 17 . 1 1 33 33 HIS N N 33 112.955 112.955 114.300 -1.345 25755
4326 1 17 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.233 0.390 25755
4327 1 17 . 1 1 33 33 HIS CA C 33 56.486 56.486 56.646 -0.160 25755
4328 1 17 . 1 1 33 33 HIS CB C 33 25.694 25.694 27.856 -2.162 25755
4329 1 17 . 1 1 33 33 HIS H H 33 7.065 7.065 8.090 -1.025 25755
4330 1 17 . 1 1 34 34 ALA N N 34 120.177 120.177 119.920 0.257 25755
4331 1 17 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.764 0.385 25755
4332 1 17 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.428 -1.649 25755
4333 1 17 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.605 -0.487 25755
4334 1 17 . 1 1 34 34 ALA H H 34 7.716 7.716 7.082 0.634 25755
4335 1 17 . 1 1 35 35 ARG N N 35 116.636 116.636 117.942 -1.306 25755
4336 1 17 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.210 -0.004 25755
4337 1 17 . 1 1 35 35 ARG CA C 35 58.076 58.076 58.629 -0.553 25755
4338 1 17 . 1 1 35 35 ARG CB C 35 30.717 30.717 31.125 -0.408 25755
4339 1 17 . 1 1 35 35 ARG H H 35 8.295 8.295 8.138 0.157 25755
4340 1 17 . 1 1 36 36 SER N N 36 109.273 109.273 111.900 -2.627 25755
4341 1 17 . 1 1 36 36 SER HA H 36 4.646 4.646 4.473 0.173 25755
4342 1 17 . 1 1 36 36 SER CA C 36 57.703 57.703 58.013 -0.310 25755
4343 1 17 . 1 1 36 36 SER CB C 36 65.425 65.425 64.602 0.823 25755
4344 1 17 . 1 1 36 36 SER H H 36 8.026 8.026 7.647 0.379 25755
4345 1 17 . 1 1 37 37 GLY N N 37 107.305 107.305 110.143 -2.838 25755
4346 1 17 . 1 1 37 37 GLY CA C 37 47.152 47.152 45.007 2.145 25755
4347 1 17 . 1 1 37 37 GLY H H 37 8.679 8.679 7.936 0.743 25755
4348 1 17 . 1 1 38 38 GLU N N 38 119.065 119.065 122.172 -3.107 25755
4349 1 17 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.550 -0.148 25755
4350 1 17 . 1 1 38 38 GLU CA C 38 55.773 55.773 54.833 0.940 25755
4351 1 17 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.948 -2.126 25755
4352 1 17 . 1 1 38 38 GLU H H 38 8.351 8.351 8.812 -0.461 25755
4353 1 17 . 1 1 39 39 CYS N N 39 121.636 121.636 118.377 3.259 25755
4354 1 17 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.480 0.507 25755
4355 1 17 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.483 -0.756 25755
4356 1 17 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.734 16.285 25755
4357 1 17 . 1 1 39 39 CYS H H 39 8.839 8.839 8.264 0.575 25755
4358 1 17 . 1 1 40 40 PHE N N 40 121.987 121.987 119.968 2.019 25755
4359 1 17 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.797 -0.027 25755
4360 1 17 . 1 1 40 40 PHE CA C 40 56.969 56.969 56.547 0.422 25755
4361 1 17 . 1 1 40 40 PHE CB C 40 43.760 43.760 42.907 0.853 25755
4362 1 17 . 1 1 40 40 PHE H H 40 9.214 9.214 8.888 0.326 25755
4363 1 17 . 1 1 41 41 TYR N N 41 121.905 121.905 120.330 1.575 25755
4364 1 17 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.721 0.239 25755
4365 1 17 . 1 1 41 41 TYR CA C 41 58.532 58.532 58.676 -0.144 25755
4366 1 17 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.151 1.151 25755
4367 1 17 . 1 1 41 41 TYR H H 41 8.557 8.557 8.803 -0.246 25755
4368 1 17 . 1 1 42 42 ASP N N 42 123.133 123.133 121.782 1.351 25755
4369 1 17 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.811 -0.058 25755
4370 1 17 . 1 1 42 42 ASP CA C 42 52.426 52.426 52.521 -0.095 25755
4371 1 17 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.332 -0.712 25755
4372 1 17 . 1 1 42 42 ASP H H 42 8.603 8.603 8.517 0.086 25755
4373 1 17 . 1 1 43 43 GLU N N 43 118.012 118.012 118.626 -0.614 25755
4374 1 17 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.119 0.090 25755
4375 1 17 . 1 1 43 43 GLU CA C 43 58.865 58.865 59.219 -0.354 25755
4376 1 17 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.451 -0.214 25755
4377 1 17 . 1 1 43 43 GLU H H 43 9.081 9.081 8.776 0.305 25755
4378 1 17 . 1 1 44 44 LYS N N 44 120.047 120.047 116.355 3.692 25755
4379 1 17 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.346 0.098 25755
4380 1 17 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.425 0.236 25755
4381 1 17 . 1 1 44 44 LYS CB C 44 32.039 32.039 31.728 0.311 25755
4382 1 17 . 1 1 44 44 LYS H H 44 8.162 8.162 8.472 -0.310 25755
4383 1 17 . 1 1 45 45 ARG N N 45 113.453 113.453 115.426 -1.973 25755
4384 1 17 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.084 -0.421 25755
4385 1 17 . 1 1 45 45 ARG CA C 45 57.736 57.736 57.169 0.567 25755
4386 1 17 . 1 1 45 45 ARG CB C 45 26.390 26.390 27.014 -0.624 25755
4387 1 17 . 1 1 45 45 ARG H H 45 8.335 8.335 8.026 0.309 25755
4388 1 17 . 1 1 46 46 ASN N N 46 118.207 118.207 117.525 0.682 25755
4389 1 17 . 1 1 46 46 ASN HA H 46 4.982 4.982 5.040 -0.058 25755
4390 1 17 . 1 1 46 46 ASN CA C 46 53.066 53.066 51.665 1.401 25755
4391 1 17 . 1 1 46 46 ASN CB C 46 39.293 39.293 40.000 -0.707 25755
4392 1 17 . 1 1 46 46 ASN H H 46 8.745 8.745 9.051 -0.306 25755
4393 1 17 . 1 1 47 47 LEU N N 47 125.815 125.815 127.301 -1.486 25755
4394 1 17 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.098 0.181 25755
4395 1 17 . 1 1 47 47 LEU CA C 47 55.290 55.290 55.149 0.141 25755
4396 1 17 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.536 1.770 25755
4397 1 17 . 1 1 47 47 LEU H H 47 8.509 8.509 8.838 -0.329 25755
4398 1 17 . 1 1 48 48 GLN N N 48 120.834 120.834 122.448 -1.614 25755
4399 1 17 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.688 0.048 25755
4400 1 17 . 1 1 48 48 GLN CA C 48 54.105 54.105 54.312 -0.207 25755
4401 1 17 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.350 -0.484 25755
4402 1 17 . 1 1 48 48 GLN H H 48 8.589 8.589 8.903 -0.314 25755
4403 1 17 . 1 1 49 49 CYS N N 49 121.829 121.829 122.724 -0.895 25755
4404 1 17 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.543 0.315 25755
4405 1 17 . 1 1 49 49 CYS CA C 49 54.955 54.955 58.895 -3.940 25755
4406 1 17 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.403 13.042 25755
4407 1 17 . 1 1 49 49 CYS H H 49 9.247 9.247 8.934 0.313 25755
4408 1 17 . 1 1 50 50 ILE N N 50 129.010 129.010 129.034 -0.024 25755
4409 1 17 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.376 0.010 25755
4410 1 17 . 1 1 50 50 ILE CA C 50 60.421 60.421 61.815 -1.394 25755
4411 1 17 . 1 1 50 50 ILE CB C 50 38.404 38.404 38.846 -0.443 25755
4412 1 17 . 1 1 50 50 ILE H H 50 8.787 8.787 7.862 0.925 25755
4413 1 17 . 1 1 51 51 CYS N N 51 126.108 126.108 127.459 -1.351 25755
4414 1 17 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.636 0.701 25755
4415 1 17 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.552 -6.734 25755
4416 1 17 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.636 6.346 25755
4417 1 17 . 1 1 51 51 CYS H H 51 8.556 8.556 9.350 -0.794 25755
4418 1 17 . 1 1 52 52 ASP N N 52 122.342 122.342 120.370 1.972 25755
4419 1 17 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.851 0.662 25755
4420 1 17 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.696 -1.113 25755
4421 1 17 . 1 1 52 52 ASP CB C 52 42.831 42.831 42.631 0.200 25755
4422 1 17 . 1 1 52 52 ASP H H 52 8.826 8.826 8.498 0.328 25755
4423 1 17 . 1 1 53 53 TYR N N 53 125.370 125.370 123.394 1.976 25755
4424 1 17 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.650 -0.392 25755
4425 1 17 . 1 1 53 53 TYR CA C 53 59.665 59.665 58.937 0.728 25755
4426 1 17 . 1 1 53 53 TYR CB C 53 38.783 38.783 39.501 -0.718 25755
4427 1 17 . 1 1 53 53 TYR H H 53 9.734 9.734 8.727 1.007 25755
4428 1 17 . 1 1 54 54 CYS N N 54 120.418 120.418 121.559 -1.141 25755
4429 1 17 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.474 0.019 25755
4430 1 17 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.447 -4.304 25755
4431 1 17 . 1 1 54 54 CYS CB C 54 44.382 44.382 29.044 15.338 25755
4432 1 17 . 1 1 54 54 CYS H H 54 9.478 9.478 9.008 0.470 25755
4433 1 17 . 1 1 55 55 GLU N N 55 121.097 121.097 118.928 2.169 25755
4434 1 17 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.142 0.170 25755
4435 1 17 . 1 1 55 55 GLU CA C 55 56.010 56.010 57.370 -1.360 25755
4436 1 17 . 1 1 55 55 GLU CB C 55 31.014 31.014 30.031 0.983 25755
4437 1 17 . 1 1 55 55 GLU H H 55 8.423 8.423 8.110 0.313 25755
4438 1 18 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.882 -0.631 25755
4439 1 18 . 1 1 2 2 ASP CA C 2 59.484 59.484 54.041 5.443 25755
4440 1 18 . 1 1 2 2 ASP CB C 2 39.412 39.412 40.423 -1.011 25755
4441 1 18 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.346 -0.001 25755
4442 1 18 . 1 1 3 3 LYS CA C 3 57.556 57.556 56.646 0.910 25755
4443 1 18 . 1 1 3 3 LYS CB C 3 32.593 32.593 33.308 -0.715 25755
4444 1 18 . 1 1 4 4 CYS N N 4 117.049 117.049 119.388 -2.339 25755
4445 1 18 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.895 -0.167 25755
4446 1 18 . 1 1 4 4 CYS CA C 4 57.415 57.415 56.446 0.969 25755
4447 1 18 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.481 12.362 25755
4448 1 18 . 1 1 4 4 CYS H H 4 8.486 8.486 8.157 0.329 25755
4449 1 18 . 1 1 5 5 LYS N N 5 118.790 118.790 121.499 -2.709 25755
4450 1 18 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.868 0.703 25755
4451 1 18 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.757 -0.467 25755
4452 1 18 . 1 1 5 5 LYS CB C 5 34.606 34.606 34.994 -0.388 25755
4453 1 18 . 1 1 5 5 LYS H H 5 8.007 8.007 8.249 -0.242 25755
4454 1 18 . 1 1 6 6 LYS N N 6 121.177 121.177 120.347 0.830 25755
4455 1 18 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.561 0.224 25755
4456 1 18 . 1 1 6 6 LYS CA C 6 55.542 55.542 55.867 -0.325 25755
4457 1 18 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.608 1.294 25755
4458 1 18 . 1 1 6 6 LYS H H 6 9.014 9.014 8.811 0.203 25755
4459 1 18 . 1 1 7 7 VAL N N 7 127.629 127.629 124.165 3.464 25755
4460 1 18 . 1 1 7 7 VAL HA H 7 4.026 4.026 4.025 0.001 25755
4461 1 18 . 1 1 7 7 VAL CA C 7 63.988 63.988 62.464 1.524 25755
4462 1 18 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.654 0.453 25755
4463 1 18 . 1 1 7 7 VAL H H 7 8.837 8.837 8.640 0.197 25755
4464 1 18 . 1 1 8 8 TYR N N 8 130.003 130.003 129.597 0.406 25755
4465 1 18 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.765 -0.306 25755
4466 1 18 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.737 -0.017 25755
4467 1 18 . 1 1 8 8 TYR CB C 8 36.018 36.018 37.532 -1.514 25755
4468 1 18 . 1 1 8 8 TYR H H 8 9.251 9.251 8.340 0.911 25755
4469 1 18 . 1 1 9 9 GLU N N 9 130.851 130.851 124.643 6.208 25755
4470 1 18 . 1 1 9 9 GLU HA H 9 4.204 4.204 4.043 0.161 25755
4471 1 18 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.721 -0.204 25755
4472 1 18 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.473 -0.082 25755
4473 1 18 . 1 1 9 9 GLU H H 9 9.072 9.072 8.480 0.592 25755
4474 1 18 . 1 1 10 10 ASN N N 10 116.120 116.120 116.984 -0.864 25755
4475 1 18 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.632 -0.194 25755
4476 1 18 . 1 1 10 10 ASN CA C 10 54.587 54.587 52.803 1.784 25755
4477 1 18 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.410 -0.132 25755
4478 1 18 . 1 1 10 10 ASN H H 10 9.301 9.301 7.715 1.586 25755
4479 1 18 . 1 1 11 11 TYR N N 11 122.436 122.436 120.860 1.576 25755
4480 1 18 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.650 -0.456 25755
4481 1 18 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.379 2.233 25755
4482 1 18 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.688 -2.221 25755
4483 1 18 . 1 1 11 11 TYR H H 11 7.550 7.550 7.532 0.018 25755
4484 1 18 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.581 -0.134 25755
4485 1 18 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.635 -0.137 25755
4486 1 18 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.828 -2.237 25755
4487 1 18 . 1 1 13 13 VAL N N 13 124.506 124.506 121.263 3.243 25755
4488 1 18 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.740 0.096 25755
4489 1 18 . 1 1 13 13 VAL CA C 13 65.761 65.761 64.826 0.935 25755
4490 1 18 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.682 -0.102 25755
4491 1 18 . 1 1 13 13 VAL H H 13 8.169 8.169 8.435 -0.266 25755
4492 1 18 . 1 1 14 14 SER N N 14 116.625 116.625 117.382 -0.757 25755
4493 1 18 . 1 1 14 14 SER HA H 14 4.206 4.206 4.383 -0.177 25755
4494 1 18 . 1 1 14 14 SER CA C 14 61.194 61.194 62.086 -0.892 25755
4495 1 18 . 1 1 14 14 SER CB C 14 62.041 62.041 62.783 -0.743 25755
4496 1 18 . 1 1 14 14 SER H H 14 8.396 8.396 8.280 0.116 25755
4497 1 18 . 1 1 15 15 LYS N N 15 120.843 120.843 121.798 -0.955 25755
4498 1 18 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.016 0.184 25755
4499 1 18 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.166 0.457 25755
4500 1 18 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.004 0.182 25755
4501 1 18 . 1 1 15 15 LYS H H 15 7.791 7.791 7.665 0.126 25755
4502 1 18 . 1 1 16 16 CYS N N 16 115.949 115.949 116.809 -0.860 25755
4503 1 18 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.548 0.345 25755
4504 1 18 . 1 1 16 16 CYS CA C 16 56.570 56.570 60.598 -4.028 25755
4505 1 18 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.794 14.643 25755
4506 1 18 . 1 1 16 16 CYS H H 16 7.870 7.870 7.520 0.350 25755
4507 1 18 . 1 1 17 17 GLN N N 17 117.241 117.241 117.618 -0.377 25755
4508 1 18 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.109 0.165 25755
4509 1 18 . 1 1 17 17 GLN CA C 17 56.937 56.937 57.214 -0.277 25755
4510 1 18 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.716 0.471 25755
4511 1 18 . 1 1 17 17 GLN H H 17 7.560 7.560 7.767 -0.207 25755
4512 1 18 . 1 1 18 18 LEU N N 18 120.537 120.537 121.375 -0.838 25755
4513 1 18 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.151 0.289 25755
4514 1 18 . 1 1 18 18 LEU CA C 18 55.448 55.448 55.038 0.410 25755
4515 1 18 . 1 1 18 18 LEU CB C 18 41.837 41.837 40.919 0.918 25755
4516 1 18 . 1 1 18 18 LEU H H 18 7.369 7.369 7.501 -0.132 25755
4517 1 18 . 1 1 19 19 ARG N N 19 121.697 121.697 123.194 -1.497 25755
4518 1 18 . 1 1 19 19 ARG HA H 19 4.299 4.299 4.011 0.288 25755
4519 1 18 . 1 1 19 19 ARG CA C 19 57.836 57.836 59.067 -1.231 25755
4520 1 18 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.274 0.118 25755
4521 1 18 . 1 1 19 19 ARG H H 19 8.447 8.447 7.978 0.469 25755
4522 1 18 . 1 1 20 20 ILE N N 20 116.439 116.439 116.348 0.091 25755
4523 1 18 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.025 0.109 25755
4524 1 18 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.359 0.138 25755
4525 1 18 . 1 1 20 20 ILE CB C 20 38.164 38.164 38.174 -0.010 25755
4526 1 18 . 1 1 20 20 ILE H H 20 7.758 7.758 7.773 -0.015 25755
4527 1 18 . 1 1 21 21 ALA N N 21 122.642 122.642 122.811 -0.169 25755
4528 1 18 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.551 -0.169 25755
4529 1 18 . 1 1 21 21 ALA CA C 21 52.395 52.395 51.634 0.761 25755
4530 1 18 . 1 1 21 21 ALA CB C 21 20.098 20.098 19.842 0.256 25755
4531 1 18 . 1 1 21 21 ALA H H 21 7.727 7.727 7.345 0.382 25755
4532 1 18 . 1 1 22 22 ASN N N 22 116.616 116.616 121.463 -4.847 25755
4533 1 18 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.868 -0.077 25755
4534 1 18 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.239 0.638 25755
4535 1 18 . 1 1 22 22 ASN CB C 22 37.554 37.554 37.950 -0.396 25755
4536 1 18 . 1 1 22 22 ASN H H 22 8.307 8.307 8.541 -0.234 25755
4537 1 18 . 1 1 23 23 GLN N N 23 124.357 124.357 123.035 1.322 25755
4538 1 18 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.346 -0.328 25755
4539 1 18 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.423 1.225 25755
4540 1 18 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.348 1.051 25755
4541 1 18 . 1 1 23 23 GLN H H 23 8.542 8.542 8.172 0.370 25755
4542 1 18 . 1 1 24 24 CYS N N 24 118.909 118.909 119.594 -0.685 25755
4543 1 18 . 1 1 24 24 CYS HA H 24 4.284 4.284 4.043 0.241 25755
4544 1 18 . 1 1 24 24 CYS CA C 24 58.406 58.406 62.786 -4.380 25755
4545 1 18 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.804 11.972 25755
4546 1 18 . 1 1 24 24 CYS H H 24 8.352 8.352 8.513 -0.161 25755
4547 1 18 . 1 1 25 25 ASN N N 25 118.182 118.182 119.856 -1.674 25755
4548 1 18 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.334 -0.446 25755
4549 1 18 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.746 0.926 25755
4550 1 18 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.252 2.521 25755
4551 1 18 . 1 1 25 25 ASN H H 25 7.504 7.504 8.486 -0.982 25755
4552 1 18 . 1 1 26 26 TYR N N 26 117.354 117.354 120.142 -2.788 25755
4553 1 18 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.179 -0.214 25755
4554 1 18 . 1 1 26 26 TYR CA C 26 62.162 62.162 61.859 0.303 25755
4555 1 18 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.779 -0.149 25755
4556 1 18 . 1 1 26 26 TYR H H 26 7.322 7.322 7.575 -0.253 25755
4557 1 18 . 1 1 27 27 ASP N N 27 119.874 119.874 119.948 -0.074 25755
4558 1 18 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.328 0.327 25755
4559 1 18 . 1 1 27 27 ASP CB C 27 40.590 40.590 40.855 -0.265 25755
4560 1 18 . 1 1 27 27 ASP H H 27 9.218 9.218 8.164 1.054 25755
4561 1 18 . 1 1 28 28 CYS N N 28 119.782 119.782 119.250 0.532 25755
4562 1 18 . 1 1 28 28 CYS HA H 28 4.168 4.168 3.886 0.282 25755
4563 1 18 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.702 -1.788 25755
4564 1 18 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.177 10.768 25755
4565 1 18 . 1 1 28 28 CYS H H 28 9.171 9.171 8.460 0.711 25755
4566 1 18 . 1 1 29 29 LYS N N 29 119.663 119.663 118.595 1.068 25755
4567 1 18 . 1 1 29 29 LYS HA H 29 4.137 4.137 3.818 0.319 25755
4568 1 18 . 1 1 29 29 LYS CA C 29 59.781 59.781 59.098 0.683 25755
4569 1 18 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.732 0.681 25755
4570 1 18 . 1 1 29 29 LYS H H 29 7.546 7.546 7.410 0.136 25755
4571 1 18 . 1 1 30 30 LEU N N 30 119.987 119.987 119.195 0.792 25755
4572 1 18 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.856 0.255 25755
4573 1 18 . 1 1 30 30 LEU CA C 30 57.672 57.672 58.212 -0.540 25755
4574 1 18 . 1 1 30 30 LEU CB C 30 42.379 42.379 42.088 0.291 25755
4575 1 18 . 1 1 30 30 LEU H H 30 8.226 8.226 7.393 0.833 25755
4576 1 18 . 1 1 31 31 ASP N N 31 116.853 116.853 117.449 -0.596 25755
4577 1 18 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.655 -0.109 25755
4578 1 18 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.658 0.607 25755
4579 1 18 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.203 -0.725 25755
4580 1 18 . 1 1 31 31 ASP H H 31 9.019 9.019 7.961 1.058 25755
4581 1 18 . 1 1 32 32 LYS N N 32 112.075 112.075 118.519 -6.444 25755
4582 1 18 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.123 0.426 25755
4583 1 18 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.785 -4.321 25755
4584 1 18 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.652 -0.787 25755
4585 1 18 . 1 1 32 32 LYS H H 32 6.639 6.639 8.226 -1.587 25755
4586 1 18 . 1 1 33 33 HIS N N 33 112.955 112.955 114.709 -1.754 25755
4587 1 18 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.161 0.462 25755
4588 1 18 . 1 1 33 33 HIS CA C 33 56.486 56.486 56.466 0.020 25755
4589 1 18 . 1 1 33 33 HIS CB C 33 25.694 25.694 27.917 -2.223 25755
4590 1 18 . 1 1 33 33 HIS H H 33 7.065 7.065 8.142 -1.077 25755
4591 1 18 . 1 1 34 34 ALA N N 34 120.177 120.177 119.207 0.970 25755
4592 1 18 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.766 0.383 25755
4593 1 18 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.486 -1.707 25755
4594 1 18 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.478 -0.360 25755
4595 1 18 . 1 1 34 34 ALA H H 34 7.716 7.716 7.049 0.667 25755
4596 1 18 . 1 1 35 35 ARG N N 35 116.636 116.636 117.039 -0.403 25755
4597 1 18 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.092 0.114 25755
4598 1 18 . 1 1 35 35 ARG CA C 35 58.076 58.076 58.401 -0.326 25755
4599 1 18 . 1 1 35 35 ARG CB C 35 30.717 30.717 30.201 0.516 25755
4600 1 18 . 1 1 35 35 ARG H H 35 8.295 8.295 8.085 0.210 25755
4601 1 18 . 1 1 36 36 SER N N 36 109.273 109.273 111.236 -1.963 25755
4602 1 18 . 1 1 36 36 SER HA H 36 4.646 4.646 4.495 0.151 25755
4603 1 18 . 1 1 36 36 SER CA C 36 57.703 57.703 57.825 -0.122 25755
4604 1 18 . 1 1 36 36 SER CB C 36 65.425 65.425 65.318 0.107 25755
4605 1 18 . 1 1 36 36 SER H H 36 8.026 8.026 8.025 0.001 25755
4606 1 18 . 1 1 37 37 GLY N N 37 107.305 107.305 111.094 -3.789 25755
4607 1 18 . 1 1 37 37 GLY CA C 37 47.152 47.152 44.749 2.403 25755
4608 1 18 . 1 1 37 37 GLY H H 37 8.679 8.679 7.861 0.818 25755
4609 1 18 . 1 1 38 38 GLU N N 38 119.065 119.065 122.263 -3.198 25755
4610 1 18 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.579 -0.177 25755
4611 1 18 . 1 1 38 38 GLU CA C 38 55.773 55.773 54.740 1.033 25755
4612 1 18 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.971 -2.149 25755
4613 1 18 . 1 1 38 38 GLU H H 38 8.351 8.351 8.865 -0.514 25755
4614 1 18 . 1 1 39 39 CYS N N 39 121.636 121.636 118.488 3.148 25755
4615 1 18 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.253 0.734 25755
4616 1 18 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.760 -1.032 25755
4617 1 18 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.379 16.640 25755
4618 1 18 . 1 1 39 39 CYS H H 39 8.839 8.839 8.311 0.528 25755
4619 1 18 . 1 1 40 40 PHE N N 40 121.987 121.987 120.408 1.579 25755
4620 1 18 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.793 -0.023 25755
4621 1 18 . 1 1 40 40 PHE CA C 40 56.969 56.969 56.564 0.405 25755
4622 1 18 . 1 1 40 40 PHE CB C 40 43.760 43.760 43.001 0.759 25755
4623 1 18 . 1 1 40 40 PHE H H 40 9.214 9.214 8.776 0.438 25755
4624 1 18 . 1 1 41 41 TYR N N 41 121.905 121.905 119.079 2.826 25755
4625 1 18 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.639 0.321 25755
4626 1 18 . 1 1 41 41 TYR CA C 41 58.532 58.532 59.007 -0.475 25755
4627 1 18 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.272 1.030 25755
4628 1 18 . 1 1 41 41 TYR H H 41 8.557 8.557 8.671 -0.114 25755
4629 1 18 . 1 1 42 42 ASP N N 42 123.133 123.133 121.341 1.792 25755
4630 1 18 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.857 -0.104 25755
4631 1 18 . 1 1 42 42 ASP CA C 42 52.426 52.426 52.877 -0.451 25755
4632 1 18 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.617 -0.997 25755
4633 1 18 . 1 1 42 42 ASP H H 42 8.603 8.603 7.964 0.639 25755
4634 1 18 . 1 1 43 43 GLU N N 43 118.012 118.012 119.505 -1.493 25755
4635 1 18 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.123 0.086 25755
4636 1 18 . 1 1 43 43 GLU CA C 43 58.865 58.865 58.831 0.034 25755
4637 1 18 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.617 -0.380 25755
4638 1 18 . 1 1 43 43 GLU H H 43 9.081 9.081 8.718 0.363 25755
4639 1 18 . 1 1 44 44 LYS N N 44 120.047 120.047 117.393 2.654 25755
4640 1 18 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.385 0.059 25755
4641 1 18 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.436 0.225 25755
4642 1 18 . 1 1 44 44 LYS CB C 44 32.039 32.039 32.617 -0.578 25755
4643 1 18 . 1 1 44 44 LYS H H 44 8.162 8.162 7.785 0.377 25755
4644 1 18 . 1 1 45 45 ARG N N 45 113.453 113.453 115.650 -2.197 25755
4645 1 18 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.048 -0.385 25755
4646 1 18 . 1 1 45 45 ARG CA C 45 57.736 57.736 56.853 0.883 25755
4647 1 18 . 1 1 45 45 ARG CB C 45 26.390 26.390 27.475 -1.085 25755
4648 1 18 . 1 1 45 45 ARG H H 45 8.335 8.335 7.739 0.596 25755
4649 1 18 . 1 1 46 46 ASN N N 46 118.207 118.207 116.577 1.630 25755
4650 1 18 . 1 1 46 46 ASN HA H 46 4.982 4.982 4.932 0.050 25755
4651 1 18 . 1 1 46 46 ASN CA C 46 53.066 53.066 52.327 0.739 25755
4652 1 18 . 1 1 46 46 ASN CB C 46 39.293 39.293 38.759 0.534 25755
4653 1 18 . 1 1 46 46 ASN H H 46 8.745 8.745 8.246 0.499 25755
4654 1 18 . 1 1 47 47 LEU N N 47 125.815 125.815 126.719 -0.904 25755
4655 1 18 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.021 0.258 25755
4656 1 18 . 1 1 47 47 LEU CA C 47 55.290 55.290 54.954 0.336 25755
4657 1 18 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.417 1.889 25755
4658 1 18 . 1 1 47 47 LEU H H 47 8.509 8.509 8.804 -0.295 25755
4659 1 18 . 1 1 48 48 GLN N N 48 120.834 120.834 122.357 -1.523 25755
4660 1 18 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.689 0.047 25755
4661 1 18 . 1 1 48 48 GLN CA C 48 54.105 54.105 53.968 0.137 25755
4662 1 18 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.383 -0.517 25755
4663 1 18 . 1 1 48 48 GLN H H 48 8.589 8.589 8.899 -0.310 25755
4664 1 18 . 1 1 49 49 CYS N N 49 121.829 121.829 123.604 -1.775 25755
4665 1 18 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.530 0.328 25755
4666 1 18 . 1 1 49 49 CYS CA C 49 54.955 54.955 59.146 -4.191 25755
4667 1 18 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.605 12.839 25755
4668 1 18 . 1 1 49 49 CYS H H 49 9.247 9.247 9.009 0.238 25755
4669 1 18 . 1 1 50 50 ILE N N 50 129.010 129.010 130.344 -1.334 25755
4670 1 18 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.471 -0.085 25755
4671 1 18 . 1 1 50 50 ILE CA C 50 60.421 60.421 61.990 -1.569 25755
4672 1 18 . 1 1 50 50 ILE CB C 50 38.404 38.404 38.875 -0.471 25755
4673 1 18 . 1 1 50 50 ILE H H 50 8.787 8.787 7.974 0.813 25755
4674 1 18 . 1 1 51 51 CYS N N 51 126.108 126.108 127.263 -1.155 25755
4675 1 18 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.635 0.702 25755
4676 1 18 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.628 -6.810 25755
4677 1 18 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.619 6.363 25755
4678 1 18 . 1 1 51 51 CYS H H 51 8.556 8.556 9.326 -0.770 25755
4679 1 18 . 1 1 52 52 ASP N N 52 122.342 122.342 119.894 2.448 25755
4680 1 18 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.982 0.531 25755
4681 1 18 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.430 -0.847 25755
4682 1 18 . 1 1 52 52 ASP CB C 52 42.831 42.831 42.322 0.509 25755
4683 1 18 . 1 1 52 52 ASP H H 52 8.826 8.826 8.486 0.340 25755
4684 1 18 . 1 1 53 53 TYR N N 53 125.370 125.370 123.840 1.530 25755
4685 1 18 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.689 -0.431 25755
4686 1 18 . 1 1 53 53 TYR CA C 53 59.665 59.665 58.916 0.749 25755
4687 1 18 . 1 1 53 53 TYR CB C 53 38.783 38.783 39.684 -0.901 25755
4688 1 18 . 1 1 53 53 TYR H H 53 9.734 9.734 8.711 1.023 25755
4689 1 18 . 1 1 54 54 CYS N N 54 120.418 120.418 121.205 -0.787 25755
4690 1 18 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.520 -0.026 25755
4691 1 18 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.709 -4.566 25755
4692 1 18 . 1 1 54 54 CYS CB C 54 44.382 44.382 29.378 15.004 25755
4693 1 18 . 1 1 54 54 CYS H H 54 9.478 9.478 8.954 0.524 25755
4694 1 18 . 1 1 55 55 GLU N N 55 121.097 121.097 118.454 2.643 25755
4695 1 18 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.043 0.269 25755
4696 1 18 . 1 1 55 55 GLU CA C 55 56.010 56.010 57.440 -1.430 25755
4697 1 18 . 1 1 55 55 GLU CB C 55 31.014 31.014 29.841 1.173 25755
4698 1 18 . 1 1 55 55 GLU H H 55 8.423 8.423 7.968 0.455 25755
4699 1 19 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.773 -0.522 25755
4700 1 19 . 1 1 2 2 ASP CA C 2 59.484 59.484 54.431 5.053 25755
4701 1 19 . 1 1 2 2 ASP CB C 2 39.412 39.412 40.715 -1.303 25755
4702 1 19 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.269 0.076 25755
4703 1 19 . 1 1 3 3 LYS CA C 3 57.556 57.556 56.978 0.578 25755
4704 1 19 . 1 1 3 3 LYS CB C 3 32.593 32.593 32.658 -0.065 25755
4705 1 19 . 1 1 4 4 CYS N N 4 117.049 117.049 119.612 -2.563 25755
4706 1 19 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.830 -0.102 25755
4707 1 19 . 1 1 4 4 CYS CA C 4 57.415 57.415 57.477 -0.062 25755
4708 1 19 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.353 12.490 25755
4709 1 19 . 1 1 4 4 CYS H H 4 8.486 8.486 7.963 0.523 25755
4710 1 19 . 1 1 5 5 LYS N N 5 118.790 118.790 120.939 -2.149 25755
4711 1 19 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.890 0.681 25755
4712 1 19 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.521 -0.231 25755
4713 1 19 . 1 1 5 5 LYS CB C 5 34.606 34.606 35.289 -0.683 25755
4714 1 19 . 1 1 5 5 LYS H H 5 8.007 8.007 8.334 -0.327 25755
4715 1 19 . 1 1 6 6 LYS N N 6 121.177 121.177 120.460 0.717 25755
4716 1 19 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.575 0.210 25755
4717 1 19 . 1 1 6 6 LYS CA C 6 55.542 55.542 55.914 -0.372 25755
4718 1 19 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.529 1.373 25755
4719 1 19 . 1 1 6 6 LYS H H 6 9.014 9.014 8.781 0.233 25755
4720 1 19 . 1 1 7 7 VAL N N 7 127.629 127.629 123.650 3.979 25755
4721 1 19 . 1 1 7 7 VAL HA H 7 4.026 4.026 3.980 0.046 25755
4722 1 19 . 1 1 7 7 VAL CA C 7 63.988 63.988 62.420 1.568 25755
4723 1 19 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.977 0.130 25755
4724 1 19 . 1 1 7 7 VAL H H 7 8.837 8.837 8.538 0.299 25755
4725 1 19 . 1 1 8 8 TYR N N 8 130.003 130.003 128.389 1.614 25755
4726 1 19 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.720 -0.261 25755
4727 1 19 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.093 0.627 25755
4728 1 19 . 1 1 8 8 TYR CB C 8 36.018 36.018 37.393 -1.375 25755
4729 1 19 . 1 1 8 8 TYR H H 8 9.251 9.251 8.168 1.083 25755
4730 1 19 . 1 1 9 9 GLU N N 9 130.851 130.851 123.599 7.252 25755
4731 1 19 . 1 1 9 9 GLU HA H 9 4.204 4.204 4.387 -0.183 25755
4732 1 19 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.997 -0.480 25755
4733 1 19 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.786 -0.395 25755
4734 1 19 . 1 1 9 9 GLU H H 9 9.072 9.072 8.324 0.748 25755
4735 1 19 . 1 1 10 10 ASN N N 10 116.120 116.120 118.456 -2.336 25755
4736 1 19 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.846 -0.408 25755
4737 1 19 . 1 1 10 10 ASN CA C 10 54.587 54.587 53.082 1.505 25755
4738 1 19 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.605 -0.327 25755
4739 1 19 . 1 1 10 10 ASN H H 10 9.301 9.301 8.630 0.671 25755
4740 1 19 . 1 1 11 11 TYR N N 11 122.436 122.436 122.134 0.302 25755
4741 1 19 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.389 -0.195 25755
4742 1 19 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.373 2.239 25755
4743 1 19 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.485 -2.018 25755
4744 1 19 . 1 1 11 11 TYR H H 11 7.550 7.550 7.601 -0.051 25755
4745 1 19 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.530 -0.083 25755
4746 1 19 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.612 -0.114 25755
4747 1 19 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.719 -2.128 25755
4748 1 19 . 1 1 13 13 VAL N N 13 124.506 124.506 122.219 2.287 25755
4749 1 19 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.814 0.022 25755
4750 1 19 . 1 1 13 13 VAL CA C 13 65.761 65.761 64.883 0.878 25755
4751 1 19 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.667 -0.087 25755
4752 1 19 . 1 1 13 13 VAL H H 13 8.169 8.169 8.369 -0.200 25755
4753 1 19 . 1 1 14 14 SER N N 14 116.625 116.625 116.343 0.282 25755
4754 1 19 . 1 1 14 14 SER HA H 14 4.206 4.206 4.186 0.020 25755
4755 1 19 . 1 1 14 14 SER CA C 14 61.194 61.194 61.714 -0.520 25755
4756 1 19 . 1 1 14 14 SER CB C 14 62.041 62.041 62.350 -0.309 25755
4757 1 19 . 1 1 14 14 SER H H 14 8.396 8.396 8.286 0.110 25755
4758 1 19 . 1 1 15 15 LYS N N 15 120.843 120.843 121.801 -0.958 25755
4759 1 19 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.006 0.194 25755
4760 1 19 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.382 0.241 25755
4761 1 19 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.200 -0.014 25755
4762 1 19 . 1 1 15 15 LYS H H 15 7.791 7.791 7.884 -0.093 25755
4763 1 19 . 1 1 16 16 CYS N N 16 115.949 115.949 116.518 -0.569 25755
4764 1 19 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.531 0.362 25755
4765 1 19 . 1 1 16 16 CYS CA C 16 56.570 56.570 60.847 -4.277 25755
4766 1 19 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.428 15.009 25755
4767 1 19 . 1 1 16 16 CYS H H 16 7.870 7.870 7.602 0.268 25755
4768 1 19 . 1 1 17 17 GLN N N 17 117.241 117.241 116.907 0.334 25755
4769 1 19 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.213 0.061 25755
4770 1 19 . 1 1 17 17 GLN CA C 17 56.937 56.937 56.420 0.517 25755
4771 1 19 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.765 0.422 25755
4772 1 19 . 1 1 17 17 GLN H H 17 7.560 7.560 7.645 -0.085 25755
4773 1 19 . 1 1 18 18 LEU N N 18 120.537 120.537 122.274 -1.737 25755
4774 1 19 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.220 0.220 25755
4775 1 19 . 1 1 18 18 LEU CA C 18 55.448 55.448 54.879 0.569 25755
4776 1 19 . 1 1 18 18 LEU CB C 18 41.837 41.837 40.766 1.071 25755
4777 1 19 . 1 1 18 18 LEU H H 18 7.369 7.369 7.517 -0.148 25755
4778 1 19 . 1 1 19 19 ARG N N 19 121.697 121.697 123.067 -1.370 25755
4779 1 19 . 1 1 19 19 ARG HA H 19 4.299 4.299 4.008 0.291 25755
4780 1 19 . 1 1 19 19 ARG CA C 19 57.836 57.836 58.698 -0.862 25755
4781 1 19 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.035 0.357 25755
4782 1 19 . 1 1 19 19 ARG H H 19 8.447 8.447 8.086 0.361 25755
4783 1 19 . 1 1 20 20 ILE N N 20 116.439 116.439 116.166 0.273 25755
4784 1 19 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.052 0.082 25755
4785 1 19 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.414 0.083 25755
4786 1 19 . 1 1 20 20 ILE CB C 20 38.164 38.164 38.172 -0.008 25755
4787 1 19 . 1 1 20 20 ILE H H 20 7.758 7.758 7.768 -0.010 25755
4788 1 19 . 1 1 21 21 ALA N N 21 122.642 122.642 122.871 -0.229 25755
4789 1 19 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.571 -0.189 25755
4790 1 19 . 1 1 21 21 ALA CA C 21 52.395 52.395 51.692 0.703 25755
4791 1 19 . 1 1 21 21 ALA CB C 21 20.098 20.098 19.822 0.276 25755
4792 1 19 . 1 1 21 21 ALA H H 21 7.727 7.727 7.459 0.268 25755
4793 1 19 . 1 1 22 22 ASN N N 22 116.616 116.616 121.952 -5.336 25755
4794 1 19 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.669 0.122 25755
4795 1 19 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.554 0.323 25755
4796 1 19 . 1 1 22 22 ASN CB C 22 37.554 37.554 37.965 -0.411 25755
4797 1 19 . 1 1 22 22 ASN H H 22 8.307 8.307 8.547 -0.240 25755
4798 1 19 . 1 1 23 23 GLN N N 23 124.357 124.357 123.699 0.658 25755
4799 1 19 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.287 -0.269 25755
4800 1 19 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.463 1.185 25755
4801 1 19 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.690 0.709 25755
4802 1 19 . 1 1 23 23 GLN H H 23 8.542 8.542 8.253 0.289 25755
4803 1 19 . 1 1 24 24 CYS N N 24 118.909 118.909 118.904 0.005 25755
4804 1 19 . 1 1 24 24 CYS HA H 24 4.284 4.284 4.250 0.034 25755
4805 1 19 . 1 1 24 24 CYS CA C 24 58.406 58.406 62.287 -3.881 25755
4806 1 19 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.844 11.932 25755
4807 1 19 . 1 1 24 24 CYS H H 24 8.352 8.352 8.480 -0.128 25755
4808 1 19 . 1 1 25 25 ASN N N 25 118.182 118.182 119.126 -0.944 25755
4809 1 19 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.278 -0.390 25755
4810 1 19 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.486 1.185 25755
4811 1 19 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.278 2.495 25755
4812 1 19 . 1 1 25 25 ASN H H 25 7.504 7.504 8.461 -0.957 25755
4813 1 19 . 1 1 26 26 TYR N N 26 117.354 117.354 119.314 -1.960 25755
4814 1 19 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.182 -0.217 25755
4815 1 19 . 1 1 26 26 TYR CA C 26 62.162 62.162 61.949 0.213 25755
4816 1 19 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.916 -0.286 25755
4817 1 19 . 1 1 26 26 TYR H H 26 7.322 7.322 7.571 -0.249 25755
4818 1 19 . 1 1 27 27 ASP N N 27 119.874 119.874 120.195 -0.321 25755
4819 1 19 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.443 0.212 25755
4820 1 19 . 1 1 27 27 ASP CB C 27 40.590 40.590 41.182 -0.592 25755
4821 1 19 . 1 1 27 27 ASP H H 27 9.218 9.218 8.308 0.910 25755
4822 1 19 . 1 1 28 28 CYS N N 28 119.782 119.782 118.945 0.837 25755
4823 1 19 . 1 1 28 28 CYS HA H 28 4.168 4.168 4.117 0.051 25755
4824 1 19 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.583 -1.669 25755
4825 1 19 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.418 10.527 25755
4826 1 19 . 1 1 28 28 CYS H H 28 9.171 9.171 8.478 0.693 25755
4827 1 19 . 1 1 29 29 LYS N N 29 119.663 119.663 119.127 0.536 25755
4828 1 19 . 1 1 29 29 LYS HA H 29 4.137 4.137 3.933 0.204 25755
4829 1 19 . 1 1 29 29 LYS CA C 29 59.781 59.781 59.027 0.754 25755
4830 1 19 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.804 0.609 25755
4831 1 19 . 1 1 29 29 LYS H H 29 7.546 7.546 7.493 0.053 25755
4832 1 19 . 1 1 30 30 LEU N N 30 119.987 119.987 120.049 -0.062 25755
4833 1 19 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.825 0.286 25755
4834 1 19 . 1 1 30 30 LEU CA C 30 57.672 57.672 57.666 0.006 25755
4835 1 19 . 1 1 30 30 LEU CB C 30 42.379 42.379 42.257 0.122 25755
4836 1 19 . 1 1 30 30 LEU H H 30 8.226 8.226 7.698 0.528 25755
4837 1 19 . 1 1 31 31 ASP N N 31 116.853 116.853 116.114 0.739 25755
4838 1 19 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.615 -0.069 25755
4839 1 19 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.718 0.548 25755
4840 1 19 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.872 -1.394 25755
4841 1 19 . 1 1 31 31 ASP H H 31 9.019 9.019 7.804 1.215 25755
4842 1 19 . 1 1 32 32 LYS N N 32 112.075 112.075 118.590 -6.515 25755
4843 1 19 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.159 0.390 25755
4844 1 19 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.755 -4.290 25755
4845 1 19 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.496 -0.631 25755
4846 1 19 . 1 1 32 32 LYS H H 32 6.639 6.639 8.400 -1.761 25755
4847 1 19 . 1 1 33 33 HIS N N 33 112.955 112.955 113.887 -0.932 25755
4848 1 19 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.164 0.459 25755
4849 1 19 . 1 1 33 33 HIS CA C 33 56.486 56.486 55.482 1.004 25755
4850 1 19 . 1 1 33 33 HIS CB C 33 25.694 25.694 28.389 -2.695 25755
4851 1 19 . 1 1 33 33 HIS H H 33 7.065 7.065 8.005 -0.940 25755
4852 1 19 . 1 1 34 34 ALA N N 34 120.177 120.177 119.193 0.984 25755
4853 1 19 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.695 0.454 25755
4854 1 19 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.486 -1.708 25755
4855 1 19 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.515 -0.397 25755
4856 1 19 . 1 1 34 34 ALA H H 34 7.716 7.716 7.160 0.556 25755
4857 1 19 . 1 1 35 35 ARG N N 35 116.636 116.636 117.920 -1.284 25755
4858 1 19 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.172 0.034 25755
4859 1 19 . 1 1 35 35 ARG CA C 35 58.076 58.076 58.043 0.033 25755
4860 1 19 . 1 1 35 35 ARG CB C 35 30.717 30.717 29.992 0.725 25755
4861 1 19 . 1 1 35 35 ARG H H 35 8.295 8.295 8.003 0.292 25755
4862 1 19 . 1 1 36 36 SER N N 36 109.273 109.273 113.194 -3.921 25755
4863 1 19 . 1 1 36 36 SER HA H 36 4.646 4.646 4.451 0.195 25755
4864 1 19 . 1 1 36 36 SER CA C 36 57.703 57.703 57.973 -0.270 25755
4865 1 19 . 1 1 36 36 SER CB C 36 65.425 65.425 64.682 0.743 25755
4866 1 19 . 1 1 36 36 SER H H 36 8.026 8.026 7.874 0.152 25755
4867 1 19 . 1 1 37 37 GLY N N 37 107.305 107.305 109.880 -2.575 25755
4868 1 19 . 1 1 37 37 GLY CA C 37 47.152 47.152 45.030 2.122 25755
4869 1 19 . 1 1 37 37 GLY H H 37 8.679 8.679 7.886 0.793 25755
4870 1 19 . 1 1 38 38 GLU N N 38 119.065 119.065 122.292 -3.227 25755
4871 1 19 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.557 -0.155 25755
4872 1 19 . 1 1 38 38 GLU CA C 38 55.773 55.773 54.802 0.971 25755
4873 1 19 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.921 -2.099 25755
4874 1 19 . 1 1 38 38 GLU H H 38 8.351 8.351 8.865 -0.514 25755
4875 1 19 . 1 1 39 39 CYS N N 39 121.636 121.636 118.376 3.260 25755
4876 1 19 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.335 0.652 25755
4877 1 19 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.614 -0.886 25755
4878 1 19 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.629 16.390 25755
4879 1 19 . 1 1 39 39 CYS H H 39 8.839 8.839 8.244 0.595 25755
4880 1 19 . 1 1 40 40 PHE N N 40 121.987 121.987 120.200 1.787 25755
4881 1 19 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.824 -0.054 25755
4882 1 19 . 1 1 40 40 PHE CA C 40 56.969 56.969 56.577 0.392 25755
4883 1 19 . 1 1 40 40 PHE CB C 40 43.760 43.760 42.843 0.916 25755
4884 1 19 . 1 1 40 40 PHE H H 40 9.214 9.214 8.873 0.341 25755
4885 1 19 . 1 1 41 41 TYR N N 41 121.905 121.905 118.777 3.128 25755
4886 1 19 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.589 0.371 25755
4887 1 19 . 1 1 41 41 TYR CA C 41 58.532 58.532 59.302 -0.770 25755
4888 1 19 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.204 1.098 25755
4889 1 19 . 1 1 41 41 TYR H H 41 8.557 8.557 8.757 -0.200 25755
4890 1 19 . 1 1 42 42 ASP N N 42 123.133 123.133 121.362 1.771 25755
4891 1 19 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.873 -0.120 25755
4892 1 19 . 1 1 42 42 ASP CA C 42 52.426 52.426 52.759 -0.333 25755
4893 1 19 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.987 -1.367 25755
4894 1 19 . 1 1 42 42 ASP H H 42 8.603 8.603 8.410 0.193 25755
4895 1 19 . 1 1 43 43 GLU N N 43 118.012 118.012 118.882 -0.870 25755
4896 1 19 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.135 0.074 25755
4897 1 19 . 1 1 43 43 GLU CA C 43 58.865 58.865 58.695 0.170 25755
4898 1 19 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.604 -0.367 25755
4899 1 19 . 1 1 43 43 GLU H H 43 9.081 9.081 8.770 0.311 25755
4900 1 19 . 1 1 44 44 LYS N N 44 120.047 120.047 117.543 2.504 25755
4901 1 19 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.367 0.077 25755
4902 1 19 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.475 0.186 25755
4903 1 19 . 1 1 44 44 LYS CB C 44 32.039 32.039 32.356 -0.317 25755
4904 1 19 . 1 1 44 44 LYS H H 44 8.162 8.162 8.108 0.054 25755
4905 1 19 . 1 1 45 45 ARG N N 45 113.453 113.453 116.284 -2.831 25755
4906 1 19 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.140 -0.477 25755
4907 1 19 . 1 1 45 45 ARG CA C 45 57.736 57.736 56.584 1.152 25755
4908 1 19 . 1 1 45 45 ARG CB C 45 26.390 26.390 27.348 -0.958 25755
4909 1 19 . 1 1 45 45 ARG H H 45 8.335 8.335 7.793 0.542 25755
4910 1 19 . 1 1 46 46 ASN N N 46 118.207 118.207 117.149 1.058 25755
4911 1 19 . 1 1 46 46 ASN HA H 46 4.982 4.982 4.946 0.036 25755
4912 1 19 . 1 1 46 46 ASN CA C 46 53.066 53.066 51.847 1.219 25755
4913 1 19 . 1 1 46 46 ASN CB C 46 39.293 39.293 39.188 0.105 25755
4914 1 19 . 1 1 46 46 ASN H H 46 8.745 8.745 8.273 0.472 25755
4915 1 19 . 1 1 47 47 LEU N N 47 125.815 125.815 127.018 -1.203 25755
4916 1 19 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.026 0.253 25755
4917 1 19 . 1 1 47 47 LEU CA C 47 55.290 55.290 55.256 0.034 25755
4918 1 19 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.745 1.561 25755
4919 1 19 . 1 1 47 47 LEU H H 47 8.509 8.509 8.859 -0.350 25755
4920 1 19 . 1 1 48 48 GLN N N 48 120.834 120.834 121.759 -0.925 25755
4921 1 19 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.708 0.028 25755
4922 1 19 . 1 1 48 48 GLN CA C 48 54.105 54.105 53.566 0.539 25755
4923 1 19 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.776 -0.909 25755
4924 1 19 . 1 1 48 48 GLN H H 48 8.589 8.589 8.919 -0.330 25755
4925 1 19 . 1 1 49 49 CYS N N 49 121.829 121.829 123.426 -1.597 25755
4926 1 19 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.484 0.374 25755
4927 1 19 . 1 1 49 49 CYS CA C 49 54.955 54.955 58.723 -3.768 25755
4928 1 19 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.259 13.186 25755
4929 1 19 . 1 1 49 49 CYS H H 49 9.247 9.247 9.016 0.231 25755
4930 1 19 . 1 1 50 50 ILE N N 50 129.010 129.010 129.158 -0.148 25755
4931 1 19 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.315 0.071 25755
4932 1 19 . 1 1 50 50 ILE CA C 50 60.421 60.421 62.177 -1.756 25755
4933 1 19 . 1 1 50 50 ILE CB C 50 38.404 38.404 38.622 -0.218 25755
4934 1 19 . 1 1 50 50 ILE H H 50 8.787 8.787 7.853 0.934 25755
4935 1 19 . 1 1 51 51 CYS N N 51 126.108 126.108 127.419 -1.311 25755
4936 1 19 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.613 0.724 25755
4937 1 19 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.811 -6.993 25755
4938 1 19 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.521 6.461 25755
4939 1 19 . 1 1 51 51 CYS H H 51 8.556 8.556 9.308 -0.752 25755
4940 1 19 . 1 1 52 52 ASP N N 52 122.342 122.342 119.982 2.360 25755
4941 1 19 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.986 0.527 25755
4942 1 19 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.541 -0.958 25755
4943 1 19 . 1 1 52 52 ASP CB C 52 42.831 42.831 42.495 0.336 25755
4944 1 19 . 1 1 52 52 ASP H H 52 8.826 8.826 8.481 0.345 25755
4945 1 19 . 1 1 53 53 TYR N N 53 125.370 125.370 124.684 0.686 25755
4946 1 19 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.573 -0.315 25755
4947 1 19 . 1 1 53 53 TYR CA C 53 59.665 59.665 59.010 0.655 25755
4948 1 19 . 1 1 53 53 TYR CB C 53 38.783 38.783 39.422 -0.638 25755
4949 1 19 . 1 1 53 53 TYR H H 53 9.734 9.734 8.733 1.001 25755
4950 1 19 . 1 1 54 54 CYS N N 54 120.418 120.418 121.264 -0.846 25755
4951 1 19 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.515 -0.021 25755
4952 1 19 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.409 -4.266 25755
4953 1 19 . 1 1 54 54 CYS CB C 54 44.382 44.382 29.027 15.355 25755
4954 1 19 . 1 1 54 54 CYS H H 54 9.478 9.478 8.820 0.658 25755
4955 1 19 . 1 1 55 55 GLU N N 55 121.097 121.097 118.982 2.115 25755
4956 1 19 . 1 1 55 55 GLU HA H 55 4.312 4.312 3.859 0.453 25755
4957 1 19 . 1 1 55 55 GLU CA C 55 56.010 56.010 57.216 -1.206 25755
4958 1 19 . 1 1 55 55 GLU CB C 55 31.014 31.014 29.880 1.134 25755
4959 1 19 . 1 1 55 55 GLU H H 55 8.423 8.423 8.303 0.120 25755
4960 1 20 . 1 1 2 2 ASP HA H 2 4.251 4.251 4.385 -0.134 25755
4961 1 20 . 1 1 2 2 ASP CA C 2 59.484 59.484 55.144 4.340 25755
4962 1 20 . 1 1 2 2 ASP CB C 2 39.412 39.412 40.289 -0.877 25755
4963 1 20 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.352 -0.007 25755
4964 1 20 . 1 1 3 3 LYS CA C 3 57.556 57.556 56.398 1.157 25755
4965 1 20 . 1 1 3 3 LYS CB C 3 32.593 32.593 32.244 0.349 25755
4966 1 20 . 1 1 4 4 CYS N N 4 117.049 117.049 118.201 -1.152 25755
4967 1 20 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.883 -0.155 25755
4968 1 20 . 1 1 4 4 CYS CA C 4 57.415 57.415 57.014 0.401 25755
4969 1 20 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.628 12.215 25755
4970 1 20 . 1 1 4 4 CYS H H 4 8.486 8.486 7.986 0.500 25755
4971 1 20 . 1 1 5 5 LYS N N 5 118.790 118.790 121.038 -2.248 25755
4972 1 20 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.793 0.778 25755
4973 1 20 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.787 -0.497 25755
4974 1 20 . 1 1 5 5 LYS CB C 5 34.606 34.606 34.714 -0.108 25755
4975 1 20 . 1 1 5 5 LYS H H 5 8.007 8.007 8.244 -0.237 25755
4976 1 20 . 1 1 6 6 LYS N N 6 121.177 121.177 120.848 0.329 25755
4977 1 20 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.597 0.188 25755
4978 1 20 . 1 1 6 6 LYS CA C 6 55.542 55.542 55.857 -0.315 25755
4979 1 20 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.370 1.532 25755
4980 1 20 . 1 1 6 6 LYS H H 6 9.014 9.014 8.848 0.166 25755
4981 1 20 . 1 1 7 7 VAL N N 7 127.629 127.629 124.441 3.188 25755
4982 1 20 . 1 1 7 7 VAL HA H 7 4.026 4.026 4.004 0.022 25755
4983 1 20 . 1 1 7 7 VAL CA C 7 63.988 63.988 63.174 0.814 25755
4984 1 20 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.068 1.039 25755
4985 1 20 . 1 1 7 7 VAL H H 7 8.837 8.837 8.641 0.196 25755
4986 1 20 . 1 1 8 8 TYR N N 8 130.003 130.003 129.070 0.933 25755
4987 1 20 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.714 -0.255 25755
4988 1 20 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.389 0.331 25755
4989 1 20 . 1 1 8 8 TYR CB C 8 36.018 36.018 37.837 -1.819 25755
4990 1 20 . 1 1 8 8 TYR H H 8 9.251 9.251 8.245 1.006 25755
4991 1 20 . 1 1 9 9 GLU N N 9 130.851 130.851 125.002 5.849 25755
4992 1 20 . 1 1 9 9 GLU HA H 9 4.204 4.204 4.022 0.182 25755
4993 1 20 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.739 -0.222 25755
4994 1 20 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.455 -0.064 25755
4995 1 20 . 1 1 9 9 GLU H H 9 9.072 9.072 8.499 0.573 25755
4996 1 20 . 1 1 10 10 ASN N N 10 116.120 116.120 118.091 -1.971 25755
4997 1 20 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.578 -0.140 25755
4998 1 20 . 1 1 10 10 ASN CA C 10 54.587 54.587 52.564 2.023 25755
4999 1 20 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.460 -0.182 25755
5000 1 20 . 1 1 10 10 ASN H H 10 9.301 9.301 7.753 1.548 25755
5001 1 20 . 1 1 11 11 TYR N N 11 122.436 122.436 119.974 2.462 25755
5002 1 20 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.591 -0.398 25755
5003 1 20 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.321 2.291 25755
5004 1 20 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.820 -2.353 25755
5005 1 20 . 1 1 11 11 TYR H H 11 7.550 7.550 7.448 0.102 25755
5006 1 20 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.571 -0.124 25755
5007 1 20 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.581 -0.083 25755
5008 1 20 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.893 -2.302 25755
5009 1 20 . 1 1 13 13 VAL N N 13 124.506 124.506 120.777 3.729 25755
5010 1 20 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.729 0.107 25755
5011 1 20 . 1 1 13 13 VAL CA C 13 65.761 65.761 64.729 1.032 25755
5012 1 20 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.722 -0.142 25755
5013 1 20 . 1 1 13 13 VAL H H 13 8.169 8.169 8.412 -0.243 25755
5014 1 20 . 1 1 14 14 SER N N 14 116.625 116.625 116.443 0.182 25755
5015 1 20 . 1 1 14 14 SER HA H 14 4.206 4.206 4.212 -0.006 25755
5016 1 20 . 1 1 14 14 SER CA C 14 61.194 61.194 61.703 -0.508 25755
5017 1 20 . 1 1 14 14 SER CB C 14 62.041 62.041 62.526 -0.485 25755
5018 1 20 . 1 1 14 14 SER H H 14 8.396 8.396 8.210 0.186 25755
5019 1 20 . 1 1 15 15 LYS N N 15 120.843 120.843 122.110 -1.267 25755
5020 1 20 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.001 0.199 25755
5021 1 20 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.272 0.351 25755
5022 1 20 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.031 0.155 25755
5023 1 20 . 1 1 15 15 LYS H H 15 7.791 7.791 7.641 0.150 25755
5024 1 20 . 1 1 16 16 CYS N N 16 115.949 115.949 115.510 0.439 25755
5025 1 20 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.565 0.328 25755
5026 1 20 . 1 1 16 16 CYS CA C 16 56.570 56.570 60.800 -4.230 25755
5027 1 20 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.460 14.977 25755
5028 1 20 . 1 1 16 16 CYS H H 16 7.870 7.870 7.508 0.362 25755
5029 1 20 . 1 1 17 17 GLN N N 17 117.241 117.241 117.163 0.078 25755
5030 1 20 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.241 0.033 25755
5031 1 20 . 1 1 17 17 GLN CA C 17 56.937 56.937 56.139 0.798 25755
5032 1 20 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.917 0.270 25755
5033 1 20 . 1 1 17 17 GLN H H 17 7.560 7.560 7.636 -0.076 25755
5034 1 20 . 1 1 18 18 LEU N N 18 120.537 120.537 122.560 -2.023 25755
5035 1 20 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.162 0.278 25755
5036 1 20 . 1 1 18 18 LEU CA C 18 55.448 55.448 55.315 0.134 25755
5037 1 20 . 1 1 18 18 LEU CB C 18 41.837 41.837 40.987 0.850 25755
5038 1 20 . 1 1 18 18 LEU H H 18 7.369 7.369 7.434 -0.065 25755
5039 1 20 . 1 1 19 19 ARG N N 19 121.697 121.697 122.607 -0.910 25755
5040 1 20 . 1 1 19 19 ARG HA H 19 4.299 4.299 4.027 0.272 25755
5041 1 20 . 1 1 19 19 ARG CA C 19 57.836 57.836 58.285 -0.449 25755
5042 1 20 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.180 0.212 25755
5043 1 20 . 1 1 19 19 ARG H H 19 8.447 8.447 7.948 0.499 25755
5044 1 20 . 1 1 20 20 ILE N N 20 116.439 116.439 116.684 -0.245 25755
5045 1 20 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.055 0.079 25755
5046 1 20 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.445 0.052 25755
5047 1 20 . 1 1 20 20 ILE CB C 20 38.164 38.164 38.204 -0.040 25755
5048 1 20 . 1 1 20 20 ILE H H 20 7.758 7.758 7.781 -0.023 25755
5049 1 20 . 1 1 21 21 ALA N N 21 122.642 122.642 122.937 -0.295 25755
5050 1 20 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.596 -0.214 25755
5051 1 20 . 1 1 21 21 ALA CA C 21 52.395 52.395 51.560 0.835 25755
5052 1 20 . 1 1 21 21 ALA CB C 21 20.098 20.098 19.775 0.323 25755
5053 1 20 . 1 1 21 21 ALA H H 21 7.727 7.727 7.217 0.510 25755
5054 1 20 . 1 1 22 22 ASN N N 22 116.616 116.616 121.444 -4.828 25755
5055 1 20 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.945 -0.154 25755
5056 1 20 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.339 0.538 25755
5057 1 20 . 1 1 22 22 ASN CB C 22 37.554 37.554 37.993 -0.439 25755
5058 1 20 . 1 1 22 22 ASN H H 22 8.307 8.307 8.563 -0.256 25755
5059 1 20 . 1 1 23 23 GLN N N 23 124.357 124.357 123.551 0.806 25755
5060 1 20 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.368 -0.350 25755
5061 1 20 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.781 0.867 25755
5062 1 20 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.375 1.024 25755
5063 1 20 . 1 1 23 23 GLN H H 23 8.542 8.542 8.269 0.273 25755
5064 1 20 . 1 1 24 24 CYS N N 24 118.909 118.909 119.660 -0.751 25755
5065 1 20 . 1 1 24 24 CYS HA H 24 4.284 4.284 4.105 0.179 25755
5066 1 20 . 1 1 24 24 CYS CA C 24 58.406 58.406 62.843 -4.438 25755
5067 1 20 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.762 12.014 25755
5068 1 20 . 1 1 24 24 CYS H H 24 8.352 8.352 8.494 -0.142 25755
5069 1 20 . 1 1 25 25 ASN N N 25 118.182 118.182 118.492 -0.310 25755
5070 1 20 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.441 -0.553 25755
5071 1 20 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.394 1.278 25755
5072 1 20 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.479 2.294 25755
5073 1 20 . 1 1 25 25 ASN H H 25 7.504 7.504 8.392 -0.888 25755
5074 1 20 . 1 1 26 26 TYR N N 26 117.354 117.354 119.832 -2.478 25755
5075 1 20 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.221 -0.256 25755
5076 1 20 . 1 1 26 26 TYR CA C 26 62.162 62.162 60.424 1.738 25755
5077 1 20 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.647 -0.017 25755
5078 1 20 . 1 1 26 26 TYR H H 26 7.322 7.322 7.568 -0.246 25755
5079 1 20 . 1 1 27 27 ASP N N 27 119.874 119.874 120.267 -0.393 25755
5080 1 20 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.319 0.336 25755
5081 1 20 . 1 1 27 27 ASP CB C 27 40.590 40.590 40.699 -0.109 25755
5082 1 20 . 1 1 27 27 ASP H H 27 9.218 9.218 8.330 0.888 25755
5083 1 20 . 1 1 28 28 CYS N N 28 119.782 119.782 118.993 0.789 25755
5084 1 20 . 1 1 28 28 CYS HA H 28 4.168 4.168 3.907 0.261 25755
5085 1 20 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.652 -1.738 25755
5086 1 20 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.255 10.690 25755
5087 1 20 . 1 1 28 28 CYS H H 28 9.171 9.171 8.412 0.759 25755
5088 1 20 . 1 1 29 29 LYS N N 29 119.663 119.663 118.802 0.861 25755
5089 1 20 . 1 1 29 29 LYS HA H 29 4.137 4.137 3.908 0.229 25755
5090 1 20 . 1 1 29 29 LYS CA C 29 59.781 59.781 59.166 0.615 25755
5091 1 20 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.842 0.571 25755
5092 1 20 . 1 1 29 29 LYS H H 29 7.546 7.546 7.443 0.103 25755
5093 1 20 . 1 1 30 30 LEU N N 30 119.987 119.987 119.434 0.553 25755
5094 1 20 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.999 0.112 25755
5095 1 20 . 1 1 30 30 LEU CA C 30 57.672 57.672 58.340 -0.668 25755
5096 1 20 . 1 1 30 30 LEU CB C 30 42.379 42.379 42.155 0.224 25755
5097 1 20 . 1 1 30 30 LEU H H 30 8.226 8.226 7.735 0.491 25755
5098 1 20 . 1 1 31 31 ASP N N 31 116.853 116.853 116.295 0.558 25755
5099 1 20 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.640 -0.094 25755
5100 1 20 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.605 0.661 25755
5101 1 20 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.810 -1.333 25755
5102 1 20 . 1 1 31 31 ASP H H 31 9.019 9.019 7.783 1.236 25755
5103 1 20 . 1 1 32 32 LYS N N 32 112.075 112.075 118.795 -6.720 25755
5104 1 20 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.134 0.415 25755
5105 1 20 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.582 -4.117 25755
5106 1 20 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.464 -0.599 25755
5107 1 20 . 1 1 32 32 LYS H H 32 6.639 6.639 8.242 -1.603 25755
5108 1 20 . 1 1 33 33 HIS N N 33 112.955 112.955 113.726 -0.771 25755
5109 1 20 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.222 0.401 25755
5110 1 20 . 1 1 33 33 HIS CA C 33 56.486 56.486 56.334 0.152 25755
5111 1 20 . 1 1 33 33 HIS CB C 33 25.694 25.694 27.790 -2.096 25755
5112 1 20 . 1 1 33 33 HIS H H 33 7.065 7.065 7.994 -0.929 25755
5113 1 20 . 1 1 34 34 ALA N N 34 120.177 120.177 118.860 1.317 25755
5114 1 20 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.656 0.493 25755
5115 1 20 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.395 -1.616 25755
5116 1 20 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.562 -0.444 25755
5117 1 20 . 1 1 34 34 ALA H H 34 7.716 7.716 7.077 0.639 25755
5118 1 20 . 1 1 35 35 ARG N N 35 116.636 116.636 117.736 -1.100 25755
5119 1 20 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.079 0.127 25755
5120 1 20 . 1 1 35 35 ARG CA C 35 58.076 58.076 58.567 -0.491 25755
5121 1 20 . 1 1 35 35 ARG CB C 35 30.717 30.717 30.391 0.326 25755
5122 1 20 . 1 1 35 35 ARG H H 35 8.295 8.295 8.140 0.155 25755
5123 1 20 . 1 1 36 36 SER N N 36 109.273 109.273 111.747 -2.474 25755
5124 1 20 . 1 1 36 36 SER HA H 36 4.646 4.646 4.366 0.280 25755
5125 1 20 . 1 1 36 36 SER CA C 36 57.703 57.703 58.312 -0.609 25755
5126 1 20 . 1 1 36 36 SER CB C 36 65.425 65.425 65.575 -0.150 25755
5127 1 20 . 1 1 36 36 SER H H 36 8.026 8.026 8.253 -0.227 25755
5128 1 20 . 1 1 37 37 GLY N N 37 107.305 107.305 111.289 -3.984 25755
5129 1 20 . 1 1 37 37 GLY CA C 37 47.152 47.152 44.880 2.272 25755
5130 1 20 . 1 1 37 37 GLY H H 37 8.679 8.679 7.729 0.950 25755
5131 1 20 . 1 1 38 38 GLU N N 38 119.065 119.065 121.268 -2.203 25755
5132 1 20 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.779 -0.377 25755
5133 1 20 . 1 1 38 38 GLU CA C 38 55.773 55.773 55.296 0.477 25755
5134 1 20 . 1 1 38 38 GLU CB C 38 32.822 32.822 35.123 -2.301 25755
5135 1 20 . 1 1 38 38 GLU H H 38 8.351 8.351 8.728 -0.377 25755
5136 1 20 . 1 1 39 39 CYS N N 39 121.636 121.636 118.564 3.072 25755
5137 1 20 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.427 0.560 25755
5138 1 20 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.726 -0.998 25755
5139 1 20 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.866 16.153 25755
5140 1 20 . 1 1 39 39 CYS H H 39 8.839 8.839 8.244 0.595 25755
5141 1 20 . 1 1 40 40 PHE N N 40 121.987 121.987 120.128 1.859 25755
5142 1 20 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.832 -0.062 25755
5143 1 20 . 1 1 40 40 PHE CA C 40 56.969 56.969 56.507 0.462 25755
5144 1 20 . 1 1 40 40 PHE CB C 40 43.760 43.760 42.874 0.886 25755
5145 1 20 . 1 1 40 40 PHE H H 40 9.214 9.214 8.883 0.331 25755
5146 1 20 . 1 1 41 41 TYR N N 41 121.905 121.905 118.598 3.307 25755
5147 1 20 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.616 0.344 25755
5148 1 20 . 1 1 41 41 TYR CA C 41 58.532 58.532 59.162 -0.630 25755
5149 1 20 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.287 1.015 25755
5150 1 20 . 1 1 41 41 TYR H H 41 8.557 8.557 8.723 -0.166 25755
5151 1 20 . 1 1 42 42 ASP N N 42 123.133 123.133 121.305 1.828 25755
5152 1 20 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.868 -0.115 25755
5153 1 20 . 1 1 42 42 ASP CA C 42 52.426 52.426 52.978 -0.552 25755
5154 1 20 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.968 -1.348 25755
5155 1 20 . 1 1 42 42 ASP H H 42 8.603 8.603 8.295 0.308 25755
5156 1 20 . 1 1 43 43 GLU N N 43 118.012 118.012 119.790 -1.778 25755
5157 1 20 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.173 0.036 25755
5158 1 20 . 1 1 43 43 GLU CA C 43 58.865 58.865 58.611 0.254 25755
5159 1 20 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.636 -0.399 25755
5160 1 20 . 1 1 43 43 GLU H H 43 9.081 9.081 8.749 0.332 25755
5161 1 20 . 1 1 44 44 LYS N N 44 120.047 120.047 117.598 2.449 25755
5162 1 20 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.424 0.020 25755
5163 1 20 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.546 0.115 25755
5164 1 20 . 1 1 44 44 LYS CB C 44 32.039 32.039 32.623 -0.584 25755
5165 1 20 . 1 1 44 44 LYS H H 44 8.162 8.162 7.910 0.252 25755
5166 1 20 . 1 1 45 45 ARG N N 45 113.453 113.453 116.562 -3.109 25755
5167 1 20 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.123 -0.460 25755
5168 1 20 . 1 1 45 45 ARG CA C 45 57.736 57.736 56.732 1.004 25755
5169 1 20 . 1 1 45 45 ARG CB C 45 26.390 26.390 27.599 -1.209 25755
5170 1 20 . 1 1 45 45 ARG H H 45 8.335 8.335 7.761 0.574 25755
5171 1 20 . 1 1 46 46 ASN N N 46 118.207 118.207 117.269 0.938 25755
5172 1 20 . 1 1 46 46 ASN HA H 46 4.982 4.982 4.947 0.035 25755
5173 1 20 . 1 1 46 46 ASN CA C 46 53.066 53.066 51.914 1.152 25755
5174 1 20 . 1 1 46 46 ASN CB C 46 39.293 39.293 39.025 0.268 25755
5175 1 20 . 1 1 46 46 ASN H H 46 8.745 8.745 8.283 0.462 25755
5176 1 20 . 1 1 47 47 LEU N N 47 125.815 125.815 126.819 -1.004 25755
5177 1 20 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.018 0.262 25755
5178 1 20 . 1 1 47 47 LEU CA C 47 55.290 55.290 54.980 0.310 25755
5179 1 20 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.760 1.546 25755
5180 1 20 . 1 1 47 47 LEU H H 47 8.509 8.509 8.762 -0.253 25755
5181 1 20 . 1 1 48 48 GLN N N 48 120.834 120.834 122.443 -1.609 25755
5182 1 20 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.704 0.032 25755
5183 1 20 . 1 1 48 48 GLN CA C 48 54.105 54.105 53.952 0.153 25755
5184 1 20 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.871 -1.005 25755
5185 1 20 . 1 1 48 48 GLN H H 48 8.589 8.589 9.026 -0.437 25755
5186 1 20 . 1 1 49 49 CYS N N 49 121.829 121.829 122.810 -0.981 25755
5187 1 20 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.675 0.183 25755
5188 1 20 . 1 1 49 49 CYS CA C 49 54.955 54.955 58.303 -3.348 25755
5189 1 20 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.591 12.854 25755
5190 1 20 . 1 1 49 49 CYS H H 49 9.247 9.247 8.947 0.300 25755
5191 1 20 . 1 1 50 50 ILE N N 50 129.010 129.010 130.285 -1.275 25755
5192 1 20 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.424 -0.038 25755
5193 1 20 . 1 1 50 50 ILE CA C 50 60.421 60.421 62.079 -1.658 25755
5194 1 20 . 1 1 50 50 ILE CB C 50 38.404 38.404 38.819 -0.415 25755
5195 1 20 . 1 1 50 50 ILE H H 50 8.787 8.787 7.972 0.815 25755
5196 1 20 . 1 1 51 51 CYS N N 51 126.108 126.108 127.318 -1.210 25755
5197 1 20 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.637 0.700 25755
5198 1 20 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.626 -6.808 25755
5199 1 20 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.483 6.499 25755
5200 1 20 . 1 1 51 51 CYS H H 51 8.556 8.556 9.317 -0.761 25755
5201 1 20 . 1 1 52 52 ASP N N 52 122.342 122.342 120.296 2.046 25755
5202 1 20 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.815 0.698 25755
5203 1 20 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.917 -1.335 25755
5204 1 20 . 1 1 52 52 ASP CB C 52 42.831 42.831 42.882 -0.051 25755
5205 1 20 . 1 1 52 52 ASP H H 52 8.826 8.826 8.501 0.325 25755
5206 1 20 . 1 1 53 53 TYR N N 53 125.370 125.370 124.868 0.502 25755
5207 1 20 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.606 -0.348 25755
5208 1 20 . 1 1 53 53 TYR CA C 53 59.665 59.665 59.033 0.632 25755
5209 1 20 . 1 1 53 53 TYR CB C 53 38.783 38.783 39.777 -0.994 25755
5210 1 20 . 1 1 53 53 TYR H H 53 9.734 9.734 8.747 0.987 25755
5211 1 20 . 1 1 54 54 CYS N N 54 120.418 120.418 122.661 -2.243 25755
5212 1 20 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.595 -0.101 25755
5213 1 20 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.143 -4.000 25755
5214 1 20 . 1 1 54 54 CYS CB C 54 44.382 44.382 29.213 15.168 25755
5215 1 20 . 1 1 54 54 CYS H H 54 9.478 9.478 8.856 0.622 25755
5216 1 20 . 1 1 55 55 GLU N N 55 121.097 121.097 118.877 2.220 25755
5217 1 20 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.110 0.202 25755
5218 1 20 . 1 1 55 55 GLU CA C 55 56.010 56.010 57.386 -1.376 25755
5219 1 20 . 1 1 55 55 GLU CB C 55 31.014 31.014 29.991 1.023 25755
5220 1 20 . 1 1 55 55 GLU H H 55 8.423 8.423 8.433 -0.010 25755
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 51 2.103 0.169 2.117 25755
2 1 1 "Average Difference" HA 55 0.337 -0.106 0.323 25755
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25755
4 1 1 "Average Difference" CA 53 1.952 0.245 1.955 25755
5 1 1 "Average Difference" CB 53 5.091 -1.773 4.818 25755
6 1 1 "Average Difference" HN 51 0.602 -0.181 0.580 25755
7 1 2 "Average Difference" N 51 2.165 0.246 2.173 25755
8 1 2 "Average Difference" HA 55 0.343 -0.106 0.329 25755
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25755
10 1 2 "Average Difference" CA 53 1.997 0.233 2.003 25755
11 1 2 "Average Difference" CB 53 5.149 -1.733 4.894 25755
12 1 2 "Average Difference" HN 51 0.616 -0.224 0.580 25755
13 1 3 "Average Difference" N 51 2.240 0.306 2.241 25755
14 1 3 "Average Difference" HA 55 0.357 -0.113 0.342 25755
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25755
16 1 3 "Average Difference" CA 53 2.022 0.324 2.015 25755
17 1 3 "Average Difference" CB 53 5.142 -1.814 4.858 25755
18 1 3 "Average Difference" HN 51 0.614 -0.191 0.589 25755
19 1 4 "Average Difference" N 51 2.190 0.210 2.201 25755
20 1 4 "Average Difference" HA 55 0.334 -0.096 0.322 25755
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25755
22 1 4 "Average Difference" CA 53 1.978 0.270 1.978 25755
23 1 4 "Average Difference" CB 53 5.118 -1.774 4.847 25755
24 1 4 "Average Difference" HN 51 0.600 -0.179 0.579 25755
25 1 5 "Average Difference" N 51 2.126 0.137 2.143 25755
26 1 5 "Average Difference" HA 55 0.348 -0.104 0.335 25755
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25755
28 1 5 "Average Difference" CA 53 2.000 0.208 2.008 25755
29 1 5 "Average Difference" CB 53 5.170 -1.761 4.908 25755
30 1 5 "Average Difference" HN 51 0.621 -0.185 0.598 25755
31 1 6 "Average Difference" N 51 2.149 0.190 2.162 25755
32 1 6 "Average Difference" HA 55 0.334 -0.104 0.321 25755
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25755
34 1 6 "Average Difference" CA 53 1.971 0.219 1.977 25755
35 1 6 "Average Difference" CB 53 5.109 -1.739 4.850 25755
36 1 6 "Average Difference" HN 51 0.620 -0.227 0.583 25755
37 1 7 "Average Difference" N 51 2.417 0.195 2.433 25755
38 1 7 "Average Difference" HA 55 0.343 -0.107 0.329 25755
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25755
40 1 7 "Average Difference" CA 53 1.994 0.307 1.989 25755
41 1 7 "Average Difference" CB 53 5.150 -1.806 4.869 25755
42 1 7 "Average Difference" HN 51 0.592 -0.193 0.565 25755
43 1 8 "Average Difference" N 51 2.244 0.036 2.266 25755
44 1 8 "Average Difference" HA 55 0.336 -0.092 0.326 25755
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25755
46 1 8 "Average Difference" CA 53 2.063 0.250 2.067 25755
47 1 8 "Average Difference" CB 53 5.181 -1.701 4.941 25755
48 1 8 "Average Difference" HN 51 0.615 -0.163 0.599 25755
49 1 9 "Average Difference" N 51 2.240 0.233 2.250 25755
50 1 9 "Average Difference" HA 55 0.351 -0.115 0.335 25755
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25755
52 1 9 "Average Difference" CA 53 1.994 0.283 1.993 25755
53 1 9 "Average Difference" CB 53 5.169 -1.781 4.899 25755
54 1 9 "Average Difference" HN 51 0.600 -0.177 0.580 25755
55 1 10 "Average Difference" N 51 2.363 0.036 2.386 25755
56 1 10 "Average Difference" HA 55 0.336 -0.074 0.330 25755
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25755
58 1 10 "Average Difference" CA 53 1.902 0.253 1.903 25755
59 1 10 "Average Difference" CB 53 5.149 -1.753 4.887 25755
60 1 10 "Average Difference" HN 51 0.557 -0.128 0.547 25755
61 1 11 "Average Difference" N 51 2.212 0.126 2.230 25755
62 1 11 "Average Difference" HA 55 0.356 -0.094 0.347 25755
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25755
64 1 11 "Average Difference" CA 53 1.960 0.251 1.962 25755
65 1 11 "Average Difference" CB 53 5.125 -1.729 4.871 25755
66 1 11 "Average Difference" HN 51 0.586 -0.161 0.569 25755
67 1 12 "Average Difference" N 51 2.176 0.304 2.176 25755
68 1 12 "Average Difference" HA 55 0.342 -0.106 0.328 25755
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25755
70 1 12 "Average Difference" CA 53 2.003 0.288 2.001 25755
71 1 12 "Average Difference" CB 53 5.174 -1.764 4.911 25755
72 1 12 "Average Difference" HN 51 0.605 -0.179 0.583 25755
73 1 13 "Average Difference" N 51 2.189 0.133 2.207 25755
74 1 13 "Average Difference" HA 55 0.341 -0.117 0.324 25755
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25755
76 1 13 "Average Difference" CA 53 1.970 0.254 1.972 25755
77 1 13 "Average Difference" CB 53 5.152 -1.832 4.861 25755
78 1 13 "Average Difference" HN 51 0.597 -0.133 0.588 25755
79 1 14 "Average Difference" N 51 2.105 0.008 2.126 25755
80 1 14 "Average Difference" HA 55 0.349 -0.106 0.336 25755
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25755
82 1 14 "Average Difference" CA 53 1.975 0.252 1.977 25755
83 1 14 "Average Difference" CB 53 5.123 -1.645 4.898 25755
84 1 14 "Average Difference" HN 51 0.586 -0.195 0.558 25755
85 1 15 "Average Difference" N 51 2.334 0.162 2.351 25755
86 1 15 "Average Difference" HA 55 0.352 -0.105 0.339 25755
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25755
88 1 15 "Average Difference" CA 53 1.890 0.335 1.878 25755
89 1 15 "Average Difference" CB 53 5.160 -1.757 4.898 25755
90 1 15 "Average Difference" HN 51 0.628 -0.164 0.612 25755
91 1 16 "Average Difference" N 51 2.269 0.271 2.276 25755
92 1 16 "Average Difference" HA 55 0.335 -0.080 0.328 25755
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25755
94 1 16 "Average Difference" CA 53 2.004 0.233 2.009 25755
95 1 16 "Average Difference" CB 53 5.156 -1.748 4.897 25755
96 1 16 "Average Difference" HN 51 0.605 -0.162 0.588 25755
97 1 17 "Average Difference" N 51 2.143 0.139 2.160 25755
98 1 17 "Average Difference" HA 55 0.323 -0.091 0.313 25755
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25755
100 1 17 "Average Difference" CA 53 1.975 0.226 1.981 25755
101 1 17 "Average Difference" CB 53 5.093 -1.771 4.820 25755
102 1 17 "Average Difference" HN 51 0.577 -0.146 0.563 25755
103 1 18 "Average Difference" N 51 2.266 0.196 2.280 25755
104 1 18 "Average Difference" HA 55 0.350 -0.105 0.337 25755
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25755
106 1 18 "Average Difference" CA 53 1.997 0.287 1.995 25755
107 1 18 "Average Difference" CB 53 5.106 -1.777 4.833 25755
108 1 18 "Average Difference" HN 51 0.615 -0.212 0.583 25755
109 1 19 "Average Difference" N 51 2.319 0.181 2.335 25755
110 1 19 "Average Difference" HA 55 0.338 -0.107 0.324 25755
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25755
112 1 19 "Average Difference" CA 53 1.939 0.234 1.943 25755
113 1 19 "Average Difference" CB 53 5.147 -1.765 4.881 25755
114 1 19 "Average Difference" HN 51 0.578 -0.167 0.559 25755
115 1 20 "Average Difference" N 51 2.257 0.177 2.273 25755
116 1 20 "Average Difference" HA 55 0.341 -0.101 0.328 25755
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25755
118 1 20 "Average Difference" CA 53 1.903 0.254 1.904 25755
119 1 20 "Average Difference" CB 53 5.104 -1.747 4.841 25755
120 1 20 "Average Difference" HN 51 0.600 -0.201 0.571 25755
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 25755
_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 ASP HA H 2 4.251 4.251 4.627 -0.376 25755
2 1 . 1 1 2 2 ASP CA C 2 59.484 59.484 54.520 4.964 25755
3 1 . 1 1 2 2 ASP CB C 2 39.412 39.412 40.451 -1.039 25755
4 1 . 1 1 3 3 LYS HA H 3 4.345 4.345 4.317 0.028 25755
5 1 . 1 1 3 3 LYS CA C 3 57.556 57.556 56.668 0.888 25755
6 1 . 1 1 3 3 LYS CB C 3 32.593 32.593 32.682 -0.089 25755
7 1 . 1 1 4 4 CYS N N 4 117.049 117.049 118.632 -1.583 25755
8 1 . 1 1 4 4 CYS HA H 4 4.728 4.728 4.880 -0.152 25755
9 1 . 1 1 4 4 CYS CA C 4 57.415 57.415 56.944 0.471 25755
10 1 . 1 1 4 4 CYS CB C 4 41.843 41.843 29.392 12.451 25755
11 1 . 1 1 4 4 CYS H H 4 8.486 8.486 7.991 0.495 25755
12 1 . 1 1 5 5 LYS N N 5 118.790 118.790 121.173 -2.383 25755
13 1 . 1 1 5 5 LYS HA H 5 5.571 5.571 4.862 0.709 25755
14 1 . 1 1 5 5 LYS CA C 5 55.290 55.290 55.708 -0.418 25755
15 1 . 1 1 5 5 LYS CB C 5 34.606 34.606 34.949 -0.343 25755
16 1 . 1 1 5 5 LYS H H 5 8.007 8.007 8.249 -0.242 25755
17 1 . 1 1 6 6 LYS N N 6 121.177 121.177 120.515 0.662 25755
18 1 . 1 1 6 6 LYS HA H 6 4.785 4.785 4.572 0.213 25755
19 1 . 1 1 6 6 LYS CA C 6 55.542 55.542 55.975 -0.433 25755
20 1 . 1 1 6 6 LYS CB C 6 36.902 36.902 35.549 1.353 25755
21 1 . 1 1 6 6 LYS H H 6 9.014 9.014 8.789 0.225 25755
22 1 . 1 1 7 7 VAL N N 7 127.629 127.629 124.539 3.090 25755
23 1 . 1 1 7 7 VAL HA H 7 4.026 4.026 4.076 -0.050 25755
24 1 . 1 1 7 7 VAL CA C 7 63.988 63.988 62.430 1.558 25755
25 1 . 1 1 7 7 VAL CB C 7 33.107 33.107 32.577 0.529 25755
26 1 . 1 1 7 7 VAL H H 7 8.837 8.837 8.606 0.231 25755
27 1 . 1 1 8 8 TYR N N 8 130.003 130.003 129.281 0.722 25755
28 1 . 1 1 8 8 TYR HA H 8 4.459 4.459 4.727 -0.268 25755
29 1 . 1 1 8 8 TYR CA C 8 55.720 55.720 55.479 0.241 25755
30 1 . 1 1 8 8 TYR CB C 8 36.018 36.018 37.850 -1.832 25755
31 1 . 1 1 8 8 TYR H H 8 9.251 9.251 8.297 0.955 25755
32 1 . 1 1 9 9 GLU N N 9 130.851 130.851 124.629 6.222 25755
33 1 . 1 1 9 9 GLU HA H 9 4.204 4.204 4.141 0.063 25755
34 1 . 1 1 9 9 GLU CA C 9 58.517 58.517 58.663 -0.146 25755
35 1 . 1 1 9 9 GLU CB C 9 29.391 29.391 29.545 -0.154 25755
36 1 . 1 1 9 9 GLU H H 9 9.072 9.072 8.437 0.635 25755
37 1 . 1 1 10 10 ASN N N 10 116.120 116.120 117.561 -1.441 25755
38 1 . 1 1 10 10 ASN HA H 10 4.438 4.438 4.676 -0.238 25755
39 1 . 1 1 10 10 ASN CA C 10 54.587 54.587 52.895 1.692 25755
40 1 . 1 1 10 10 ASN CB C 10 37.278 37.278 37.548 -0.270 25755
41 1 . 1 1 10 10 ASN H H 10 9.301 9.301 7.940 1.361 25755
42 1 . 1 1 11 11 TYR N N 11 122.436 122.436 120.706 1.730 25755
43 1 . 1 1 11 11 TYR HA H 11 4.194 4.194 4.583 -0.389 25755
44 1 . 1 1 11 11 TYR CA C 11 57.612 57.612 55.401 2.211 25755
45 1 . 1 1 11 11 TYR CB C 11 39.467 39.467 41.746 -2.279 25755
46 1 . 1 1 11 11 TYR H H 11 7.550 7.550 7.515 0.035 25755
47 1 . 1 1 12 12 PRO HA H 12 4.447 4.447 4.549 -0.102 25755
48 1 . 1 1 12 12 PRO CA C 12 62.498 62.498 62.581 -0.083 25755
49 1 . 1 1 12 12 PRO CB C 12 30.591 30.591 32.682 -2.091 25755
50 1 . 1 1 13 13 VAL N N 13 124.506 124.506 121.865 2.641 25755
51 1 . 1 1 13 13 VAL HA H 13 3.836 3.836 3.802 0.034 25755
52 1 . 1 1 13 13 VAL CA C 13 65.761 65.761 64.755 1.006 25755
53 1 . 1 1 13 13 VAL CB C 13 31.580 31.580 31.563 0.016 25755
54 1 . 1 1 13 13 VAL H H 13 8.169 8.169 8.424 -0.255 25755
55 1 . 1 1 14 14 SER N N 14 116.625 116.625 116.824 -0.199 25755
56 1 . 1 1 14 14 SER HA H 14 4.206 4.206 4.312 -0.106 25755
57 1 . 1 1 14 14 SER CA C 14 61.194 61.194 61.902 -0.708 25755
58 1 . 1 1 14 14 SER CB C 14 62.041 62.041 62.632 -0.591 25755
59 1 . 1 1 14 14 SER H H 14 8.396 8.396 8.234 0.162 25755
60 1 . 1 1 15 15 LYS N N 15 120.843 120.843 121.785 -0.941 25755
61 1 . 1 1 15 15 LYS HA H 15 4.200 4.200 4.020 0.180 25755
62 1 . 1 1 15 15 LYS CA C 15 59.623 59.623 59.213 0.411 25755
63 1 . 1 1 15 15 LYS CB C 15 32.186 32.186 32.096 0.090 25755
64 1 . 1 1 15 15 LYS H H 15 7.791 7.791 7.817 -0.026 25755
65 1 . 1 1 16 16 CYS N N 16 115.949 115.949 116.934 -0.985 25755
66 1 . 1 1 16 16 CYS HA H 16 4.893 4.893 4.506 0.387 25755
67 1 . 1 1 16 16 CYS CA C 16 56.570 56.570 61.017 -4.447 25755
68 1 . 1 1 16 16 CYS CB C 16 41.437 41.437 26.607 14.830 25755
69 1 . 1 1 16 16 CYS H H 16 7.870 7.870 7.558 0.312 25755
70 1 . 1 1 17 17 GLN N N 17 117.241 117.241 117.302 -0.061 25755
71 1 . 1 1 17 17 GLN HA H 17 4.274 4.274 4.137 0.137 25755
72 1 . 1 1 17 17 GLN CA C 17 56.937 56.937 56.905 0.032 25755
73 1 . 1 1 17 17 GLN CB C 17 29.187 29.187 28.743 0.444 25755
74 1 . 1 1 17 17 GLN H H 17 7.560 7.560 7.661 -0.101 25755
75 1 . 1 1 18 18 LEU N N 18 120.537 120.537 121.694 -1.157 25755
76 1 . 1 1 18 18 LEU HA H 18 4.440 4.440 4.158 0.282 25755
77 1 . 1 1 18 18 LEU CA C 18 55.448 55.448 55.165 0.283 25755
78 1 . 1 1 18 18 LEU CB C 18 41.837 41.837 40.939 0.898 25755
79 1 . 1 1 18 18 LEU H H 18 7.369 7.369 7.423 -0.054 25755
80 1 . 1 1 19 19 ARG N N 19 121.697 121.697 122.607 -0.910 25755
81 1 . 1 1 19 19 ARG HA H 19 4.299 4.299 4.021 0.278 25755
82 1 . 1 1 19 19 ARG CA C 19 57.836 57.836 58.667 -0.831 25755
83 1 . 1 1 19 19 ARG CB C 19 30.392 30.392 30.160 0.232 25755
84 1 . 1 1 19 19 ARG H H 19 8.447 8.447 8.007 0.440 25755
85 1 . 1 1 20 20 ILE N N 20 116.439 116.439 116.988 -0.549 25755
86 1 . 1 1 20 20 ILE HA H 20 4.134 4.134 4.057 0.077 25755
87 1 . 1 1 20 20 ILE CA C 20 62.497 62.497 62.346 0.152 25755
88 1 . 1 1 20 20 ILE CB C 20 38.164 38.164 37.973 0.191 25755
89 1 . 1 1 20 20 ILE H H 20 7.758 7.758 7.778 -0.020 25755
90 1 . 1 1 21 21 ALA N N 21 122.642 122.642 122.968 -0.326 25755
91 1 . 1 1 21 21 ALA HA H 21 4.382 4.382 4.547 -0.165 25755
92 1 . 1 1 21 21 ALA CA C 21 52.395 52.395 51.464 0.931 25755
93 1 . 1 1 21 21 ALA CB C 21 20.098 20.098 19.383 0.715 25755
94 1 . 1 1 21 21 ALA H H 21 7.727 7.727 7.419 0.308 25755
95 1 . 1 1 22 22 ASN N N 22 116.616 116.616 121.558 -4.942 25755
96 1 . 1 1 22 22 ASN HA H 22 4.791 4.791 4.827 -0.036 25755
97 1 . 1 1 22 22 ASN CA C 22 52.877 52.877 52.450 0.427 25755
98 1 . 1 1 22 22 ASN CB C 22 37.554 37.554 38.054 -0.500 25755
99 1 . 1 1 22 22 ASN H H 22 8.307 8.307 8.516 -0.209 25755
100 1 . 1 1 23 23 GLN N N 23 124.357 124.357 123.378 0.979 25755
101 1 . 1 1 23 23 GLN HA H 23 4.018 4.018 4.311 -0.293 25755
102 1 . 1 1 23 23 GLN CA C 23 58.648 58.648 57.601 1.047 25755
103 1 . 1 1 23 23 GLN CB C 23 29.399 29.399 28.592 0.807 25755
104 1 . 1 1 23 23 GLN H H 23 8.542 8.542 8.226 0.316 25755
105 1 . 1 1 24 24 CYS N N 24 118.909 118.909 119.229 -0.320 25755
106 1 . 1 1 24 24 CYS HA H 24 4.284 4.284 4.056 0.228 25755
107 1 . 1 1 24 24 CYS CA C 24 58.406 58.406 62.886 -4.480 25755
108 1 . 1 1 24 24 CYS CB C 24 38.776 38.776 26.790 11.986 25755
109 1 . 1 1 24 24 CYS H H 24 8.352 8.352 8.582 -0.230 25755
110 1 . 1 1 25 25 ASN N N 25 118.182 118.182 119.025 -0.843 25755
111 1 . 1 1 25 25 ASN HA H 25 3.888 3.888 4.302 -0.414 25755
112 1 . 1 1 25 25 ASN CA C 25 57.672 57.672 56.604 1.068 25755
113 1 . 1 1 25 25 ASN CB C 25 39.773 39.773 37.395 2.378 25755
114 1 . 1 1 25 25 ASN H H 25 7.504 7.504 8.448 -0.944 25755
115 1 . 1 1 26 26 TYR N N 26 117.354 117.354 119.670 -2.316 25755
116 1 . 1 1 26 26 TYR HA H 26 3.965 3.965 4.187 -0.222 25755
117 1 . 1 1 26 26 TYR CA C 26 62.162 62.162 61.593 0.569 25755
118 1 . 1 1 26 26 TYR CB C 26 38.630 38.630 38.791 -0.161 25755
119 1 . 1 1 26 26 TYR H H 26 7.322 7.322 7.579 -0.257 25755
120 1 . 1 1 27 27 ASP N N 27 119.874 119.874 120.141 -0.267 25755
121 1 . 1 1 27 27 ASP HA H 27 4.655 4.655 4.356 0.299 25755
122 1 . 1 1 27 27 ASP CB C 27 40.590 40.590 40.898 -0.308 25755
123 1 . 1 1 27 27 ASP H H 27 9.218 9.218 8.235 0.983 25755
124 1 . 1 1 28 28 CYS N N 28 119.782 119.782 119.022 0.760 25755
125 1 . 1 1 28 28 CYS HA H 28 4.168 4.168 3.957 0.211 25755
126 1 . 1 1 28 28 CYS CA C 28 60.914 60.914 62.649 -1.735 25755
127 1 . 1 1 28 28 CYS CB C 28 36.945 36.945 26.261 10.684 25755
128 1 . 1 1 28 28 CYS H H 28 9.171 9.171 8.352 0.819 25755
129 1 . 1 1 29 29 LYS N N 29 119.663 119.663 118.861 0.802 25755
130 1 . 1 1 29 29 LYS HA H 29 4.137 4.137 3.920 0.217 25755
131 1 . 1 1 29 29 LYS CA C 29 59.781 59.781 59.038 0.743 25755
132 1 . 1 1 29 29 LYS CB C 29 32.413 32.413 31.797 0.616 25755
133 1 . 1 1 29 29 LYS H H 29 7.546 7.546 7.454 0.092 25755
134 1 . 1 1 30 30 LEU N N 30 119.987 119.987 120.490 -0.503 25755
135 1 . 1 1 30 30 LEU HA H 30 4.111 4.111 3.862 0.249 25755
136 1 . 1 1 30 30 LEU CA C 30 57.672 57.672 57.886 -0.214 25755
137 1 . 1 1 30 30 LEU CB C 30 42.379 42.379 42.057 0.322 25755
138 1 . 1 1 30 30 LEU H H 30 8.226 8.226 7.652 0.574 25755
139 1 . 1 1 31 31 ASP N N 31 116.853 116.853 116.496 0.357 25755
140 1 . 1 1 31 31 ASP HA H 31 4.546 4.546 4.608 -0.062 25755
141 1 . 1 1 31 31 ASP CA C 31 56.266 56.266 55.615 0.651 25755
142 1 . 1 1 31 31 ASP CB C 31 40.478 40.478 41.520 -1.042 25755
143 1 . 1 1 31 31 ASP H H 31 9.019 9.019 7.840 1.179 25755
144 1 . 1 1 32 32 LYS N N 32 112.075 112.075 118.506 -6.431 25755
145 1 . 1 1 32 32 LYS HA H 32 4.549 4.549 4.152 0.397 25755
146 1 . 1 1 32 32 LYS CA C 32 53.465 53.465 57.712 -4.247 25755
147 1 . 1 1 32 32 LYS CB C 32 31.865 31.865 32.607 -0.742 25755
148 1 . 1 1 32 32 LYS H H 32 6.639 6.639 8.280 -1.641 25755
149 1 . 1 1 33 33 HIS N N 33 112.955 112.955 114.477 -1.522 25755
150 1 . 1 1 33 33 HIS HA H 33 4.623 4.623 4.178 0.445 25755
151 1 . 1 1 33 33 HIS CA C 33 56.486 56.486 55.920 0.566 25755
152 1 . 1 1 33 33 HIS CB C 33 25.694 25.694 28.076 -2.382 25755
153 1 . 1 1 33 33 HIS H H 33 7.065 7.065 8.070 -1.005 25755
154 1 . 1 1 34 34 ALA N N 34 120.177 120.177 119.316 0.861 25755
155 1 . 1 1 34 34 ALA HA H 34 4.149 4.149 3.730 0.419 25755
156 1 . 1 1 34 34 ALA CA C 34 50.779 50.779 52.407 -1.628 25755
157 1 . 1 1 34 34 ALA CB C 34 19.118 19.118 19.596 -0.478 25755
158 1 . 1 1 34 34 ALA H H 34 7.716 7.716 7.083 0.633 25755
159 1 . 1 1 35 35 ARG N N 35 116.636 116.636 117.343 -0.708 25755
160 1 . 1 1 35 35 ARG HA H 35 4.206 4.206 4.114 0.092 25755
161 1 . 1 1 35 35 ARG CA C 35 58.076 58.076 58.933 -0.857 25755
162 1 . 1 1 35 35 ARG CB C 35 30.717 30.717 30.540 0.177 25755
163 1 . 1 1 35 35 ARG H H 35 8.295 8.295 8.106 0.189 25755
164 1 . 1 1 36 36 SER N N 36 109.273 109.273 111.521 -2.248 25755
165 1 . 1 1 36 36 SER HA H 36 4.646 4.646 4.454 0.192 25755
166 1 . 1 1 36 36 SER CA C 36 57.703 57.703 58.135 -0.432 25755
167 1 . 1 1 36 36 SER CB C 36 65.425 65.425 65.374 0.051 25755
168 1 . 1 1 36 36 SER H H 36 8.026 8.026 8.165 -0.139 25755
169 1 . 1 1 37 37 GLY N N 37 107.305 107.305 110.718 -3.413 25755
170 1 . 1 1 37 37 GLY CA C 37 47.152 47.152 44.934 2.218 25755
171 1 . 1 1 37 37 GLY H H 37 8.679 8.679 7.976 0.703 25755
172 1 . 1 1 38 38 GLU N N 38 119.065 119.065 122.182 -3.117 25755
173 1 . 1 1 38 38 GLU HA H 38 4.402 4.402 4.587 -0.185 25755
174 1 . 1 1 38 38 GLU CA C 38 55.773 55.773 54.891 0.882 25755
175 1 . 1 1 38 38 GLU CB C 38 32.822 32.822 34.956 -2.134 25755
176 1 . 1 1 38 38 GLU H H 38 8.351 8.351 8.822 -0.471 25755
177 1 . 1 1 39 39 CYS N N 39 121.636 121.636 118.392 3.244 25755
178 1 . 1 1 39 39 CYS HA H 39 5.987 5.987 5.341 0.646 25755
179 1 . 1 1 39 39 CYS CA C 39 56.728 56.728 57.693 -0.965 25755
180 1 . 1 1 39 39 CYS CB C 39 45.019 45.019 28.532 16.487 25755
181 1 . 1 1 39 39 CYS H H 39 8.839 8.839 8.278 0.561 25755
182 1 . 1 1 40 40 PHE N N 40 121.987 121.987 120.329 1.658 25755
183 1 . 1 1 40 40 PHE HA H 40 4.770 4.770 4.811 -0.041 25755
184 1 . 1 1 40 40 PHE CA C 40 56.969 56.969 56.398 0.571 25755
185 1 . 1 1 40 40 PHE CB C 40 43.760 43.760 42.892 0.868 25755
186 1 . 1 1 40 40 PHE H H 40 9.214 9.214 8.832 0.382 25755
187 1 . 1 1 41 41 TYR N N 41 121.905 121.905 119.344 2.561 25755
188 1 . 1 1 41 41 TYR HA H 41 4.960 4.960 4.663 0.297 25755
189 1 . 1 1 41 41 TYR CA C 41 58.532 58.532 59.014 -0.482 25755
190 1 . 1 1 41 41 TYR CB C 41 40.302 40.302 39.223 1.079 25755
191 1 . 1 1 41 41 TYR H H 41 8.557 8.557 8.723 -0.166 25755
192 1 . 1 1 42 42 ASP N N 42 123.133 123.133 121.145 1.988 25755
193 1 . 1 1 42 42 ASP HA H 42 4.753 4.753 4.833 -0.080 25755
194 1 . 1 1 42 42 ASP CA C 42 52.426 52.426 52.715 -0.289 25755
195 1 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.637 -1.017 25755
196 1 . 1 1 42 42 ASP H H 42 8.603 8.603 8.291 0.312 25755
197 1 . 1 1 43 43 GLU N N 43 118.012 118.012 118.983 -0.971 25755
198 1 . 1 1 43 43 GLU HA H 43 4.209 4.209 4.132 0.077 25755
199 1 . 1 1 43 43 GLU CA C 43 58.865 58.865 58.845 0.020 25755
200 1 . 1 1 43 43 GLU CB C 43 29.237 29.237 29.545 -0.307 25755
201 1 . 1 1 43 43 GLU H H 43 9.081 9.081 8.724 0.357 25755
202 1 . 1 1 44 44 LYS N N 44 120.047 120.047 117.272 2.775 25755
203 1 . 1 1 44 44 LYS HA H 44 4.444 4.444 4.388 0.056 25755
204 1 . 1 1 44 44 LYS CA C 44 55.661 55.661 55.490 0.171 25755
205 1 . 1 1 44 44 LYS CB C 44 32.039 32.039 32.412 -0.373 25755
206 1 . 1 1 44 44 LYS H H 44 8.162 8.162 8.064 0.098 25755
207 1 . 1 1 45 45 ARG N N 45 113.453 113.453 115.846 -2.393 25755
208 1 . 1 1 45 45 ARG HA H 45 3.663 3.663 4.089 -0.426 25755
209 1 . 1 1 45 45 ARG CA C 45 57.736 57.736 56.852 0.884 25755
210 1 . 1 1 45 45 ARG CB C 45 26.390 26.390 27.250 -0.860 25755
211 1 . 1 1 45 45 ARG H H 45 8.335 8.335 7.879 0.456 25755
212 1 . 1 1 46 46 ASN N N 46 118.207 118.207 117.118 1.089 25755
213 1 . 1 1 46 46 ASN HA H 46 4.982 4.982 4.976 0.006 25755
214 1 . 1 1 46 46 ASN CA C 46 53.066 53.066 51.934 1.132 25755
215 1 . 1 1 46 46 ASN CB C 46 39.293 39.293 39.299 -0.006 25755
216 1 . 1 1 46 46 ASN H H 46 8.745 8.745 8.541 0.204 25755
217 1 . 1 1 47 47 LEU N N 47 125.815 125.815 126.881 -1.066 25755
218 1 . 1 1 47 47 LEU HA H 47 4.279 4.279 4.038 0.241 25755
219 1 . 1 1 47 47 LEU CA C 47 55.290 55.290 55.084 0.206 25755
220 1 . 1 1 47 47 LEU CB C 47 43.306 43.306 41.542 1.764 25755
221 1 . 1 1 47 47 LEU H H 47 8.509 8.509 8.817 -0.308 25755
222 1 . 1 1 48 48 GLN N N 48 120.834 120.834 122.266 -1.432 25755
223 1 . 1 1 48 48 GLN HA H 48 4.736 4.736 4.682 0.054 25755
224 1 . 1 1 48 48 GLN CA C 48 54.105 54.105 54.012 0.093 25755
225 1 . 1 1 48 48 GLN CB C 48 32.866 32.866 33.508 -0.642 25755
226 1 . 1 1 48 48 GLN H H 48 8.589 8.589 8.935 -0.346 25755
227 1 . 1 1 49 49 CYS N N 49 121.829 121.829 122.972 -1.143 25755
228 1 . 1 1 49 49 CYS HA H 49 4.858 4.858 4.562 0.296 25755
229 1 . 1 1 49 49 CYS CA C 49 54.955 54.955 58.928 -3.973 25755
230 1 . 1 1 49 49 CYS CB C 49 38.445 38.445 25.573 12.872 25755
231 1 . 1 1 49 49 CYS H H 49 9.247 9.247 8.990 0.257 25755
232 1 . 1 1 50 50 ILE N N 50 129.010 129.010 129.860 -0.850 25755
233 1 . 1 1 50 50 ILE HA H 50 4.386 4.386 4.453 -0.067 25755
234 1 . 1 1 50 50 ILE CA C 50 60.421 60.421 61.872 -1.451 25755
235 1 . 1 1 50 50 ILE CB C 50 38.404 38.404 38.979 -0.575 25755
236 1 . 1 1 50 50 ILE H H 50 8.787 8.787 8.099 0.688 25755
237 1 . 1 1 51 51 CYS N N 51 126.108 126.108 127.406 -1.298 25755
238 1 . 1 1 51 51 CYS HA H 51 5.337 5.337 4.649 0.688 25755
239 1 . 1 1 51 51 CYS CA C 51 51.818 51.818 58.465 -6.647 25755
240 1 . 1 1 51 51 CYS CB C 51 35.982 35.982 29.635 6.347 25755
241 1 . 1 1 51 51 CYS H H 51 8.556 8.556 9.287 -0.731 25755
242 1 . 1 1 52 52 ASP N N 52 122.342 122.342 120.029 2.313 25755
243 1 . 1 1 52 52 ASP HA H 52 5.513 5.513 4.881 0.632 25755
244 1 . 1 1 52 52 ASP CA C 52 52.583 52.583 53.573 -0.991 25755
245 1 . 1 1 52 52 ASP CB C 52 42.831 42.831 42.356 0.475 25755
246 1 . 1 1 52 52 ASP H H 52 8.826 8.826 8.514 0.312 25755
247 1 . 1 1 53 53 TYR N N 53 125.370 125.370 123.265 2.106 25755
248 1 . 1 1 53 53 TYR HA H 53 4.258 4.258 4.624 -0.366 25755
249 1 . 1 1 53 53 TYR CA C 53 59.665 59.665 59.000 0.665 25755
250 1 . 1 1 53 53 TYR CB C 53 38.783 38.783 39.343 -0.560 25755
251 1 . 1 1 53 53 TYR H H 53 9.734 9.734 8.678 1.056 25755
252 1 . 1 1 54 54 CYS N N 54 120.418 120.418 121.258 -0.840 25755
253 1 . 1 1 54 54 CYS HA H 54 4.494 4.494 4.466 0.028 25755
254 1 . 1 1 54 54 CYS CA C 54 55.143 55.143 59.636 -4.493 25755
255 1 . 1 1 54 54 CYS CB C 54 44.382 44.382 28.980 15.402 25755
256 1 . 1 1 54 54 CYS H H 54 9.478 9.478 8.889 0.589 25755
257 1 . 1 1 55 55 GLU N N 55 121.097 121.097 119.317 1.780 25755
258 1 . 1 1 55 55 GLU HA H 55 4.312 4.312 4.404 -0.092 25755
259 1 . 1 1 55 55 GLU CA C 55 56.010 56.010 56.608 -0.598 25755
260 1 . 1 1 55 55 GLU CB C 55 31.014 31.014 31.097 -0.083 25755
261 1 . 1 1 55 55 GLU H H 55 8.423 8.423 8.102 0.321 25755
stop_
save_