data_25447
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25447
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 25447
_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 1 1 MET N N 1 120.668 120.668 114.923 5.745 25447
2 1 1 . 1 1 1 1 MET HA H 1 4.484 4.484 4.213 0.271 25447
3 1 1 . 1 1 1 1 MET CA C 1 55.257 55.257 56.831 -1.574 25447
4 1 1 . 1 1 1 1 MET CB C 1 34.517 34.517 33.126 1.391 25447
5 1 1 . 1 1 1 1 MET H H 1 8.313 8.313 7.779 0.534 25447
6 1 1 . 1 1 2 2 GLN N N 2 123.739 123.739 113.088 10.651 25447
7 1 1 . 1 1 2 2 GLN HA H 2 4.030 4.030 3.726 0.304 25447
8 1 1 . 1 1 2 2 GLN CA C 2 57.874 57.874 56.700 1.174 25447
9 1 1 . 1 1 2 2 GLN CB C 2 29.938 29.938 26.113 3.825 25447
10 1 1 . 1 1 2 2 GLN H H 2 9.455 9.455 7.631 1.824 25447
11 1 1 . 1 1 3 3 HIS N N 3 119.115 119.115 110.184 8.931 25447
12 1 1 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.220 0.896 25447
13 1 1 . 1 1 3 3 HIS CA C 3 55.494 55.494 56.016 -0.522 25447
14 1 1 . 1 1 3 3 HIS CB C 3 31.015 31.015 27.507 3.508 25447
15 1 1 . 1 1 3 3 HIS H H 3 9.783 9.783 8.250 1.533 25447
16 1 1 . 1 1 4 4 ALA N N 4 122.648 122.648 122.800 -0.152 25447
17 1 1 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.029 -0.126 25447
18 1 1 . 1 1 4 4 ALA CA C 4 56.479 56.479 54.587 1.893 25447
19 1 1 . 1 1 4 4 ALA CB C 4 19.194 19.194 18.940 0.254 25447
20 1 1 . 1 1 4 4 ALA H H 4 7.551 7.551 8.438 -0.887 25447
21 1 1 . 1 1 5 5 SER N N 5 112.599 112.599 114.760 -2.161 25447
22 1 1 . 1 1 5 5 SER HA H 5 4.298 4.298 4.157 0.141 25447
23 1 1 . 1 1 5 5 SER CA C 5 62.117 62.117 62.053 0.064 25447
24 1 1 . 1 1 5 5 SER CB C 5 62.334 62.334 62.611 -0.277 25447
25 1 1 . 1 1 5 5 SER H H 5 8.736 8.736 8.409 0.327 25447
26 1 1 . 1 1 6 6 VAL N N 6 122.866 122.866 122.916 -0.050 25447
27 1 1 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.726 0.379 25447
28 1 1 . 1 1 6 6 VAL CA C 6 65.732 65.732 66.422 -0.690 25447
29 1 1 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.862 0.875 25447
30 1 1 . 1 1 6 6 VAL H H 6 7.660 7.660 7.830 -0.170 25447
31 1 1 . 1 1 7 7 ILE N N 7 121.715 121.715 119.795 1.920 25447
32 1 1 . 1 1 7 7 ILE HA H 7 4.224 4.224 4.050 0.174 25447
33 1 1 . 1 1 7 7 ILE CA C 7 65.329 65.329 65.794 -0.465 25447
34 1 1 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.719 0.974 25447
35 1 1 . 1 1 7 7 ILE H H 7 8.519 8.519 7.674 0.845 25447
36 1 1 . 1 1 8 8 ALA N N 8 121.373 121.373 121.247 0.126 25447
37 1 1 . 1 1 8 8 ALA HA H 8 3.895 3.895 4.016 -0.121 25447
38 1 1 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.282 0.975 25447
39 1 1 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.012 0.628 25447
40 1 1 . 1 1 8 8 ALA H H 8 8.940 8.940 8.018 0.922 25447
41 1 1 . 1 1 9 9 GLN N N 9 115.076 115.076 119.481 -4.405 25447
42 1 1 . 1 1 9 9 GLN HA H 9 3.870 3.870 3.884 -0.014 25447
43 1 1 . 1 1 9 9 GLN CA C 9 59.192 59.192 59.099 0.093 25447
44 1 1 . 1 1 9 9 GLN CB C 9 28.138 28.138 28.523 -0.385 25447
45 1 1 . 1 1 9 9 GLN H H 9 7.729 7.729 8.312 -0.583 25447
46 1 1 . 1 1 10 10 PHE N N 10 120.207 120.207 118.096 2.111 25447
47 1 1 . 1 1 10 10 PHE HA H 10 4.085 4.085 3.859 0.226 25447
48 1 1 . 1 1 10 10 PHE CA C 10 60.893 60.893 61.334 -0.440 25447
49 1 1 . 1 1 10 10 PHE CB C 10 38.932 38.932 37.904 1.028 25447
50 1 1 . 1 1 10 10 PHE H H 10 7.301 7.301 7.778 -0.477 25447
51 1 1 . 1 1 11 11 VAL N N 11 117.569 117.569 119.166 -1.597 25447
52 1 1 . 1 1 11 11 VAL HA H 11 3.307 3.307 4.221 -0.914 25447
53 1 1 . 1 1 11 11 VAL CA C 11 66.508 66.508 65.213 1.295 25447
54 1 1 . 1 1 11 11 VAL CB C 11 31.487 31.487 31.160 0.327 25447
55 1 1 . 1 1 11 11 VAL H H 11 8.370 8.370 7.806 0.564 25447
56 1 1 . 1 1 12 12 VAL N N 12 117.909 117.909 121.028 -3.119 25447
57 1 1 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.668 0.073 25447
58 1 1 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.855 -0.979 25447
59 1 1 . 1 1 12 12 VAL CB C 12 31.312 31.312 30.934 0.378 25447
60 1 1 . 1 1 12 12 VAL H H 12 8.294 8.294 8.556 -0.262 25447
61 1 1 . 1 1 13 13 GLU N N 13 117.918 117.918 118.151 -0.233 25447
62 1 1 . 1 1 13 13 GLU HA H 13 3.742 3.742 4.003 -0.261 25447
63 1 1 . 1 1 13 13 GLU CA C 13 59.307 59.307 58.278 1.030 25447
64 1 1 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.176 0.313 25447
65 1 1 . 1 1 13 13 GLU H H 13 7.750 7.750 8.047 -0.297 25447
66 1 1 . 1 1 14 14 GLU N N 14 113.478 113.478 117.487 -4.009 25447
67 1 1 . 1 1 14 14 GLU HA H 14 3.778 3.778 4.127 -0.349 25447
68 1 1 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.756 -1.956 25447
69 1 1 . 1 1 14 14 GLU CB C 14 29.643 29.643 30.113 -0.470 25447
70 1 1 . 1 1 14 14 GLU H H 14 7.603 7.603 8.156 -0.553 25447
71 1 1 . 1 1 15 15 PHE N N 15 114.193 114.193 114.766 -0.573 25447
72 1 1 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.628 0.311 25447
73 1 1 . 1 1 15 15 PHE CA C 15 58.095 58.095 58.492 -0.397 25447
74 1 1 . 1 1 15 15 PHE CB C 15 42.095 42.095 42.341 -0.246 25447
75 1 1 . 1 1 15 15 PHE H H 15 7.908 7.908 7.507 0.401 25447
76 1 1 . 1 1 16 16 LEU N N 16 121.492 121.492 121.718 -0.226 25447
77 1 1 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.797 0.170 25447
78 1 1 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.200 0.177 25447
79 1 1 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.436 1.297 25447
80 1 1 . 1 1 16 16 LEU H H 16 8.015 8.015 8.053 -0.038 25447
81 1 1 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.416 -0.033 25447
82 1 1 . 1 1 17 17 PRO CA C 17 64.858 64.858 63.893 0.965 25447
83 1 1 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.824 0.005 25447
84 1 1 . 1 1 18 18 ASP N N 18 116.508 116.508 118.351 -1.843 25447
85 1 1 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.698 -0.130 25447
86 1 1 . 1 1 18 18 ASP CA C 18 54.688 54.688 54.044 0.644 25447
87 1 1 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.516 0.110 25447
88 1 1 . 1 1 18 18 ASP H H 18 8.399 8.399 8.614 -0.215 25447
89 1 1 . 1 1 19 19 VAL N N 19 122.135 122.135 120.822 1.313 25447
90 1 1 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.150 -0.032 25447
91 1 1 . 1 1 19 19 VAL CA C 19 61.293 61.293 60.498 0.795 25447
92 1 1 . 1 1 19 19 VAL CB C 19 33.582 33.582 33.458 0.124 25447
93 1 1 . 1 1 19 19 VAL H H 19 7.760 7.760 7.249 0.511 25447
94 1 1 . 1 1 20 20 ALA N N 20 129.301 129.301 130.828 -1.527 25447
95 1 1 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.493 0.106 25447
96 1 1 . 1 1 20 20 ALA CA C 20 50.270 50.270 50.227 0.042 25447
97 1 1 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.266 -0.838 25447
98 1 1 . 1 1 20 20 ALA H H 20 8.761 8.761 8.343 0.418 25447
99 1 1 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.158 -0.081 25447
100 1 1 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.369 0.834 25447
101 1 1 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.748 -0.340 25447
102 1 1 . 1 1 22 22 ALA N N 22 116.106 116.106 117.786 -1.680 25447
103 1 1 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.130 -0.013 25447
104 1 1 . 1 1 22 22 ALA CA C 22 53.996 53.996 54.145 -0.149 25447
105 1 1 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.205 0.639 25447
106 1 1 . 1 1 22 22 ALA H H 22 8.064 8.064 7.900 0.164 25447
107 1 1 . 1 1 23 23 ASP N N 23 115.541 115.541 118.089 -2.548 25447
108 1 1 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.630 0.047 25447
109 1 1 . 1 1 23 23 ASP CA C 23 54.336 54.336 53.934 0.402 25447
110 1 1 . 1 1 23 23 ASP CB C 23 41.353 41.353 40.961 0.392 25447
111 1 1 . 1 1 23 23 ASP H H 23 8.003 8.003 8.150 -0.147 25447
112 1 1 . 1 1 24 24 VAL N N 24 121.517 121.517 120.645 0.872 25447
113 1 1 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.145 -0.324 25447
114 1 1 . 1 1 24 24 VAL CA C 24 62.345 62.345 62.005 0.340 25447
115 1 1 . 1 1 24 24 VAL CB C 24 31.733 31.733 33.337 -1.604 25447
116 1 1 . 1 1 24 24 VAL H H 24 7.069 7.069 7.416 -0.347 25447
117 1 1 . 1 1 25 25 ASP N N 25 129.329 129.329 126.889 2.440 25447
118 1 1 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.824 -0.250 25447
119 1 1 . 1 1 25 25 ASP CA C 25 54.566 54.566 53.520 1.046 25447
120 1 1 . 1 1 25 25 ASP CB C 25 42.333 42.333 41.565 0.768 25447
121 1 1 . 1 1 25 25 ASP H H 25 8.474 8.474 8.691 -0.217 25447
122 1 1 . 1 1 26 26 VAL N N 26 121.920 121.920 120.269 1.651 25447
123 1 1 . 1 1 26 26 VAL HA H 26 4.108 4.108 4.055 0.053 25447
124 1 1 . 1 1 26 26 VAL CA C 26 64.518 64.518 63.593 0.925 25447
125 1 1 . 1 1 26 26 VAL CB C 26 31.198 31.198 32.094 -0.896 25447
126 1 1 . 1 1 26 26 VAL H H 26 8.591 8.591 8.586 0.005 25447
127 1 1 . 1 1 27 27 ASP N N 27 116.286 116.286 118.908 -2.622 25447
128 1 1 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.638 0.507 25447
129 1 1 . 1 1 27 27 ASP CA C 27 54.181 54.181 55.198 -1.017 25447
130 1 1 . 1 1 27 27 ASP CB C 27 42.575 42.575 40.536 2.039 25447
131 1 1 . 1 1 27 27 ASP H H 27 8.609 8.609 8.245 0.364 25447
132 1 1 . 1 1 28 28 LEU N N 28 125.116 125.116 122.008 3.108 25447
133 1 1 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.474 -0.463 25447
134 1 1 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.339 1.748 25447
135 1 1 . 1 1 28 28 LEU CB C 28 43.321 43.321 43.846 -0.525 25447
136 1 1 . 1 1 28 28 LEU H H 28 7.374 7.374 7.320 0.054 25447
137 1 1 . 1 1 29 29 ASP N N 29 125.924 125.924 125.227 0.697 25447
138 1 1 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.639 0.195 25447
139 1 1 . 1 1 29 29 ASP CA C 29 53.920 53.920 55.005 -1.085 25447
140 1 1 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.482 -0.103 25447
141 1 1 . 1 1 29 29 ASP H H 29 8.699 8.699 8.621 0.078 25447
142 1 1 . 1 1 30 30 LEU N N 30 129.975 129.975 123.704 6.271 25447
143 1 1 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.150 -0.233 25447
144 1 1 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.325 -0.938 25447
145 1 1 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.576 -0.337 25447
146 1 1 . 1 1 30 30 LEU H H 30 9.718 9.718 8.437 1.281 25447
147 1 1 . 1 1 31 31 VAL N N 31 121.212 121.212 117.743 3.469 25447
148 1 1 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.591 0.602 25447
149 1 1 . 1 1 31 31 VAL CA C 31 64.433 64.433 66.699 -2.266 25447
150 1 1 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.698 0.477 25447
151 1 1 . 1 1 31 31 VAL H H 31 8.163 8.163 7.731 0.432 25447
152 1 1 . 1 1 32 32 ASP N N 32 124.893 124.893 118.689 6.204 25447
153 1 1 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.324 0.034 25447
154 1 1 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.798 0.427 25447
155 1 1 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.092 0.643 25447
156 1 1 . 1 1 32 32 ASP H H 32 9.385 9.385 8.770 0.615 25447
157 1 1 . 1 1 33 33 ASN N N 33 111.484 111.484 116.554 -5.070 25447
158 1 1 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.559 0.161 25447
159 1 1 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.926 -0.040 25447
160 1 1 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.227 -0.221 25447
161 1 1 . 1 1 33 33 ASN H H 33 7.396 7.396 7.634 -0.238 25447
162 1 1 . 1 1 34 34 GLY N N 34 106.957 106.957 106.440 0.517 25447
163 1 1 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.668 0.939 25447
164 1 1 . 1 1 34 34 GLY H H 34 7.618 7.618 7.867 -0.249 25447
165 1 1 . 1 1 35 35 VAL N N 35 120.424 120.424 118.616 1.808 25447
166 1 1 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.566 0.200 25447
167 1 1 . 1 1 35 35 VAL CA C 35 65.125 65.125 65.122 0.003 25447
168 1 1 . 1 1 35 35 VAL CB C 35 31.879 31.879 31.831 0.048 25447
169 1 1 . 1 1 35 35 VAL H H 35 7.792 7.792 7.860 -0.068 25447
170 1 1 . 1 1 36 36 ILE N N 36 116.364 116.364 119.813 -3.449 25447
171 1 1 . 1 1 36 36 ILE HA H 36 3.737 3.737 3.958 -0.221 25447
172 1 1 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.736 -1.051 25447
173 1 1 . 1 1 36 36 ILE CB C 36 38.807 38.807 37.683 1.124 25447
174 1 1 . 1 1 36 36 ILE H H 36 7.331 7.331 7.972 -0.641 25447
175 1 1 . 1 1 37 37 ASP N N 37 127.306 127.306 127.794 -0.488 25447
176 1 1 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.742 -0.078 25447
177 1 1 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.890 -1.274 25447
178 1 1 . 1 1 37 37 ASP CB C 37 41.209 41.209 42.788 -1.579 25447
179 1 1 . 1 1 37 37 ASP H H 37 7.874 7.874 7.975 -0.101 25447
180 1 1 . 1 1 38 38 ALA N N 38 120.352 120.352 123.034 -2.682 25447
181 1 1 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.105 -0.110 25447
182 1 1 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.361 0.930 25447
183 1 1 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.587 -0.275 25447
184 1 1 . 1 1 38 38 ALA H H 38 8.244 8.244 8.330 -0.086 25447
185 1 1 . 1 1 39 39 LEU N N 39 117.438 117.438 118.354 -0.916 25447
186 1 1 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.192 0.058 25447
187 1 1 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.063 0.292 25447
188 1 1 . 1 1 39 39 LEU CB C 39 41.236 41.236 41.163 0.073 25447
189 1 1 . 1 1 39 39 LEU H H 39 7.688 7.688 8.405 -0.717 25447
190 1 1 . 1 1 40 40 GLY N N 40 112.015 112.015 107.861 4.154 25447
191 1 1 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.179 0.920 25447
192 1 1 . 1 1 40 40 GLY H H 40 8.732 8.732 8.317 0.415 25447
193 1 1 . 1 1 41 41 LEU N N 41 122.983 122.983 123.445 -0.462 25447
194 1 1 . 1 1 41 41 LEU HA H 41 3.851 3.851 4.137 -0.286 25447
195 1 1 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.731 0.601 25447
196 1 1 . 1 1 41 41 LEU CB C 41 41.639 41.639 42.023 -0.384 25447
197 1 1 . 1 1 41 41 LEU H H 41 8.548 8.548 8.344 0.204 25447
198 1 1 . 1 1 42 42 LEU N N 42 116.076 116.076 119.994 -3.918 25447
199 1 1 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.897 0.131 25447
200 1 1 . 1 1 42 42 LEU CA C 42 58.064 58.064 58.521 -0.457 25447
201 1 1 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.813 -0.873 25447
202 1 1 . 1 1 42 42 LEU H H 42 7.168 7.168 7.637 -0.469 25447
203 1 1 . 1 1 43 43 LYS N N 43 119.831 119.831 119.103 0.728 25447
204 1 1 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.037 0.247 25447
205 1 1 . 1 1 43 43 LYS CA C 43 59.644 59.644 60.060 -0.416 25447
206 1 1 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.365 0.162 25447
207 1 1 . 1 1 43 43 LYS H H 43 7.640 7.640 8.290 -0.650 25447
208 1 1 . 1 1 44 44 VAL N N 44 121.046 121.046 120.449 0.597 25447
209 1 1 . 1 1 44 44 VAL HA H 44 3.949 3.949 4.051 -0.102 25447
210 1 1 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.972 -0.329 25447
211 1 1 . 1 1 44 44 VAL H H 44 8.269 8.269 7.949 0.320 25447
212 1 1 . 1 1 45 45 ILE N N 45 119.333 119.333 119.400 -0.067 25447
213 1 1 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.608 -0.204 25447
214 1 1 . 1 1 45 45 ILE CA C 45 66.148 66.148 63.808 2.340 25447
215 1 1 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.145 1.132 25447
216 1 1 . 1 1 45 45 ILE H H 45 8.145 8.145 7.762 0.383 25447
217 1 1 . 1 1 46 46 ALA N N 46 121.213 121.213 123.569 -2.356 25447
218 1 1 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.096 0.161 25447
219 1 1 . 1 1 46 46 ALA CA C 46 55.164 55.164 55.270 -0.106 25447
220 1 1 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.343 0.025 25447
221 1 1 . 1 1 46 46 ALA H H 46 7.792 7.792 8.236 -0.444 25447
222 1 1 . 1 1 47 47 TRP N N 47 121.416 121.416 120.046 1.370 25447
223 1 1 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.449 -0.215 25447
224 1 1 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.574 2.096 25447
225 1 1 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.403 -1.164 25447
226 1 1 . 1 1 47 47 TRP H H 47 8.093 8.093 7.944 0.149 25447
227 1 1 . 1 1 48 48 LEU N N 48 118.963 118.963 121.021 -2.058 25447
228 1 1 . 1 1 48 48 LEU HA H 48 3.586 3.586 2.723 0.863 25447
229 1 1 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.729 0.466 25447
230 1 1 . 1 1 48 48 LEU CB C 48 42.251 42.251 41.173 1.078 25447
231 1 1 . 1 1 48 48 LEU H H 48 8.693 8.693 7.214 1.479 25447
232 1 1 . 1 1 49 49 GLU N N 49 119.131 119.131 117.439 1.692 25447
233 1 1 . 1 1 49 49 GLU HA H 49 4.050 4.050 3.992 0.058 25447
234 1 1 . 1 1 49 49 GLU CA C 49 59.862 59.862 58.944 0.918 25447
235 1 1 . 1 1 49 49 GLU CB C 49 29.586 29.586 28.776 0.810 25447
236 1 1 . 1 1 49 49 GLU H H 49 7.771 7.771 7.942 -0.171 25447
237 1 1 . 1 1 50 50 ASP N N 50 119.941 119.941 120.068 -0.127 25447
238 1 1 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.403 -0.166 25447
239 1 1 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.983 0.372 25447
240 1 1 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.940 1.443 25447
241 1 1 . 1 1 50 50 ASP H H 50 7.697 7.697 7.569 0.128 25447
242 1 1 . 1 1 51 51 ARG N N 51 116.911 116.911 117.743 -0.832 25447
243 1 1 . 1 1 51 51 ARG HA H 51 3.736 3.736 4.008 -0.272 25447
244 1 1 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.404 -2.040 25447
245 1 1 . 1 1 51 51 ARG CB C 51 29.315 29.315 30.258 -0.943 25447
246 1 1 . 1 1 51 51 ARG H H 51 8.881 8.881 7.826 1.055 25447
247 1 1 . 1 1 52 52 PHE N N 52 112.328 112.328 116.437 -4.109 25447
248 1 1 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.632 0.043 25447
249 1 1 . 1 1 52 52 PHE CA C 52 57.413 57.413 57.993 -0.580 25447
250 1 1 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.343 1.549 25447
251 1 1 . 1 1 52 52 PHE H H 52 7.284 7.284 7.502 -0.218 25447
252 1 1 . 1 1 53 53 GLY N N 53 109.826 109.826 108.795 1.031 25447
253 1 1 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.601 1.200 25447
254 1 1 . 1 1 53 53 GLY H H 53 7.427 7.427 7.939 -0.512 25447
255 1 1 . 1 1 54 54 ILE N N 54 119.127 119.127 115.078 4.049 25447
256 1 1 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.508 -0.557 25447
257 1 1 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.348 1.337 25447
258 1 1 . 1 1 54 54 ILE CB C 54 39.490 39.490 39.885 -0.395 25447
259 1 1 . 1 1 54 54 ILE H H 54 6.876 6.876 7.594 -0.718 25447
260 1 1 . 1 1 55 55 ALA N N 55 129.823 129.823 124.390 5.433 25447
261 1 1 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.564 -0.150 25447
262 1 1 . 1 1 55 55 ALA CA C 55 51.610 51.610 50.643 0.967 25447
263 1 1 . 1 1 55 55 ALA CB C 55 19.262 19.262 20.148 -0.886 25447
264 1 1 . 1 1 55 55 ALA H H 55 8.499 8.499 8.301 0.198 25447
265 1 1 . 1 1 56 56 ALA N N 56 126.300 126.300 126.665 -0.365 25447
266 1 1 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.085 0.184 25447
267 1 1 . 1 1 56 56 ALA CA C 56 53.474 53.474 54.587 -1.113 25447
268 1 1 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.421 0.823 25447
269 1 1 . 1 1 56 56 ALA H H 56 8.641 8.641 8.983 -0.342 25447
270 1 1 . 1 1 57 57 ASP N N 57 116.395 116.395 117.275 -0.880 25447
271 1 1 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.362 0.117 25447
272 1 1 . 1 1 57 57 ASP CA C 57 55.226 55.226 56.393 -1.167 25447
273 1 1 . 1 1 57 57 ASP CB C 57 40.922 40.922 39.963 0.959 25447
274 1 1 . 1 1 57 57 ASP H H 57 8.337 8.337 8.561 -0.224 25447
275 1 1 . 1 1 58 58 ASP N N 58 118.557 118.557 118.834 -0.277 25447
276 1 1 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.431 0.205 25447
277 1 1 . 1 1 58 58 ASP CA C 58 55.144 55.144 55.803 -0.659 25447
278 1 1 . 1 1 58 58 ASP CB C 58 41.504 41.504 41.563 -0.059 25447
279 1 1 . 1 1 58 58 ASP H H 58 8.027 8.027 7.942 0.085 25447
280 1 1 . 1 1 59 59 VAL N N 59 118.898 118.898 118.433 0.465 25447
281 1 1 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.266 -0.090 25447
282 1 1 . 1 1 59 59 VAL CA C 59 62.300 62.300 61.133 1.167 25447
283 1 1 . 1 1 59 59 VAL CB C 59 33.078 33.078 34.868 -1.790 25447
284 1 1 . 1 1 59 59 VAL H H 59 7.716 7.716 7.488 0.228 25447
285 1 1 . 1 1 60 60 GLU N N 60 122.888 122.888 126.534 -3.646 25447
286 1 1 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.424 -0.140 25447
287 1 1 . 1 1 60 60 GLU CA C 60 56.546 56.546 55.945 0.601 25447
288 1 1 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.583 -0.801 25447
289 1 1 . 1 1 60 60 GLU H H 60 8.367 8.367 8.395 -0.028 25447
290 1 1 . 1 1 61 61 LEU N N 61 124.827 124.827 125.049 -0.222 25447
291 1 1 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.458 -0.100 25447
292 1 1 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.300 0.516 25447
293 1 1 . 1 1 61 61 LEU CB C 61 41.937 41.937 42.547 -0.610 25447
294 1 1 . 1 1 61 61 LEU H H 61 8.198 8.198 8.402 -0.204 25447
295 1 1 . 1 1 62 62 SER N N 62 118.715 118.715 119.454 -0.739 25447
296 1 1 . 1 1 62 62 SER HA H 62 4.809 4.809 4.957 -0.148 25447
297 1 1 . 1 1 62 62 SER CA C 62 55.732 55.732 55.603 0.129 25447
298 1 1 . 1 1 62 62 SER CB C 62 64.017 64.017 65.029 -1.012 25447
299 1 1 . 1 1 62 62 SER H H 62 8.137 8.137 8.291 -0.154 25447
300 1 1 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.305 -0.052 25447
301 1 1 . 1 1 63 63 PRO CA C 63 64.896 64.896 65.154 -0.258 25447
302 1 1 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.830 0.222 25447
303 1 1 . 1 1 64 64 GLU N N 64 116.554 116.554 119.127 -2.573 25447
304 1 1 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.151 -0.278 25447
305 1 1 . 1 1 64 64 GLU CA C 64 58.719 58.719 58.876 -0.157 25447
306 1 1 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.250 -0.569 25447
307 1 1 . 1 1 64 64 GLU H H 64 8.316 8.316 8.525 -0.209 25447
308 1 1 . 1 1 65 65 HIS N N 65 115.487 115.487 119.672 -4.185 25447
309 1 1 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.258 0.022 25447
310 1 1 . 1 1 65 65 HIS CA C 65 57.652 57.652 58.145 -0.493 25447
311 1 1 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.465 0.417 25447
312 1 1 . 1 1 65 65 HIS H H 65 7.274 7.274 8.364 -1.090 25447
313 1 1 . 1 1 66 66 PHE N N 66 116.127 116.127 116.690 -0.563 25447
314 1 1 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.685 0.081 25447
315 1 1 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.479 -1.697 25447
316 1 1 . 1 1 66 66 PHE CB C 66 38.908 38.908 37.738 1.170 25447
317 1 1 . 1 1 66 66 PHE H H 66 7.239 7.239 7.840 -0.601 25447
318 1 1 . 1 1 67 67 ARG N N 67 112.468 112.468 119.976 -7.508 25447
319 1 1 . 1 1 67 67 ARG HA H 67 4.085 4.085 3.995 0.090 25447
320 1 1 . 1 1 67 67 ARG CA C 67 58.287 58.287 59.221 -0.934 25447
321 1 1 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.424 1.336 25447
322 1 1 . 1 1 67 67 ARG H H 67 6.628 6.628 7.918 -1.290 25447
323 1 1 . 1 1 68 68 SER N N 68 109.305 109.305 110.360 -1.055 25447
324 1 1 . 1 1 68 68 SER HA H 68 4.980 4.980 4.746 0.234 25447
325 1 1 . 1 1 68 68 SER CA C 68 55.785 55.785 56.842 -1.057 25447
326 1 1 . 1 1 68 68 SER CB C 68 67.691 67.691 66.515 1.176 25447
327 1 1 . 1 1 68 68 SER H H 68 8.145 8.145 7.344 0.801 25447
328 1 1 . 1 1 69 69 ILE N N 69 122.602 122.602 122.690 -0.088 25447
329 1 1 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.720 -0.044 25447
330 1 1 . 1 1 69 69 ILE CA C 69 66.754 66.754 65.290 1.464 25447
331 1 1 . 1 1 69 69 ILE CB C 69 37.296 37.296 37.594 -0.298 25447
332 1 1 . 1 1 69 69 ILE H H 69 9.775 9.775 9.112 0.663 25447
333 1 1 . 1 1 70 70 ARG N N 70 118.764 118.764 118.527 0.237 25447
334 1 1 . 1 1 70 70 ARG HA H 70 3.955 3.955 3.882 0.073 25447
335 1 1 . 1 1 70 70 ARG CA C 70 60.533 60.533 60.156 0.377 25447
336 1 1 . 1 1 70 70 ARG CB C 70 30.418 30.418 29.543 0.875 25447
337 1 1 . 1 1 70 70 ARG H H 70 8.910 8.910 8.485 0.425 25447
338 1 1 . 1 1 71 71 SER N N 71 117.670 117.670 115.260 2.410 25447
339 1 1 . 1 1 71 71 SER HA H 71 4.330 4.330 4.166 0.164 25447
340 1 1 . 1 1 71 71 SER CA C 71 62.287 62.287 61.460 0.827 25447
341 1 1 . 1 1 71 71 SER CB C 71 63.278 63.278 62.765 0.513 25447
342 1 1 . 1 1 71 71 SER H H 71 8.518 8.518 7.455 1.063 25447
343 1 1 . 1 1 72 72 ILE N N 72 127.447 127.447 121.917 5.530 25447
344 1 1 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.533 0.377 25447
345 1 1 . 1 1 72 72 ILE CA C 72 66.811 66.811 63.561 3.250 25447
346 1 1 . 1 1 72 72 ILE CB C 72 38.398 38.398 36.320 2.078 25447
347 1 1 . 1 1 72 72 ILE H H 72 8.762 8.762 7.338 1.424 25447
348 1 1 . 1 1 73 73 ASP N N 73 121.636 121.636 120.632 1.004 25447
349 1 1 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.314 -0.301 25447
350 1 1 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.465 1.683 25447
351 1 1 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.636 2.904 25447
352 1 1 . 1 1 73 73 ASP H H 73 8.677 8.677 7.895 0.782 25447
353 1 1 . 1 1 74 74 ALA N N 74 118.793 118.793 121.820 -3.027 25447
354 1 1 . 1 1 74 74 ALA HA H 74 4.044 4.044 3.970 0.074 25447
355 1 1 . 1 1 74 74 ALA CA C 74 55.321 55.321 55.191 0.131 25447
356 1 1 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.444 -0.499 25447
357 1 1 . 1 1 74 74 ALA H H 74 8.005 8.005 7.569 0.436 25447
358 1 1 . 1 1 75 75 PHE N N 75 121.235 121.235 119.904 1.331 25447
359 1 1 . 1 1 75 75 PHE HA H 75 4.038 4.038 4.073 -0.035 25447
360 1 1 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.933 -0.918 25447
361 1 1 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.421 -0.584 25447
362 1 1 . 1 1 75 75 PHE H H 75 8.353 8.353 8.482 -0.129 25447
363 1 1 . 1 1 76 76 VAL N N 76 120.866 120.866 119.044 1.822 25447
364 1 1 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.358 -0.415 25447
365 1 1 . 1 1 76 76 VAL CA C 76 66.901 66.901 66.889 0.012 25447
366 1 1 . 1 1 76 76 VAL CB C 76 31.247 31.247 31.280 -0.033 25447
367 1 1 . 1 1 76 76 VAL H H 76 8.544 8.544 8.343 0.201 25447
368 1 1 . 1 1 77 77 VAL N N 77 121.408 121.408 119.744 1.664 25447
369 1 1 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.652 -0.157 25447
370 1 1 . 1 1 77 77 VAL CA C 77 66.833 66.833 66.490 0.343 25447
371 1 1 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.177 0.753 25447
372 1 1 . 1 1 77 77 VAL H H 77 8.708 8.708 8.107 0.601 25447
373 1 1 . 1 1 78 78 GLY N N 78 106.402 106.402 107.246 -0.844 25447
374 1 1 . 1 1 78 78 GLY CA C 78 46.840 46.840 47.000 -0.160 25447
375 1 1 . 1 1 78 78 GLY H H 78 7.945 7.945 8.614 -0.669 25447
376 1 1 . 1 1 79 79 ALA N N 79 121.146 121.146 122.267 -1.121 25447
377 1 1 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.965 0.242 25447
378 1 1 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.435 -1.506 25447
379 1 1 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.447 0.814 25447
380 1 1 . 1 1 79 79 ALA H H 79 7.639 7.639 7.473 0.166 25447
381 1 1 . 1 1 80 80 THR N N 80 107.668 107.668 109.590 -1.922 25447
382 1 1 . 1 1 80 80 THR HA H 80 4.443 4.443 4.389 0.054 25447
383 1 1 . 1 1 80 80 THR CA C 80 61.406 61.406 62.654 -1.248 25447
384 1 1 . 1 1 80 80 THR CB C 80 70.767 70.767 70.071 0.696 25447
385 1 1 . 1 1 80 80 THR H H 80 7.449 7.449 7.688 -0.239 25447
386 1 1 . 1 1 81 81 THR N N 81 119.953 119.953 117.143 2.810 25447
387 1 1 . 1 1 81 81 THR HA H 81 4.665 4.665 4.811 -0.146 25447
388 1 1 . 1 1 81 81 THR CA C 81 60.412 60.412 59.303 1.109 25447
389 1 1 . 1 1 81 81 THR CB C 81 70.113 70.113 69.251 0.862 25447
390 1 1 . 1 1 81 81 THR H H 81 7.685 7.685 7.980 -0.295 25447
391 1 1 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.346 0.343 25447
392 1 1 . 1 1 82 82 PRO CA C 82 61.688 61.688 62.383 -0.695 25447
393 1 1 . 1 1 82 82 PRO CB C 82 30.969 30.969 31.163 -0.194 25447
394 1 1 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.328 0.153 25447
395 1 1 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.459 0.472 25447
396 1 1 . 1 1 83 83 PRO CB C 83 32.193 32.193 32.151 0.042 25447
397 1 1 . 1 1 84 84 VAL N N 84 120.691 120.691 121.818 -1.127 25447
398 1 1 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.140 -0.047 25447
399 1 1 . 1 1 84 84 VAL CA C 84 62.339 62.339 61.882 0.457 25447
400 1 1 . 1 1 84 84 VAL CB C 84 32.851 32.851 32.727 0.124 25447
401 1 1 . 1 1 84 84 VAL H H 84 8.257 8.257 8.188 0.069 25447
402 1 1 . 1 1 85 85 GLU N N 85 127.655 127.655 122.487 5.168 25447
403 1 1 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.803 0.481 25447
404 1 1 . 1 1 85 85 GLU CA C 85 56.754 56.754 56.679 0.075 25447
405 1 1 . 1 1 85 85 GLU CB C 85 30.559 30.559 27.965 2.594 25447
406 1 1 . 1 1 85 85 GLU H H 85 8.202 8.202 8.785 -0.583 25447
407 1 1 . 1 1 86 86 ALA N N 86 126.437 126.437 120.520 5.917 25447
408 1 1 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.131 -0.080 25447
409 1 1 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.593 -0.445 25447
410 1 1 . 1 1 86 86 ALA CB C 86 19.460 19.460 19.646 -0.186 25447
411 1 1 . 1 1 86 86 ALA H H 86 8.323 8.323 8.123 0.200 25447
412 1 1 . 1 1 87 87 LYS N N 87 121.796 121.796 122.265 -0.469 25447
413 1 1 . 1 1 87 87 LYS HA H 87 4.347 4.347 3.958 0.389 25447
414 1 1 . 1 1 87 87 LYS CA C 87 56.297 56.297 58.511 -2.214 25447
415 1 1 . 1 1 87 87 LYS CB C 87 33.276 33.276 32.144 1.133 25447
416 1 1 . 1 1 87 87 LYS H H 87 8.333 8.333 8.596 -0.263 25447
417 1 1 . 1 1 88 88 LEU N N 88 125.576 125.576 119.479 6.097 25447
418 1 1 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.117 -0.210 25447
419 1 1 . 1 1 88 88 LEU CA C 88 55.772 55.772 56.767 -0.995 25447
420 1 1 . 1 1 88 88 LEU CB C 88 42.472 42.472 41.790 0.682 25447
421 1 1 . 1 1 88 88 LEU H H 88 8.444 8.444 8.077 0.367 25447
422 1 2 . 1 1 1 1 MET N N 1 120.668 120.668 124.727 -4.059 25447
423 1 2 . 1 1 1 1 MET HA H 1 4.484 4.484 4.395 0.089 25447
424 1 2 . 1 1 1 1 MET CA C 1 55.257 55.257 55.040 0.217 25447
425 1 2 . 1 1 1 1 MET CB C 1 34.517 34.517 31.711 2.806 25447
426 1 2 . 1 1 1 1 MET H H 1 8.313 8.313 8.640 -0.327 25447
427 1 2 . 1 1 2 2 GLN N N 2 123.739 123.739 116.842 6.897 25447
428 1 2 . 1 1 2 2 GLN HA H 2 4.030 4.030 3.670 0.360 25447
429 1 2 . 1 1 2 2 GLN CA C 2 57.874 57.874 56.425 1.449 25447
430 1 2 . 1 1 2 2 GLN CB C 2 29.938 29.938 26.033 3.905 25447
431 1 2 . 1 1 2 2 GLN H H 2 9.455 9.455 8.024 1.431 25447
432 1 2 . 1 1 3 3 HIS N N 3 119.115 119.115 109.185 9.930 25447
433 1 2 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.280 0.836 25447
434 1 2 . 1 1 3 3 HIS CA C 3 55.494 55.494 56.675 -1.181 25447
435 1 2 . 1 1 3 3 HIS CB C 3 31.015 31.015 27.162 3.853 25447
436 1 2 . 1 1 3 3 HIS H H 3 9.783 9.783 8.368 1.415 25447
437 1 2 . 1 1 4 4 ALA N N 4 122.648 122.648 123.110 -0.462 25447
438 1 2 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.149 -0.246 25447
439 1 2 . 1 1 4 4 ALA CA C 4 56.479 56.479 55.414 1.065 25447
440 1 2 . 1 1 4 4 ALA CB C 4 19.194 19.194 18.655 0.538 25447
441 1 2 . 1 1 4 4 ALA H H 4 7.551 7.551 8.432 -0.881 25447
442 1 2 . 1 1 5 5 SER N N 5 112.599 112.599 114.191 -1.592 25447
443 1 2 . 1 1 5 5 SER HA H 5 4.298 4.298 4.282 0.016 25447
444 1 2 . 1 1 5 5 SER CA C 5 62.117 62.117 61.242 0.875 25447
445 1 2 . 1 1 5 5 SER CB C 5 62.334 62.334 62.258 0.076 25447
446 1 2 . 1 1 5 5 SER H H 5 8.736 8.736 8.290 0.446 25447
447 1 2 . 1 1 6 6 VAL N N 6 122.866 122.866 123.457 -0.591 25447
448 1 2 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.814 0.291 25447
449 1 2 . 1 1 6 6 VAL CA C 6 65.732 65.732 66.368 -0.636 25447
450 1 2 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.480 1.257 25447
451 1 2 . 1 1 6 6 VAL H H 6 7.660 7.660 7.763 -0.103 25447
452 1 2 . 1 1 7 7 ILE N N 7 121.715 121.715 119.901 1.814 25447
453 1 2 . 1 1 7 7 ILE HA H 7 4.224 4.224 4.121 0.103 25447
454 1 2 . 1 1 7 7 ILE CA C 7 65.329 65.329 65.829 -0.500 25447
455 1 2 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.517 1.176 25447
456 1 2 . 1 1 7 7 ILE H H 7 8.519 8.519 7.761 0.758 25447
457 1 2 . 1 1 8 8 ALA N N 8 121.373 121.373 121.770 -0.397 25447
458 1 2 . 1 1 8 8 ALA HA H 8 3.895 3.895 4.001 -0.106 25447
459 1 2 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.404 0.853 25447
460 1 2 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.052 0.588 25447
461 1 2 . 1 1 8 8 ALA H H 8 8.940 8.940 7.844 1.096 25447
462 1 2 . 1 1 9 9 GLN N N 9 115.076 115.076 118.622 -3.546 25447
463 1 2 . 1 1 9 9 GLN HA H 9 3.870 3.870 3.895 -0.025 25447
464 1 2 . 1 1 9 9 GLN CA C 9 59.192 59.192 58.937 0.255 25447
465 1 2 . 1 1 9 9 GLN CB C 9 28.138 28.138 28.604 -0.466 25447
466 1 2 . 1 1 9 9 GLN H H 9 7.729 7.729 7.901 -0.172 25447
467 1 2 . 1 1 10 10 PHE N N 10 120.207 120.207 119.308 0.899 25447
468 1 2 . 1 1 10 10 PHE HA H 10 4.085 4.085 3.806 0.279 25447
469 1 2 . 1 1 10 10 PHE CA C 10 60.893 60.893 61.633 -0.740 25447
470 1 2 . 1 1 10 10 PHE CB C 10 38.932 38.932 37.829 1.103 25447
471 1 2 . 1 1 10 10 PHE H H 10 7.301 7.301 7.890 -0.589 25447
472 1 2 . 1 1 11 11 VAL N N 11 117.569 117.569 117.222 0.347 25447
473 1 2 . 1 1 11 11 VAL HA H 11 3.307 3.307 3.885 -0.578 25447
474 1 2 . 1 1 11 11 VAL CA C 11 66.508 66.508 65.812 0.696 25447
475 1 2 . 1 1 11 11 VAL CB C 11 31.487 31.487 31.506 -0.019 25447
476 1 2 . 1 1 11 11 VAL H H 11 8.370 8.370 7.731 0.639 25447
477 1 2 . 1 1 12 12 VAL N N 12 117.909 117.909 121.117 -3.208 25447
478 1 2 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.573 0.168 25447
479 1 2 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.624 -0.748 25447
480 1 2 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.649 -0.337 25447
481 1 2 . 1 1 12 12 VAL H H 12 8.294 8.294 8.276 0.018 25447
482 1 2 . 1 1 13 13 GLU N N 13 117.918 117.918 118.104 -0.186 25447
483 1 2 . 1 1 13 13 GLU HA H 13 3.742 3.742 3.977 -0.235 25447
484 1 2 . 1 1 13 13 GLU CA C 13 59.307 59.307 58.336 0.971 25447
485 1 2 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.169 0.320 25447
486 1 2 . 1 1 13 13 GLU H H 13 7.750 7.750 8.403 -0.653 25447
487 1 2 . 1 1 14 14 GLU N N 14 113.478 113.478 117.877 -4.399 25447
488 1 2 . 1 1 14 14 GLU HA H 14 3.778 3.778 4.125 -0.347 25447
489 1 2 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.693 -1.893 25447
490 1 2 . 1 1 14 14 GLU CB C 14 29.643 29.643 30.221 -0.578 25447
491 1 2 . 1 1 14 14 GLU H H 14 7.603 7.603 7.976 -0.373 25447
492 1 2 . 1 1 15 15 PHE N N 15 114.193 114.193 115.678 -1.485 25447
493 1 2 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.573 0.366 25447
494 1 2 . 1 1 15 15 PHE CA C 15 58.095 58.095 58.515 -0.420 25447
495 1 2 . 1 1 15 15 PHE CB C 15 42.095 42.095 42.217 -0.122 25447
496 1 2 . 1 1 15 15 PHE H H 15 7.908 7.908 7.552 0.356 25447
497 1 2 . 1 1 16 16 LEU N N 16 121.492 121.492 121.731 -0.239 25447
498 1 2 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.794 0.173 25447
499 1 2 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.163 0.214 25447
500 1 2 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.402 1.331 25447
501 1 2 . 1 1 16 16 LEU H H 16 8.015 8.015 7.959 0.056 25447
502 1 2 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.382 0.001 25447
503 1 2 . 1 1 17 17 PRO CA C 17 64.858 64.858 64.061 0.798 25447
504 1 2 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.839 -0.010 25447
505 1 2 . 1 1 18 18 ASP N N 18 116.508 116.508 118.126 -1.618 25447
506 1 2 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.723 -0.155 25447
507 1 2 . 1 1 18 18 ASP CA C 18 54.688 54.688 53.855 0.833 25447
508 1 2 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.495 0.131 25447
509 1 2 . 1 1 18 18 ASP H H 18 8.399 8.399 8.510 -0.111 25447
510 1 2 . 1 1 19 19 VAL N N 19 122.135 122.135 120.875 1.260 25447
511 1 2 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.154 -0.036 25447
512 1 2 . 1 1 19 19 VAL CA C 19 61.293 61.293 60.190 1.103 25447
513 1 2 . 1 1 19 19 VAL CB C 19 33.582 33.582 33.303 0.279 25447
514 1 2 . 1 1 19 19 VAL H H 19 7.760 7.760 7.271 0.489 25447
515 1 2 . 1 1 20 20 ALA N N 20 129.301 129.301 130.929 -1.628 25447
516 1 2 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.498 0.101 25447
517 1 2 . 1 1 20 20 ALA CA C 20 50.270 50.270 50.242 0.028 25447
518 1 2 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.281 -0.853 25447
519 1 2 . 1 1 20 20 ALA H H 20 8.761 8.761 8.333 0.428 25447
520 1 2 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.158 -0.081 25447
521 1 2 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.362 0.841 25447
522 1 2 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.777 -0.369 25447
523 1 2 . 1 1 22 22 ALA N N 22 116.106 116.106 117.932 -1.826 25447
524 1 2 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.130 -0.013 25447
525 1 2 . 1 1 22 22 ALA CA C 22 53.996 53.996 54.159 -0.163 25447
526 1 2 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.214 0.630 25447
527 1 2 . 1 1 22 22 ALA H H 22 8.064 8.064 7.896 0.168 25447
528 1 2 . 1 1 23 23 ASP N N 23 115.541 115.541 118.092 -2.551 25447
529 1 2 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.629 0.048 25447
530 1 2 . 1 1 23 23 ASP CA C 23 54.336 54.336 53.919 0.417 25447
531 1 2 . 1 1 23 23 ASP CB C 23 41.353 41.353 40.938 0.415 25447
532 1 2 . 1 1 23 23 ASP H H 23 8.003 8.003 8.147 -0.144 25447
533 1 2 . 1 1 24 24 VAL N N 24 121.517 121.517 120.672 0.845 25447
534 1 2 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.130 -0.309 25447
535 1 2 . 1 1 24 24 VAL CA C 24 62.345 62.345 62.103 0.242 25447
536 1 2 . 1 1 24 24 VAL CB C 24 31.733 31.733 33.255 -1.522 25447
537 1 2 . 1 1 24 24 VAL H H 24 7.069 7.069 7.420 -0.351 25447
538 1 2 . 1 1 25 25 ASP N N 25 129.329 129.329 127.726 1.603 25447
539 1 2 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.803 -0.229 25447
540 1 2 . 1 1 25 25 ASP CA C 25 54.566 54.566 53.207 1.359 25447
541 1 2 . 1 1 25 25 ASP CB C 25 42.333 42.333 41.743 0.590 25447
542 1 2 . 1 1 25 25 ASP H H 25 8.474 8.474 8.706 -0.232 25447
543 1 2 . 1 1 26 26 VAL N N 26 121.920 121.920 121.113 0.807 25447
544 1 2 . 1 1 26 26 VAL HA H 26 4.108 4.108 3.964 0.144 25447
545 1 2 . 1 1 26 26 VAL CA C 26 64.518 64.518 63.363 1.155 25447
546 1 2 . 1 1 26 26 VAL CB C 26 31.198 31.198 31.639 -0.441 25447
547 1 2 . 1 1 26 26 VAL H H 26 8.591 8.591 8.648 -0.057 25447
548 1 2 . 1 1 27 27 ASP N N 27 116.286 116.286 118.284 -1.998 25447
549 1 2 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.693 0.452 25447
550 1 2 . 1 1 27 27 ASP CA C 27 54.181 54.181 54.478 -0.297 25447
551 1 2 . 1 1 27 27 ASP CB C 27 42.575 42.575 40.770 1.805 25447
552 1 2 . 1 1 27 27 ASP H H 27 8.609 8.609 8.095 0.514 25447
553 1 2 . 1 1 28 28 LEU N N 28 125.116 125.116 122.348 2.768 25447
554 1 2 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.502 -0.491 25447
555 1 2 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.226 1.861 25447
556 1 2 . 1 1 28 28 LEU CB C 28 43.321 43.321 44.029 -0.708 25447
557 1 2 . 1 1 28 28 LEU H H 28 7.374 7.374 7.408 -0.034 25447
558 1 2 . 1 1 29 29 ASP N N 29 125.924 125.924 125.324 0.600 25447
559 1 2 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.786 0.048 25447
560 1 2 . 1 1 29 29 ASP CA C 29 53.920 53.920 54.478 -0.559 25447
561 1 2 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.425 -0.046 25447
562 1 2 . 1 1 29 29 ASP H H 29 8.699 8.699 8.633 0.066 25447
563 1 2 . 1 1 30 30 LEU N N 30 129.975 129.975 123.588 6.387 25447
564 1 2 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.040 -0.123 25447
565 1 2 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.801 -1.413 25447
566 1 2 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.187 0.052 25447
567 1 2 . 1 1 30 30 LEU H H 30 9.718 9.718 7.970 1.748 25447
568 1 2 . 1 1 31 31 VAL N N 31 121.212 121.212 118.493 2.719 25447
569 1 2 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.582 0.611 25447
570 1 2 . 1 1 31 31 VAL CA C 31 64.433 64.433 66.720 -2.287 25447
571 1 2 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.636 0.539 25447
572 1 2 . 1 1 31 31 VAL H H 31 8.163 8.163 7.694 0.469 25447
573 1 2 . 1 1 32 32 ASP N N 32 124.893 124.893 118.776 6.117 25447
574 1 2 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.321 0.037 25447
575 1 2 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.813 0.411 25447
576 1 2 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.070 0.665 25447
577 1 2 . 1 1 32 32 ASP H H 32 9.385 9.385 8.775 0.610 25447
578 1 2 . 1 1 33 33 ASN N N 33 111.484 111.484 116.098 -4.614 25447
579 1 2 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.571 0.149 25447
580 1 2 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.615 0.271 25447
581 1 2 . 1 1 33 33 ASN CB C 33 39.006 39.006 38.825 0.181 25447
582 1 2 . 1 1 33 33 ASN H H 33 7.396 7.396 7.471 -0.075 25447
583 1 2 . 1 1 34 34 GLY N N 34 106.957 106.957 106.223 0.734 25447
584 1 2 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.788 0.819 25447
585 1 2 . 1 1 34 34 GLY H H 34 7.618 7.618 7.857 -0.239 25447
586 1 2 . 1 1 35 35 VAL N N 35 120.424 120.424 118.709 1.715 25447
587 1 2 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.398 0.368 25447
588 1 2 . 1 1 35 35 VAL CA C 35 65.125 65.125 64.572 0.553 25447
589 1 2 . 1 1 35 35 VAL CB C 35 31.879 31.879 32.031 -0.152 25447
590 1 2 . 1 1 35 35 VAL H H 35 7.792 7.792 7.702 0.090 25447
591 1 2 . 1 1 36 36 ILE N N 36 116.364 116.364 119.878 -3.514 25447
592 1 2 . 1 1 36 36 ILE HA H 36 3.737 3.737 3.911 -0.174 25447
593 1 2 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.547 -0.862 25447
594 1 2 . 1 1 36 36 ILE CB C 36 38.807 38.807 37.680 1.127 25447
595 1 2 . 1 1 36 36 ILE H H 36 7.331 7.331 7.799 -0.468 25447
596 1 2 . 1 1 37 37 ASP N N 37 127.306 127.306 127.680 -0.374 25447
597 1 2 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.725 -0.061 25447
598 1 2 . 1 1 37 37 ASP CA C 37 51.616 51.616 53.088 -1.472 25447
599 1 2 . 1 1 37 37 ASP CB C 37 41.209 41.209 42.402 -1.193 25447
600 1 2 . 1 1 37 37 ASP H H 37 7.874 7.874 8.065 -0.191 25447
601 1 2 . 1 1 38 38 ALA N N 38 120.352 120.352 122.881 -2.529 25447
602 1 2 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.120 -0.125 25447
603 1 2 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.134 1.158 25447
604 1 2 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.608 -0.296 25447
605 1 2 . 1 1 38 38 ALA H H 38 8.244 8.244 8.264 -0.020 25447
606 1 2 . 1 1 39 39 LEU N N 39 117.438 117.438 118.548 -1.110 25447
607 1 2 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.142 0.108 25447
608 1 2 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.019 0.336 25447
609 1 2 . 1 1 39 39 LEU CB C 39 41.236 41.236 41.133 0.103 25447
610 1 2 . 1 1 39 39 LEU H H 39 7.688 7.688 8.419 -0.731 25447
611 1 2 . 1 1 40 40 GLY N N 40 112.015 112.015 107.681 4.334 25447
612 1 2 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.134 0.965 25447
613 1 2 . 1 1 40 40 GLY H H 40 8.732 8.732 8.294 0.438 25447
614 1 2 . 1 1 41 41 LEU N N 41 122.983 122.983 123.244 -0.261 25447
615 1 2 . 1 1 41 41 LEU HA H 41 3.851 3.851 3.908 -0.057 25447
616 1 2 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.503 0.829 25447
617 1 2 . 1 1 41 41 LEU CB C 41 41.639 41.639 41.850 -0.211 25447
618 1 2 . 1 1 41 41 LEU H H 41 8.548 8.548 7.661 0.887 25447
619 1 2 . 1 1 42 42 LEU N N 42 116.076 116.076 120.015 -3.939 25447
620 1 2 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.892 0.136 25447
621 1 2 . 1 1 42 42 LEU CA C 42 58.064 58.064 58.511 -0.447 25447
622 1 2 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.795 -0.855 25447
623 1 2 . 1 1 42 42 LEU H H 42 7.168 7.168 7.618 -0.450 25447
624 1 2 . 1 1 43 43 LYS N N 43 119.831 119.831 119.001 0.830 25447
625 1 2 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.026 0.258 25447
626 1 2 . 1 1 43 43 LYS CA C 43 59.644 59.644 59.971 -0.327 25447
627 1 2 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.297 0.230 25447
628 1 2 . 1 1 43 43 LYS H H 43 7.640 7.640 8.346 -0.706 25447
629 1 2 . 1 1 44 44 VAL N N 44 121.046 121.046 120.241 0.805 25447
630 1 2 . 1 1 44 44 VAL HA H 44 3.949 3.949 4.068 -0.119 25447
631 1 2 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.706 -0.063 25447
632 1 2 . 1 1 44 44 VAL H H 44 8.269 8.269 7.770 0.499 25447
633 1 2 . 1 1 45 45 ILE N N 45 119.333 119.333 119.708 -0.375 25447
634 1 2 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.616 -0.212 25447
635 1 2 . 1 1 45 45 ILE CA C 45 66.148 66.148 64.740 1.409 25447
636 1 2 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.278 1.000 25447
637 1 2 . 1 1 45 45 ILE H H 45 8.145 8.145 7.730 0.415 25447
638 1 2 . 1 1 46 46 ALA N N 46 121.213 121.213 123.191 -1.978 25447
639 1 2 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.129 0.128 25447
640 1 2 . 1 1 46 46 ALA CA C 46 55.164 55.164 55.203 -0.039 25447
641 1 2 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.248 0.120 25447
642 1 2 . 1 1 46 46 ALA H H 46 7.792 7.792 8.089 -0.297 25447
643 1 2 . 1 1 47 47 TRP N N 47 121.416 121.416 120.157 1.259 25447
644 1 2 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.452 -0.218 25447
645 1 2 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.438 2.232 25447
646 1 2 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.391 -1.152 25447
647 1 2 . 1 1 47 47 TRP H H 47 8.093 8.093 7.882 0.211 25447
648 1 2 . 1 1 48 48 LEU N N 48 118.963 118.963 120.998 -2.035 25447
649 1 2 . 1 1 48 48 LEU HA H 48 3.586 3.586 2.775 0.811 25447
650 1 2 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.655 0.540 25447
651 1 2 . 1 1 48 48 LEU CB C 48 42.251 42.251 41.148 1.103 25447
652 1 2 . 1 1 48 48 LEU H H 48 8.693 8.693 7.392 1.301 25447
653 1 2 . 1 1 49 49 GLU N N 49 119.131 119.131 117.546 1.585 25447
654 1 2 . 1 1 49 49 GLU HA H 49 4.050 4.050 3.974 0.076 25447
655 1 2 . 1 1 49 49 GLU CA C 49 59.862 59.862 58.902 0.960 25447
656 1 2 . 1 1 49 49 GLU CB C 49 29.586 29.586 28.727 0.859 25447
657 1 2 . 1 1 49 49 GLU H H 49 7.771 7.771 7.738 0.033 25447
658 1 2 . 1 1 50 50 ASP N N 50 119.941 119.941 120.460 -0.519 25447
659 1 2 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.416 -0.179 25447
660 1 2 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.298 1.057 25447
661 1 2 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.806 1.577 25447
662 1 2 . 1 1 50 50 ASP H H 50 7.697 7.697 7.631 0.066 25447
663 1 2 . 1 1 51 51 ARG N N 51 116.911 116.911 117.778 -0.867 25447
664 1 2 . 1 1 51 51 ARG HA H 51 3.736 3.736 4.027 -0.291 25447
665 1 2 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.364 -2.000 25447
666 1 2 . 1 1 51 51 ARG CB C 51 29.315 29.315 30.311 -0.996 25447
667 1 2 . 1 1 51 51 ARG H H 51 8.881 8.881 7.773 1.108 25447
668 1 2 . 1 1 52 52 PHE N N 52 112.328 112.328 116.435 -4.107 25447
669 1 2 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.647 0.028 25447
670 1 2 . 1 1 52 52 PHE CA C 52 57.413 57.413 57.987 -0.574 25447
671 1 2 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.377 1.515 25447
672 1 2 . 1 1 52 52 PHE H H 52 7.284 7.284 7.565 -0.281 25447
673 1 2 . 1 1 53 53 GLY N N 53 109.826 109.826 108.884 0.942 25447
674 1 2 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.641 1.160 25447
675 1 2 . 1 1 53 53 GLY H H 53 7.427 7.427 7.995 -0.568 25447
676 1 2 . 1 1 54 54 ILE N N 54 119.127 119.127 114.757 4.370 25447
677 1 2 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.506 -0.555 25447
678 1 2 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.183 1.502 25447
679 1 2 . 1 1 54 54 ILE CB C 54 39.490 39.490 39.698 -0.208 25447
680 1 2 . 1 1 54 54 ILE H H 54 6.876 6.876 7.473 -0.597 25447
681 1 2 . 1 1 55 55 ALA N N 55 129.823 129.823 124.217 5.606 25447
682 1 2 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.674 -0.260 25447
683 1 2 . 1 1 55 55 ALA CA C 55 51.610 51.610 50.400 1.210 25447
684 1 2 . 1 1 55 55 ALA CB C 55 19.262 19.262 20.481 -1.219 25447
685 1 2 . 1 1 55 55 ALA H H 55 8.499 8.499 8.559 -0.060 25447
686 1 2 . 1 1 56 56 ALA N N 56 126.300 126.300 126.371 -0.071 25447
687 1 2 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.066 0.203 25447
688 1 2 . 1 1 56 56 ALA CA C 56 53.474 53.474 54.272 -0.798 25447
689 1 2 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.466 0.778 25447
690 1 2 . 1 1 56 56 ALA H H 56 8.641 8.641 8.937 -0.296 25447
691 1 2 . 1 1 57 57 ASP N N 57 116.395 116.395 118.074 -1.679 25447
692 1 2 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.360 0.119 25447
693 1 2 . 1 1 57 57 ASP CA C 57 55.226 55.226 56.468 -1.242 25447
694 1 2 . 1 1 57 57 ASP CB C 57 40.922 40.922 39.930 0.992 25447
695 1 2 . 1 1 57 57 ASP H H 57 8.337 8.337 8.615 -0.278 25447
696 1 2 . 1 1 58 58 ASP N N 58 118.557 118.557 118.796 -0.239 25447
697 1 2 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.435 0.201 25447
698 1 2 . 1 1 58 58 ASP CA C 58 55.144 55.144 55.910 -0.766 25447
699 1 2 . 1 1 58 58 ASP CB C 58 41.504 41.504 41.348 0.156 25447
700 1 2 . 1 1 58 58 ASP H H 58 8.027 8.027 7.966 0.061 25447
701 1 2 . 1 1 59 59 VAL N N 59 118.898 118.898 118.124 0.774 25447
702 1 2 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.261 -0.085 25447
703 1 2 . 1 1 59 59 VAL CA C 59 62.300 62.300 61.135 1.165 25447
704 1 2 . 1 1 59 59 VAL CB C 59 33.078 33.078 35.274 -2.196 25447
705 1 2 . 1 1 59 59 VAL H H 59 7.716 7.716 7.493 0.223 25447
706 1 2 . 1 1 60 60 GLU N N 60 122.888 122.888 126.728 -3.840 25447
707 1 2 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.459 -0.175 25447
708 1 2 . 1 1 60 60 GLU CA C 60 56.546 56.546 55.812 0.734 25447
709 1 2 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.635 -0.853 25447
710 1 2 . 1 1 60 60 GLU H H 60 8.367 8.367 8.386 -0.019 25447
711 1 2 . 1 1 61 61 LEU N N 61 124.827 124.827 125.038 -0.211 25447
712 1 2 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.472 -0.114 25447
713 1 2 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.045 0.771 25447
714 1 2 . 1 1 61 61 LEU CB C 61 41.937 41.937 43.068 -1.131 25447
715 1 2 . 1 1 61 61 LEU H H 61 8.198 8.198 8.500 -0.302 25447
716 1 2 . 1 1 62 62 SER N N 62 118.715 118.715 118.682 0.033 25447
717 1 2 . 1 1 62 62 SER HA H 62 4.809 4.809 4.978 -0.169 25447
718 1 2 . 1 1 62 62 SER CA C 62 55.732 55.732 55.275 0.457 25447
719 1 2 . 1 1 62 62 SER CB C 62 64.017 64.017 64.559 -0.542 25447
720 1 2 . 1 1 62 62 SER H H 62 8.137 8.137 8.165 -0.028 25447
721 1 2 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.248 0.005 25447
722 1 2 . 1 1 63 63 PRO CA C 63 64.896 64.896 64.875 0.021 25447
723 1 2 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.697 0.355 25447
724 1 2 . 1 1 64 64 GLU N N 64 116.554 116.554 118.666 -2.112 25447
725 1 2 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.135 -0.262 25447
726 1 2 . 1 1 64 64 GLU CA C 64 58.719 58.719 58.867 -0.148 25447
727 1 2 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.212 -0.531 25447
728 1 2 . 1 1 64 64 GLU H H 64 8.316 8.316 8.472 -0.156 25447
729 1 2 . 1 1 65 65 HIS N N 65 115.487 115.487 119.670 -4.183 25447
730 1 2 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.244 0.036 25447
731 1 2 . 1 1 65 65 HIS CA C 65 57.652 57.652 58.270 -0.618 25447
732 1 2 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.715 0.167 25447
733 1 2 . 1 1 65 65 HIS H H 65 7.274 7.274 8.232 -0.958 25447
734 1 2 . 1 1 66 66 PHE N N 66 116.127 116.127 117.002 -0.875 25447
735 1 2 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.433 0.333 25447
736 1 2 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.837 -2.055 25447
737 1 2 . 1 1 66 66 PHE CB C 66 38.908 38.908 37.340 1.568 25447
738 1 2 . 1 1 66 66 PHE H H 66 7.239 7.239 7.644 -0.405 25447
739 1 2 . 1 1 67 67 ARG N N 67 112.468 112.468 119.267 -6.799 25447
740 1 2 . 1 1 67 67 ARG HA H 67 4.085 4.085 3.939 0.146 25447
741 1 2 . 1 1 67 67 ARG CA C 67 58.287 58.287 59.039 -0.752 25447
742 1 2 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.495 1.265 25447
743 1 2 . 1 1 67 67 ARG H H 67 6.628 6.628 7.892 -1.264 25447
744 1 2 . 1 1 68 68 SER N N 68 109.305 109.305 109.691 -0.386 25447
745 1 2 . 1 1 68 68 SER HA H 68 4.980 4.980 4.691 0.289 25447
746 1 2 . 1 1 68 68 SER CA C 68 55.785 55.785 56.963 -1.178 25447
747 1 2 . 1 1 68 68 SER CB C 68 67.691 67.691 65.113 2.578 25447
748 1 2 . 1 1 68 68 SER H H 68 8.145 8.145 7.530 0.615 25447
749 1 2 . 1 1 69 69 ILE N N 69 122.602 122.602 124.175 -1.573 25447
750 1 2 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.726 -0.050 25447
751 1 2 . 1 1 69 69 ILE CA C 69 66.754 66.754 65.560 1.194 25447
752 1 2 . 1 1 69 69 ILE CB C 69 37.296 37.296 37.466 -0.170 25447
753 1 2 . 1 1 69 69 ILE H H 69 9.775 9.775 9.216 0.559 25447
754 1 2 . 1 1 70 70 ARG N N 70 118.764 118.764 119.086 -0.322 25447
755 1 2 . 1 1 70 70 ARG HA H 70 3.955 3.955 3.977 -0.022 25447
756 1 2 . 1 1 70 70 ARG CA C 70 60.533 60.533 59.635 0.898 25447
757 1 2 . 1 1 70 70 ARG CB C 70 30.418 30.418 29.392 1.026 25447
758 1 2 . 1 1 70 70 ARG H H 70 8.910 8.910 7.767 1.143 25447
759 1 2 . 1 1 71 71 SER N N 71 117.670 117.670 116.833 0.837 25447
760 1 2 . 1 1 71 71 SER HA H 71 4.330 4.330 4.294 0.036 25447
761 1 2 . 1 1 71 71 SER CA C 71 62.287 62.287 61.178 1.109 25447
762 1 2 . 1 1 71 71 SER CB C 71 63.278 63.278 62.123 1.155 25447
763 1 2 . 1 1 71 71 SER H H 71 8.518 8.518 7.544 0.974 25447
764 1 2 . 1 1 72 72 ILE N N 72 127.447 127.447 124.479 2.968 25447
765 1 2 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.855 0.055 25447
766 1 2 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.200 1.611 25447
767 1 2 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.496 0.902 25447
768 1 2 . 1 1 72 72 ILE H H 72 8.762 8.762 7.474 1.288 25447
769 1 2 . 1 1 73 73 ASP N N 73 121.636 121.636 120.352 1.284 25447
770 1 2 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.325 -0.312 25447
771 1 2 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.369 1.779 25447
772 1 2 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.645 2.895 25447
773 1 2 . 1 1 73 73 ASP H H 73 8.677 8.677 8.133 0.544 25447
774 1 2 . 1 1 74 74 ALA N N 74 118.793 118.793 122.088 -3.295 25447
775 1 2 . 1 1 74 74 ALA HA H 74 4.044 4.044 4.088 -0.044 25447
776 1 2 . 1 1 74 74 ALA CA C 74 55.321 55.321 55.080 0.241 25447
777 1 2 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.316 -0.371 25447
778 1 2 . 1 1 74 74 ALA H H 74 8.005 8.005 7.760 0.245 25447
779 1 2 . 1 1 75 75 PHE N N 75 121.235 121.235 119.857 1.378 25447
780 1 2 . 1 1 75 75 PHE HA H 75 4.038 4.038 4.023 0.015 25447
781 1 2 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.779 -0.764 25447
782 1 2 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.373 -0.536 25447
783 1 2 . 1 1 75 75 PHE H H 75 8.353 8.353 8.339 0.014 25447
784 1 2 . 1 1 76 76 VAL N N 76 120.866 120.866 118.346 2.520 25447
785 1 2 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.349 -0.406 25447
786 1 2 . 1 1 76 76 VAL CA C 76 66.901 66.901 66.799 0.102 25447
787 1 2 . 1 1 76 76 VAL CB C 76 31.247 31.247 31.349 -0.102 25447
788 1 2 . 1 1 76 76 VAL H H 76 8.544 8.544 8.392 0.152 25447
789 1 2 . 1 1 77 77 VAL N N 77 121.408 121.408 119.425 1.983 25447
790 1 2 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.683 -0.188 25447
791 1 2 . 1 1 77 77 VAL CA C 77 66.833 66.833 65.688 1.145 25447
792 1 2 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.191 0.739 25447
793 1 2 . 1 1 77 77 VAL H H 77 8.708 8.708 8.115 0.593 25447
794 1 2 . 1 1 78 78 GLY N N 78 106.402 106.402 106.295 0.107 25447
795 1 2 . 1 1 78 78 GLY CA C 78 46.840 46.840 46.796 0.044 25447
796 1 2 . 1 1 78 78 GLY H H 78 7.945 7.945 8.436 -0.491 25447
797 1 2 . 1 1 79 79 ALA N N 79 121.146 121.146 121.976 -0.830 25447
798 1 2 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.981 0.226 25447
799 1 2 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.025 -1.096 25447
800 1 2 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.772 0.489 25447
801 1 2 . 1 1 79 79 ALA H H 79 7.639 7.639 7.165 0.473 25447
802 1 2 . 1 1 80 80 THR N N 80 107.668 107.668 107.045 0.623 25447
803 1 2 . 1 1 80 80 THR HA H 80 4.443 4.443 4.443 0.000 25447
804 1 2 . 1 1 80 80 THR CA C 80 61.406 61.406 62.129 -0.723 25447
805 1 2 . 1 1 80 80 THR CB C 80 70.767 70.767 70.318 0.449 25447
806 1 2 . 1 1 80 80 THR H H 80 7.449 7.449 7.821 -0.372 25447
807 1 2 . 1 1 81 81 THR N N 81 119.953 119.953 117.390 2.563 25447
808 1 2 . 1 1 81 81 THR HA H 81 4.665 4.665 4.860 -0.195 25447
809 1 2 . 1 1 81 81 THR CA C 81 60.412 60.412 59.170 1.242 25447
810 1 2 . 1 1 81 81 THR CB C 81 70.113 70.113 69.892 0.221 25447
811 1 2 . 1 1 81 81 THR H H 81 7.685 7.685 8.306 -0.621 25447
812 1 2 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.525 0.164 25447
813 1 2 . 1 1 82 82 PRO CA C 82 61.688 61.688 62.083 -0.395 25447
814 1 2 . 1 1 82 82 PRO CB C 82 30.969 30.969 30.857 0.112 25447
815 1 2 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.481 0.000 25447
816 1 2 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.484 0.446 25447
817 1 2 . 1 1 83 83 PRO CB C 83 32.193 32.193 32.566 -0.373 25447
818 1 2 . 1 1 84 84 VAL N N 84 120.691 120.691 118.354 2.337 25447
819 1 2 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.275 -0.182 25447
820 1 2 . 1 1 84 84 VAL CA C 84 62.339 62.339 60.868 1.471 25447
821 1 2 . 1 1 84 84 VAL CB C 84 32.851 32.851 32.928 -0.077 25447
822 1 2 . 1 1 84 84 VAL H H 84 8.257 8.257 7.971 0.286 25447
823 1 2 . 1 1 85 85 GLU N N 85 127.655 127.655 124.649 3.006 25447
824 1 2 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.837 0.447 25447
825 1 2 . 1 1 85 85 GLU CA C 85 56.754 56.754 56.174 0.580 25447
826 1 2 . 1 1 85 85 GLU CB C 85 30.559 30.559 29.640 0.919 25447
827 1 2 . 1 1 85 85 GLU H H 85 8.202 8.202 8.688 -0.486 25447
828 1 2 . 1 1 86 86 ALA N N 86 126.437 126.437 122.618 3.819 25447
829 1 2 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.176 -0.125 25447
830 1 2 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.820 -0.672 25447
831 1 2 . 1 1 86 86 ALA CB C 86 19.460 19.460 19.474 -0.014 25447
832 1 2 . 1 1 86 86 ALA H H 86 8.323 8.323 8.177 0.146 25447
833 1 2 . 1 1 87 87 LYS N N 87 121.796 121.796 121.829 -0.033 25447
834 1 2 . 1 1 87 87 LYS HA H 87 4.347 4.347 4.050 0.297 25447
835 1 2 . 1 1 87 87 LYS CA C 87 56.297 56.297 57.898 -1.601 25447
836 1 2 . 1 1 87 87 LYS CB C 87 33.276 33.276 32.616 0.660 25447
837 1 2 . 1 1 87 87 LYS H H 87 8.333 8.333 8.520 -0.187 25447
838 1 2 . 1 1 88 88 LEU N N 88 125.576 125.576 120.561 5.015 25447
839 1 2 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.456 -0.549 25447
840 1 2 . 1 1 88 88 LEU CA C 88 55.772 55.772 54.754 1.018 25447
841 1 2 . 1 1 88 88 LEU CB C 88 42.472 42.472 42.362 0.110 25447
842 1 2 . 1 1 88 88 LEU H H 88 8.444 8.444 7.644 0.800 25447
843 1 3 . 1 1 1 1 MET N N 1 120.668 120.668 121.258 -0.590 25447
844 1 3 . 1 1 1 1 MET HA H 1 4.484 4.484 4.657 -0.173 25447
845 1 3 . 1 1 1 1 MET CA C 1 55.257 55.257 55.072 0.186 25447
846 1 3 . 1 1 1 1 MET CB C 1 34.517 34.517 34.106 0.411 25447
847 1 3 . 1 1 1 1 MET H H 1 8.313 8.313 8.094 0.219 25447
848 1 3 . 1 1 2 2 GLN N N 2 123.739 123.739 118.393 5.346 25447
849 1 3 . 1 1 2 2 GLN HA H 2 4.030 4.030 4.544 -0.514 25447
850 1 3 . 1 1 2 2 GLN CA C 2 57.874 57.874 54.865 3.009 25447
851 1 3 . 1 1 2 2 GLN CB C 2 29.938 29.938 29.750 0.188 25447
852 1 3 . 1 1 2 2 GLN H H 2 9.455 9.455 8.425 1.030 25447
853 1 3 . 1 1 3 3 HIS N N 3 119.115 119.115 118.761 0.354 25447
854 1 3 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.137 0.979 25447
855 1 3 . 1 1 3 3 HIS CA C 3 55.494 55.494 57.246 -1.752 25447
856 1 3 . 1 1 3 3 HIS CB C 3 31.015 31.015 28.442 2.573 25447
857 1 3 . 1 1 3 3 HIS H H 3 9.783 9.783 8.691 1.092 25447
858 1 3 . 1 1 4 4 ALA N N 4 122.648 122.648 121.452 1.196 25447
859 1 3 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.017 -0.114 25447
860 1 3 . 1 1 4 4 ALA CA C 4 56.479 56.479 55.127 1.351 25447
861 1 3 . 1 1 4 4 ALA CB C 4 19.194 19.194 18.476 0.718 25447
862 1 3 . 1 1 4 4 ALA H H 4 7.551 7.551 8.651 -1.100 25447
863 1 3 . 1 1 5 5 SER N N 5 112.599 112.599 113.759 -1.160 25447
864 1 3 . 1 1 5 5 SER HA H 5 4.298 4.298 4.251 0.047 25447
865 1 3 . 1 1 5 5 SER CA C 5 62.117 62.117 61.780 0.337 25447
866 1 3 . 1 1 5 5 SER CB C 5 62.334 62.334 62.408 -0.075 25447
867 1 3 . 1 1 5 5 SER H H 5 8.736 8.736 8.530 0.206 25447
868 1 3 . 1 1 6 6 VAL N N 6 122.866 122.866 122.668 0.198 25447
869 1 3 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.798 0.307 25447
870 1 3 . 1 1 6 6 VAL CA C 6 65.732 65.732 65.891 -0.159 25447
871 1 3 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.608 1.129 25447
872 1 3 . 1 1 6 6 VAL H H 6 7.660 7.660 7.581 0.079 25447
873 1 3 . 1 1 7 7 ILE N N 7 121.715 121.715 120.054 1.661 25447
874 1 3 . 1 1 7 7 ILE HA H 7 4.224 4.224 4.104 0.120 25447
875 1 3 . 1 1 7 7 ILE CA C 7 65.329 65.329 66.093 -0.764 25447
876 1 3 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.523 1.170 25447
877 1 3 . 1 1 7 7 ILE H H 7 8.519 8.519 7.766 0.753 25447
878 1 3 . 1 1 8 8 ALA N N 8 121.373 121.373 121.301 0.072 25447
879 1 3 . 1 1 8 8 ALA HA H 8 3.895 3.895 4.024 -0.129 25447
880 1 3 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.310 0.947 25447
881 1 3 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.004 0.636 25447
882 1 3 . 1 1 8 8 ALA H H 8 8.940 8.940 8.142 0.798 25447
883 1 3 . 1 1 9 9 GLN N N 9 115.076 115.076 119.227 -4.151 25447
884 1 3 . 1 1 9 9 GLN HA H 9 3.870 3.870 3.913 -0.043 25447
885 1 3 . 1 1 9 9 GLN CA C 9 59.192 59.192 58.982 0.210 25447
886 1 3 . 1 1 9 9 GLN CB C 9 28.138 28.138 28.555 -0.417 25447
887 1 3 . 1 1 9 9 GLN H H 9 7.729 7.729 8.195 -0.466 25447
888 1 3 . 1 1 10 10 PHE N N 10 120.207 120.207 118.052 2.155 25447
889 1 3 . 1 1 10 10 PHE HA H 10 4.085 4.085 3.918 0.167 25447
890 1 3 . 1 1 10 10 PHE CA C 10 60.893 60.893 61.387 -0.494 25447
891 1 3 . 1 1 10 10 PHE CB C 10 38.932 38.932 38.276 0.656 25447
892 1 3 . 1 1 10 10 PHE H H 10 7.301 7.301 7.766 -0.465 25447
893 1 3 . 1 1 11 11 VAL N N 11 117.569 117.569 118.721 -1.152 25447
894 1 3 . 1 1 11 11 VAL HA H 11 3.307 3.307 3.868 -0.561 25447
895 1 3 . 1 1 11 11 VAL CA C 11 66.508 66.508 65.746 0.762 25447
896 1 3 . 1 1 11 11 VAL CB C 11 31.487 31.487 32.156 -0.669 25447
897 1 3 . 1 1 11 11 VAL H H 11 8.370 8.370 7.784 0.586 25447
898 1 3 . 1 1 12 12 VAL N N 12 117.909 117.909 116.613 1.296 25447
899 1 3 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.708 0.033 25447
900 1 3 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.261 -0.385 25447
901 1 3 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.113 0.199 25447
902 1 3 . 1 1 12 12 VAL H H 12 8.294 8.294 8.031 0.263 25447
903 1 3 . 1 1 13 13 GLU N N 13 117.918 117.918 119.351 -1.433 25447
904 1 3 . 1 1 13 13 GLU HA H 13 3.742 3.742 3.937 -0.195 25447
905 1 3 . 1 1 13 13 GLU CA C 13 59.307 59.307 58.697 0.610 25447
906 1 3 . 1 1 13 13 GLU CB C 13 29.489 29.489 28.978 0.511 25447
907 1 3 . 1 1 13 13 GLU H H 13 7.750 7.750 7.990 -0.240 25447
908 1 3 . 1 1 14 14 GLU N N 14 113.478 113.478 117.189 -3.711 25447
909 1 3 . 1 1 14 14 GLU HA H 14 3.778 3.778 4.109 -0.331 25447
910 1 3 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.686 -1.886 25447
911 1 3 . 1 1 14 14 GLU CB C 14 29.643 29.643 30.097 -0.454 25447
912 1 3 . 1 1 14 14 GLU H H 14 7.603 7.603 8.203 -0.600 25447
913 1 3 . 1 1 15 15 PHE N N 15 114.193 114.193 114.599 -0.406 25447
914 1 3 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.598 0.341 25447
915 1 3 . 1 1 15 15 PHE CA C 15 58.095 58.095 58.323 -0.228 25447
916 1 3 . 1 1 15 15 PHE CB C 15 42.095 42.095 42.265 -0.170 25447
917 1 3 . 1 1 15 15 PHE H H 15 7.908 7.908 7.490 0.418 25447
918 1 3 . 1 1 16 16 LEU N N 16 121.492 121.492 121.836 -0.344 25447
919 1 3 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.766 0.201 25447
920 1 3 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.234 0.143 25447
921 1 3 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.481 1.252 25447
922 1 3 . 1 1 16 16 LEU H H 16 8.015 8.015 8.313 -0.298 25447
923 1 3 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.354 0.029 25447
924 1 3 . 1 1 17 17 PRO CA C 17 64.858 64.858 64.238 0.620 25447
925 1 3 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.856 -0.027 25447
926 1 3 . 1 1 18 18 ASP N N 18 116.508 116.508 117.502 -0.994 25447
927 1 3 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.555 0.013 25447
928 1 3 . 1 1 18 18 ASP CA C 18 54.688 54.688 52.979 1.709 25447
929 1 3 . 1 1 18 18 ASP CB C 18 40.626 40.626 39.773 0.853 25447
930 1 3 . 1 1 18 18 ASP H H 18 8.399 8.399 8.501 -0.102 25447
931 1 3 . 1 1 19 19 VAL N N 19 122.135 122.135 121.410 0.725 25447
932 1 3 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.126 -0.008 25447
933 1 3 . 1 1 19 19 VAL CA C 19 61.293 61.293 61.025 0.268 25447
934 1 3 . 1 1 19 19 VAL CB C 19 33.582 33.582 33.459 0.123 25447
935 1 3 . 1 1 19 19 VAL H H 19 7.760 7.760 7.186 0.574 25447
936 1 3 . 1 1 20 20 ALA N N 20 129.301 129.301 131.341 -2.040 25447
937 1 3 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.475 0.124 25447
938 1 3 . 1 1 20 20 ALA CA C 20 50.270 50.270 50.325 -0.055 25447
939 1 3 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.232 -0.804 25447
940 1 3 . 1 1 20 20 ALA H H 20 8.761 8.761 8.338 0.423 25447
941 1 3 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.152 -0.075 25447
942 1 3 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.464 0.739 25447
943 1 3 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.760 -0.352 25447
944 1 3 . 1 1 22 22 ALA N N 22 116.106 116.106 116.734 -0.628 25447
945 1 3 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.147 -0.030 25447
946 1 3 . 1 1 22 22 ALA CA C 22 53.996 53.996 53.893 0.103 25447
947 1 3 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.147 0.697 25447
948 1 3 . 1 1 22 22 ALA H H 22 8.064 8.064 7.939 0.125 25447
949 1 3 . 1 1 23 23 ASP N N 23 115.541 115.541 117.734 -2.193 25447
950 1 3 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.628 0.049 25447
951 1 3 . 1 1 23 23 ASP CA C 23 54.336 54.336 54.140 0.196 25447
952 1 3 . 1 1 23 23 ASP CB C 23 41.353 41.353 41.212 0.141 25447
953 1 3 . 1 1 23 23 ASP H H 23 8.003 8.003 8.148 -0.145 25447
954 1 3 . 1 1 24 24 VAL N N 24 121.517 121.517 120.447 1.070 25447
955 1 3 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.176 -0.355 25447
956 1 3 . 1 1 24 24 VAL CA C 24 62.345 62.345 61.471 0.874 25447
957 1 3 . 1 1 24 24 VAL CB C 24 31.733 31.733 32.989 -1.256 25447
958 1 3 . 1 1 24 24 VAL H H 24 7.069 7.069 7.375 -0.306 25447
959 1 3 . 1 1 25 25 ASP N N 25 129.329 129.329 126.376 2.953 25447
960 1 3 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.732 -0.158 25447
961 1 3 . 1 1 25 25 ASP CA C 25 54.566 54.566 53.076 1.490 25447
962 1 3 . 1 1 25 25 ASP CB C 25 42.333 42.333 42.102 0.231 25447
963 1 3 . 1 1 25 25 ASP H H 25 8.474 8.474 8.672 -0.198 25447
964 1 3 . 1 1 26 26 VAL N N 26 121.920 121.920 122.584 -0.664 25447
965 1 3 . 1 1 26 26 VAL HA H 26 4.108 4.108 4.116 -0.008 25447
966 1 3 . 1 1 26 26 VAL CA C 26 64.518 64.518 63.409 1.109 25447
967 1 3 . 1 1 26 26 VAL CB C 26 31.198 31.198 31.639 -0.441 25447
968 1 3 . 1 1 26 26 VAL H H 26 8.591 8.591 8.714 -0.123 25447
969 1 3 . 1 1 27 27 ASP N N 27 116.286 116.286 119.427 -3.141 25447
970 1 3 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.686 0.459 25447
971 1 3 . 1 1 27 27 ASP CA C 27 54.181 54.181 55.374 -1.194 25447
972 1 3 . 1 1 27 27 ASP CB C 27 42.575 42.575 41.705 0.870 25447
973 1 3 . 1 1 27 27 ASP H H 27 8.609 8.609 8.227 0.382 25447
974 1 3 . 1 1 28 28 LEU N N 28 125.116 125.116 122.203 2.913 25447
975 1 3 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.400 -0.389 25447
976 1 3 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.584 1.503 25447
977 1 3 . 1 1 28 28 LEU CB C 28 43.321 43.321 43.286 0.035 25447
978 1 3 . 1 1 28 28 LEU H H 28 7.374 7.374 7.347 0.027 25447
979 1 3 . 1 1 29 29 ASP N N 29 125.924 125.924 124.750 1.174 25447
980 1 3 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.629 0.205 25447
981 1 3 . 1 1 29 29 ASP CA C 29 53.920 53.920 54.842 -0.922 25447
982 1 3 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.531 -0.152 25447
983 1 3 . 1 1 29 29 ASP H H 29 8.699 8.699 8.566 0.133 25447
984 1 3 . 1 1 30 30 LEU N N 30 129.975 129.975 126.206 3.769 25447
985 1 3 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.149 -0.232 25447
986 1 3 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.332 -0.944 25447
987 1 3 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.405 -0.166 25447
988 1 3 . 1 1 30 30 LEU H H 30 9.718 9.718 8.243 1.475 25447
989 1 3 . 1 1 31 31 VAL N N 31 121.212 121.212 118.020 3.192 25447
990 1 3 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.613 0.580 25447
991 1 3 . 1 1 31 31 VAL CA C 31 64.433 64.433 66.639 -2.207 25447
992 1 3 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.151 1.024 25447
993 1 3 . 1 1 31 31 VAL H H 31 8.163 8.163 7.459 0.704 25447
994 1 3 . 1 1 32 32 ASP N N 32 124.893 124.893 119.077 5.816 25447
995 1 3 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.343 0.015 25447
996 1 3 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.721 0.504 25447
997 1 3 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.063 0.672 25447
998 1 3 . 1 1 32 32 ASP H H 32 9.385 9.385 8.646 0.739 25447
999 1 3 . 1 1 33 33 ASN N N 33 111.484 111.484 116.339 -4.855 25447
1000 1 3 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.596 0.124 25447
1001 1 3 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.686 0.200 25447
1002 1 3 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.039 -0.033 25447
1003 1 3 . 1 1 33 33 ASN H H 33 7.396 7.396 7.658 -0.262 25447
1004 1 3 . 1 1 34 34 GLY N N 34 106.957 106.957 106.239 0.718 25447
1005 1 3 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.687 0.920 25447
1006 1 3 . 1 1 34 34 GLY H H 34 7.618 7.618 7.973 -0.355 25447
1007 1 3 . 1 1 35 35 VAL N N 35 120.424 120.424 119.126 1.298 25447
1008 1 3 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.589 0.177 25447
1009 1 3 . 1 1 35 35 VAL CA C 35 65.125 65.125 64.687 0.438 25447
1010 1 3 . 1 1 35 35 VAL CB C 35 31.879 31.879 32.061 -0.182 25447
1011 1 3 . 1 1 35 35 VAL H H 35 7.792 7.792 7.772 0.020 25447
1012 1 3 . 1 1 36 36 ILE N N 36 116.364 116.364 120.751 -4.387 25447
1013 1 3 . 1 1 36 36 ILE HA H 36 3.737 3.737 3.923 -0.186 25447
1014 1 3 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.506 -0.821 25447
1015 1 3 . 1 1 36 36 ILE CB C 36 38.807 38.807 37.426 1.381 25447
1016 1 3 . 1 1 36 36 ILE H H 36 7.331 7.331 7.807 -0.476 25447
1017 1 3 . 1 1 37 37 ASP N N 37 127.306 127.306 127.931 -0.625 25447
1018 1 3 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.739 -0.075 25447
1019 1 3 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.703 -1.087 25447
1020 1 3 . 1 1 37 37 ASP CB C 37 41.209 41.209 42.895 -1.685 25447
1021 1 3 . 1 1 37 37 ASP H H 37 7.874 7.874 7.891 -0.017 25447
1022 1 3 . 1 1 38 38 ALA N N 38 120.352 120.352 123.168 -2.816 25447
1023 1 3 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.048 -0.053 25447
1024 1 3 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.403 0.889 25447
1025 1 3 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.593 -0.281 25447
1026 1 3 . 1 1 38 38 ALA H H 38 8.244 8.244 8.365 -0.121 25447
1027 1 3 . 1 1 39 39 LEU N N 39 117.438 117.438 118.177 -0.739 25447
1028 1 3 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.154 0.096 25447
1029 1 3 . 1 1 39 39 LEU CA C 39 57.355 57.355 56.989 0.366 25447
1030 1 3 . 1 1 39 39 LEU CB C 39 41.236 41.236 41.114 0.123 25447
1031 1 3 . 1 1 39 39 LEU H H 39 7.688 7.688 8.388 -0.700 25447
1032 1 3 . 1 1 40 40 GLY N N 40 112.015 112.015 108.057 3.958 25447
1033 1 3 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.145 0.954 25447
1034 1 3 . 1 1 40 40 GLY H H 40 8.732 8.732 8.189 0.543 25447
1035 1 3 . 1 1 41 41 LEU N N 41 122.983 122.983 123.347 -0.364 25447
1036 1 3 . 1 1 41 41 LEU HA H 41 3.851 3.851 3.883 -0.032 25447
1037 1 3 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.737 0.595 25447
1038 1 3 . 1 1 41 41 LEU CB C 41 41.639 41.639 41.852 -0.213 25447
1039 1 3 . 1 1 41 41 LEU H H 41 8.548 8.548 8.369 0.179 25447
1040 1 3 . 1 1 42 42 LEU N N 42 116.076 116.076 119.833 -3.757 25447
1041 1 3 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.918 0.110 25447
1042 1 3 . 1 1 42 42 LEU CA C 42 58.064 58.064 57.975 0.089 25447
1043 1 3 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.478 -0.538 25447
1044 1 3 . 1 1 42 42 LEU H H 42 7.168 7.168 7.586 -0.418 25447
1045 1 3 . 1 1 43 43 LYS N N 43 119.831 119.831 118.967 0.864 25447
1046 1 3 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.024 0.260 25447
1047 1 3 . 1 1 43 43 LYS CA C 43 59.644 59.644 59.915 -0.271 25447
1048 1 3 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.255 0.272 25447
1049 1 3 . 1 1 43 43 LYS H H 43 7.640 7.640 8.270 -0.630 25447
1050 1 3 . 1 1 44 44 VAL N N 44 121.046 121.046 120.326 0.720 25447
1051 1 3 . 1 1 44 44 VAL HA H 44 3.949 3.949 4.045 -0.096 25447
1052 1 3 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.571 0.072 25447
1053 1 3 . 1 1 44 44 VAL H H 44 8.269 8.269 7.782 0.487 25447
1054 1 3 . 1 1 45 45 ILE N N 45 119.333 119.333 119.741 -0.408 25447
1055 1 3 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.633 -0.229 25447
1056 1 3 . 1 1 45 45 ILE CA C 45 66.148 66.148 64.774 1.374 25447
1057 1 3 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.290 0.987 25447
1058 1 3 . 1 1 45 45 ILE H H 45 8.145 8.145 7.772 0.373 25447
1059 1 3 . 1 1 46 46 ALA N N 46 121.213 121.213 123.433 -2.220 25447
1060 1 3 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.105 0.152 25447
1061 1 3 . 1 1 46 46 ALA CA C 46 55.164 55.164 55.200 -0.036 25447
1062 1 3 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.370 -0.003 25447
1063 1 3 . 1 1 46 46 ALA H H 46 7.792 7.792 7.944 -0.152 25447
1064 1 3 . 1 1 47 47 TRP N N 47 121.416 121.416 120.241 1.175 25447
1065 1 3 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.406 -0.172 25447
1066 1 3 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.986 1.684 25447
1067 1 3 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.422 -1.183 25447
1068 1 3 . 1 1 47 47 TRP H H 47 8.093 8.093 7.905 0.188 25447
1069 1 3 . 1 1 48 48 LEU N N 48 118.963 118.963 121.052 -2.089 25447
1070 1 3 . 1 1 48 48 LEU HA H 48 3.586 3.586 2.749 0.837 25447
1071 1 3 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.520 0.675 25447
1072 1 3 . 1 1 48 48 LEU CB C 48 42.251 42.251 41.088 1.163 25447
1073 1 3 . 1 1 48 48 LEU H H 48 8.693 8.693 7.375 1.318 25447
1074 1 3 . 1 1 49 49 GLU N N 49 119.131 119.131 117.546 1.585 25447
1075 1 3 . 1 1 49 49 GLU HA H 49 4.050 4.050 3.986 0.064 25447
1076 1 3 . 1 1 49 49 GLU CA C 49 59.862 59.862 58.921 0.941 25447
1077 1 3 . 1 1 49 49 GLU CB C 49 29.586 29.586 28.738 0.849 25447
1078 1 3 . 1 1 49 49 GLU H H 49 7.771 7.771 7.764 0.007 25447
1079 1 3 . 1 1 50 50 ASP N N 50 119.941 119.941 120.322 -0.381 25447
1080 1 3 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.398 -0.161 25447
1081 1 3 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.105 1.250 25447
1082 1 3 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.756 1.627 25447
1083 1 3 . 1 1 50 50 ASP H H 50 7.697 7.697 7.638 0.059 25447
1084 1 3 . 1 1 51 51 ARG N N 51 116.911 116.911 117.024 -0.113 25447
1085 1 3 . 1 1 51 51 ARG HA H 51 3.736 3.736 3.978 -0.242 25447
1086 1 3 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.051 -1.687 25447
1087 1 3 . 1 1 51 51 ARG CB C 51 29.315 29.315 30.262 -0.947 25447
1088 1 3 . 1 1 51 51 ARG H H 51 8.881 8.881 7.768 1.113 25447
1089 1 3 . 1 1 52 52 PHE N N 52 112.328 112.328 115.373 -3.045 25447
1090 1 3 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.584 0.091 25447
1091 1 3 . 1 1 52 52 PHE CA C 52 57.413 57.413 57.709 -0.296 25447
1092 1 3 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.584 1.308 25447
1093 1 3 . 1 1 52 52 PHE H H 52 7.284 7.284 7.494 -0.210 25447
1094 1 3 . 1 1 53 53 GLY N N 53 109.826 109.826 109.633 0.193 25447
1095 1 3 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.535 1.266 25447
1096 1 3 . 1 1 53 53 GLY H H 53 7.427 7.427 8.184 -0.757 25447
1097 1 3 . 1 1 54 54 ILE N N 54 119.127 119.127 114.947 4.180 25447
1098 1 3 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.488 -0.537 25447
1099 1 3 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.339 1.346 25447
1100 1 3 . 1 1 54 54 ILE CB C 54 39.490 39.490 39.407 0.083 25447
1101 1 3 . 1 1 54 54 ILE H H 54 6.876 6.876 7.501 -0.625 25447
1102 1 3 . 1 1 55 55 ALA N N 55 129.823 129.823 125.193 4.630 25447
1103 1 3 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.563 -0.149 25447
1104 1 3 . 1 1 55 55 ALA CA C 55 51.610 51.610 50.715 0.895 25447
1105 1 3 . 1 1 55 55 ALA CB C 55 19.262 19.262 19.471 -0.209 25447
1106 1 3 . 1 1 55 55 ALA H H 55 8.499 8.499 8.649 -0.150 25447
1107 1 3 . 1 1 56 56 ALA N N 56 126.300 126.300 127.548 -1.248 25447
1108 1 3 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.099 0.170 25447
1109 1 3 . 1 1 56 56 ALA CA C 56 53.474 53.474 54.632 -1.158 25447
1110 1 3 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.536 0.708 25447
1111 1 3 . 1 1 56 56 ALA H H 56 8.641 8.641 9.034 -0.393 25447
1112 1 3 . 1 1 57 57 ASP N N 57 116.395 116.395 116.602 -0.207 25447
1113 1 3 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.406 0.073 25447
1114 1 3 . 1 1 57 57 ASP CA C 57 55.226 55.226 56.162 -0.936 25447
1115 1 3 . 1 1 57 57 ASP CB C 57 40.922 40.922 40.392 0.529 25447
1116 1 3 . 1 1 57 57 ASP H H 57 8.337 8.337 8.518 -0.181 25447
1117 1 3 . 1 1 58 58 ASP N N 58 118.557 118.557 118.758 -0.201 25447
1118 1 3 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.435 0.201 25447
1119 1 3 . 1 1 58 58 ASP CA C 58 55.144 55.144 56.070 -0.926 25447
1120 1 3 . 1 1 58 58 ASP CB C 58 41.504 41.504 41.261 0.243 25447
1121 1 3 . 1 1 58 58 ASP H H 58 8.027 8.027 7.914 0.113 25447
1122 1 3 . 1 1 59 59 VAL N N 59 118.898 118.898 118.583 0.315 25447
1123 1 3 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.256 -0.080 25447
1124 1 3 . 1 1 59 59 VAL CA C 59 62.300 62.300 60.551 1.749 25447
1125 1 3 . 1 1 59 59 VAL CB C 59 33.078 33.078 34.500 -1.422 25447
1126 1 3 . 1 1 59 59 VAL H H 59 7.716 7.716 7.555 0.161 25447
1127 1 3 . 1 1 60 60 GLU N N 60 122.888 122.888 126.004 -3.116 25447
1128 1 3 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.413 -0.129 25447
1129 1 3 . 1 1 60 60 GLU CA C 60 56.546 56.546 56.081 0.465 25447
1130 1 3 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.458 -0.676 25447
1131 1 3 . 1 1 60 60 GLU H H 60 8.367 8.367 8.409 -0.042 25447
1132 1 3 . 1 1 61 61 LEU N N 61 124.827 124.827 125.822 -0.995 25447
1133 1 3 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.552 -0.194 25447
1134 1 3 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.079 0.737 25447
1135 1 3 . 1 1 61 61 LEU CB C 61 41.937 41.937 43.309 -1.372 25447
1136 1 3 . 1 1 61 61 LEU H H 61 8.198 8.198 8.584 -0.386 25447
1137 1 3 . 1 1 62 62 SER N N 62 118.715 118.715 117.721 0.994 25447
1138 1 3 . 1 1 62 62 SER HA H 62 4.809 4.809 4.933 -0.124 25447
1139 1 3 . 1 1 62 62 SER CA C 62 55.732 55.732 55.153 0.579 25447
1140 1 3 . 1 1 62 62 SER CB C 62 64.017 64.017 64.512 -0.495 25447
1141 1 3 . 1 1 62 62 SER H H 62 8.137 8.137 8.287 -0.150 25447
1142 1 3 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.298 -0.045 25447
1143 1 3 . 1 1 63 63 PRO CA C 63 64.896 64.896 65.240 -0.344 25447
1144 1 3 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.768 0.284 25447
1145 1 3 . 1 1 64 64 GLU N N 64 116.554 116.554 118.039 -1.485 25447
1146 1 3 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.120 -0.247 25447
1147 1 3 . 1 1 64 64 GLU CA C 64 58.719 58.719 58.937 -0.218 25447
1148 1 3 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.016 -0.335 25447
1149 1 3 . 1 1 64 64 GLU H H 64 8.316 8.316 8.914 -0.598 25447
1150 1 3 . 1 1 65 65 HIS N N 65 115.487 115.487 119.256 -3.769 25447
1151 1 3 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.227 0.053 25447
1152 1 3 . 1 1 65 65 HIS CA C 65 57.652 57.652 57.799 -0.147 25447
1153 1 3 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.613 0.269 25447
1154 1 3 . 1 1 65 65 HIS H H 65 7.274 7.274 8.258 -0.984 25447
1155 1 3 . 1 1 66 66 PHE N N 66 116.127 116.127 115.911 0.216 25447
1156 1 3 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.445 0.321 25447
1157 1 3 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.654 -1.872 25447
1158 1 3 . 1 1 66 66 PHE CB C 66 38.908 38.908 37.761 1.147 25447
1159 1 3 . 1 1 66 66 PHE H H 66 7.239 7.239 7.649 -0.410 25447
1160 1 3 . 1 1 67 67 ARG N N 67 112.468 112.468 119.768 -7.300 25447
1161 1 3 . 1 1 67 67 ARG HA H 67 4.085 4.085 4.011 0.074 25447
1162 1 3 . 1 1 67 67 ARG CA C 67 58.287 58.287 58.769 -0.482 25447
1163 1 3 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.570 1.190 25447
1164 1 3 . 1 1 67 67 ARG H H 67 6.628 6.628 7.943 -1.315 25447
1165 1 3 . 1 1 68 68 SER N N 68 109.305 109.305 110.856 -1.551 25447
1166 1 3 . 1 1 68 68 SER HA H 68 4.980 4.980 4.888 0.092 25447
1167 1 3 . 1 1 68 68 SER CA C 68 55.785 55.785 56.941 -1.156 25447
1168 1 3 . 1 1 68 68 SER CB C 68 67.691 67.691 65.961 1.730 25447
1169 1 3 . 1 1 68 68 SER H H 68 8.145 8.145 7.484 0.661 25447
1170 1 3 . 1 1 69 69 ILE N N 69 122.602 122.602 122.302 0.300 25447
1171 1 3 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.770 -0.094 25447
1172 1 3 . 1 1 69 69 ILE CA C 69 66.754 66.754 65.407 1.347 25447
1173 1 3 . 1 1 69 69 ILE CB C 69 37.296 37.296 37.707 -0.411 25447
1174 1 3 . 1 1 69 69 ILE H H 69 9.775 9.775 9.010 0.765 25447
1175 1 3 . 1 1 70 70 ARG N N 70 118.764 118.764 119.075 -0.311 25447
1176 1 3 . 1 1 70 70 ARG HA H 70 3.955 3.955 4.066 -0.111 25447
1177 1 3 . 1 1 70 70 ARG CA C 70 60.533 60.533 59.686 0.847 25447
1178 1 3 . 1 1 70 70 ARG CB C 70 30.418 30.418 29.879 0.539 25447
1179 1 3 . 1 1 70 70 ARG H H 70 8.910 8.910 8.585 0.325 25447
1180 1 3 . 1 1 71 71 SER N N 71 117.670 117.670 115.471 2.199 25447
1181 1 3 . 1 1 71 71 SER HA H 71 4.330 4.330 4.329 0.001 25447
1182 1 3 . 1 1 71 71 SER CA C 71 62.287 62.287 61.460 0.827 25447
1183 1 3 . 1 1 71 71 SER CB C 71 63.278 63.278 62.405 0.873 25447
1184 1 3 . 1 1 71 71 SER H H 71 8.518 8.518 7.627 0.891 25447
1185 1 3 . 1 1 72 72 ILE N N 72 127.447 127.447 124.665 2.782 25447
1186 1 3 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.894 0.016 25447
1187 1 3 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.301 1.510 25447
1188 1 3 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.529 0.869 25447
1189 1 3 . 1 1 72 72 ILE H H 72 8.762 8.762 7.387 1.375 25447
1190 1 3 . 1 1 73 73 ASP N N 73 121.636 121.636 120.425 1.211 25447
1191 1 3 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.340 -0.327 25447
1192 1 3 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.411 1.737 25447
1193 1 3 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.684 2.856 25447
1194 1 3 . 1 1 73 73 ASP H H 73 8.677 8.677 8.291 0.386 25447
1195 1 3 . 1 1 74 74 ALA N N 74 118.793 118.793 122.063 -3.270 25447
1196 1 3 . 1 1 74 74 ALA HA H 74 4.044 4.044 4.098 -0.054 25447
1197 1 3 . 1 1 74 74 ALA CA C 74 55.321 55.321 55.066 0.256 25447
1198 1 3 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.345 -0.400 25447
1199 1 3 . 1 1 74 74 ALA H H 74 8.005 8.005 7.755 0.250 25447
1200 1 3 . 1 1 75 75 PHE N N 75 121.235 121.235 119.901 1.334 25447
1201 1 3 . 1 1 75 75 PHE HA H 75 4.038 4.038 4.007 0.031 25447
1202 1 3 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.640 -0.625 25447
1203 1 3 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.254 -0.416 25447
1204 1 3 . 1 1 75 75 PHE H H 75 8.353 8.353 8.439 -0.086 25447
1205 1 3 . 1 1 76 76 VAL N N 76 120.866 120.866 118.864 2.002 25447
1206 1 3 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.329 -0.386 25447
1207 1 3 . 1 1 76 76 VAL CA C 76 66.901 66.901 67.051 -0.150 25447
1208 1 3 . 1 1 76 76 VAL CB C 76 31.247 31.247 31.295 -0.048 25447
1209 1 3 . 1 1 76 76 VAL H H 76 8.544 8.544 8.458 0.086 25447
1210 1 3 . 1 1 77 77 VAL N N 77 121.408 121.408 119.936 1.472 25447
1211 1 3 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.713 -0.218 25447
1212 1 3 . 1 1 77 77 VAL CA C 77 66.833 66.833 65.195 1.638 25447
1213 1 3 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.069 0.861 25447
1214 1 3 . 1 1 77 77 VAL H H 77 8.708 8.708 8.237 0.471 25447
1215 1 3 . 1 1 78 78 GLY N N 78 106.402 106.402 106.745 -0.343 25447
1216 1 3 . 1 1 78 78 GLY CA C 78 46.840 46.840 46.881 -0.041 25447
1217 1 3 . 1 1 78 78 GLY H H 78 7.945 7.945 8.509 -0.564 25447
1218 1 3 . 1 1 79 79 ALA N N 79 121.146 121.146 122.639 -1.493 25447
1219 1 3 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.872 0.335 25447
1220 1 3 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.362 -1.433 25447
1221 1 3 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.184 1.077 25447
1222 1 3 . 1 1 79 79 ALA H H 79 7.639 7.639 7.554 0.085 25447
1223 1 3 . 1 1 80 80 THR N N 80 107.668 107.668 110.277 -2.609 25447
1224 1 3 . 1 1 80 80 THR HA H 80 4.443 4.443 4.250 0.193 25447
1225 1 3 . 1 1 80 80 THR CA C 80 61.406 61.406 63.051 -1.645 25447
1226 1 3 . 1 1 80 80 THR CB C 80 70.767 70.767 69.437 1.330 25447
1227 1 3 . 1 1 80 80 THR H H 80 7.449 7.449 7.668 -0.219 25447
1228 1 3 . 1 1 81 81 THR N N 81 119.953 119.953 116.559 3.394 25447
1229 1 3 . 1 1 81 81 THR HA H 81 4.665 4.665 4.775 -0.110 25447
1230 1 3 . 1 1 81 81 THR CA C 81 60.412 60.412 58.958 1.454 25447
1231 1 3 . 1 1 81 81 THR CB C 81 70.113 70.113 69.447 0.666 25447
1232 1 3 . 1 1 81 81 THR H H 81 7.685 7.685 7.658 0.027 25447
1233 1 3 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.599 0.090 25447
1234 1 3 . 1 1 82 82 PRO CA C 82 61.688 61.688 62.172 -0.485 25447
1235 1 3 . 1 1 82 82 PRO CB C 82 30.969 30.969 30.620 0.348 25447
1236 1 3 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.580 -0.099 25447
1237 1 3 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.331 0.600 25447
1238 1 3 . 1 1 83 83 PRO CB C 83 32.193 32.193 32.894 -0.701 25447
1239 1 3 . 1 1 84 84 VAL N N 84 120.691 120.691 121.239 -0.548 25447
1240 1 3 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.164 -0.071 25447
1241 1 3 . 1 1 84 84 VAL CA C 84 62.339 62.339 62.219 0.120 25447
1242 1 3 . 1 1 84 84 VAL CB C 84 32.851 32.851 32.892 -0.041 25447
1243 1 3 . 1 1 84 84 VAL H H 84 8.257 8.257 8.063 0.194 25447
1244 1 3 . 1 1 85 85 GLU N N 85 127.655 127.655 124.101 3.554 25447
1245 1 3 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.928 0.356 25447
1246 1 3 . 1 1 85 85 GLU CA C 85 56.754 56.754 56.099 0.655 25447
1247 1 3 . 1 1 85 85 GLU CB C 85 30.559 30.559 28.073 2.486 25447
1248 1 3 . 1 1 85 85 GLU H H 85 8.202 8.202 8.733 -0.531 25447
1249 1 3 . 1 1 86 86 ALA N N 86 126.437 126.437 121.959 4.478 25447
1250 1 3 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.194 -0.143 25447
1251 1 3 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.440 -0.292 25447
1252 1 3 . 1 1 86 86 ALA CB C 86 19.460 19.460 19.563 -0.103 25447
1253 1 3 . 1 1 86 86 ALA H H 86 8.323 8.323 8.074 0.249 25447
1254 1 3 . 1 1 87 87 LYS N N 87 121.796 121.796 120.731 1.065 25447
1255 1 3 . 1 1 87 87 LYS HA H 87 4.347 4.347 4.097 0.250 25447
1256 1 3 . 1 1 87 87 LYS CA C 87 56.297 56.297 56.341 -0.044 25447
1257 1 3 . 1 1 87 87 LYS CB C 87 33.276 33.276 33.113 0.163 25447
1258 1 3 . 1 1 87 87 LYS H H 87 8.333 8.333 8.399 -0.066 25447
1259 1 3 . 1 1 88 88 LEU N N 88 125.576 125.576 119.279 6.297 25447
1260 1 3 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.054 -0.147 25447
1261 1 3 . 1 1 88 88 LEU CA C 88 55.772 55.772 56.682 -0.910 25447
1262 1 3 . 1 1 88 88 LEU CB C 88 42.472 42.472 41.919 0.553 25447
1263 1 3 . 1 1 88 88 LEU H H 88 8.444 8.444 8.522 -0.078 25447
1264 1 4 . 1 1 1 1 MET N N 1 120.668 120.668 116.302 4.366 25447
1265 1 4 . 1 1 1 1 MET HA H 1 4.484 4.484 4.718 -0.234 25447
1266 1 4 . 1 1 1 1 MET CA C 1 55.257 55.257 55.252 0.005 25447
1267 1 4 . 1 1 1 1 MET CB C 1 34.517 34.517 33.808 0.709 25447
1268 1 4 . 1 1 1 1 MET H H 1 8.313 8.313 8.070 0.243 25447
1269 1 4 . 1 1 2 2 GLN N N 2 123.739 123.739 124.554 -0.815 25447
1270 1 4 . 1 1 2 2 GLN HA H 2 4.030 4.030 4.207 -0.177 25447
1271 1 4 . 1 1 2 2 GLN CA C 2 57.874 57.874 55.376 2.498 25447
1272 1 4 . 1 1 2 2 GLN CB C 2 29.938 29.938 28.916 1.022 25447
1273 1 4 . 1 1 2 2 GLN H H 2 9.455 9.455 8.277 1.178 25447
1274 1 4 . 1 1 3 3 HIS N N 3 119.115 119.115 120.184 -1.069 25447
1275 1 4 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.200 0.916 25447
1276 1 4 . 1 1 3 3 HIS CA C 3 55.494 55.494 56.131 -0.637 25447
1277 1 4 . 1 1 3 3 HIS CB C 3 31.015 31.015 27.909 3.106 25447
1278 1 4 . 1 1 3 3 HIS H H 3 9.783 9.783 9.062 0.721 25447
1279 1 4 . 1 1 4 4 ALA N N 4 122.648 122.648 121.650 0.998 25447
1280 1 4 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.079 -0.176 25447
1281 1 4 . 1 1 4 4 ALA CA C 4 56.479 56.479 54.924 1.555 25447
1282 1 4 . 1 1 4 4 ALA CB C 4 19.194 19.194 18.836 0.358 25447
1283 1 4 . 1 1 4 4 ALA H H 4 7.551 7.551 8.078 -0.527 25447
1284 1 4 . 1 1 5 5 SER N N 5 112.599 112.599 112.860 -0.261 25447
1285 1 4 . 1 1 5 5 SER HA H 5 4.298 4.298 4.163 0.135 25447
1286 1 4 . 1 1 5 5 SER CA C 5 62.117 62.117 61.159 0.958 25447
1287 1 4 . 1 1 5 5 SER CB C 5 62.334 62.334 62.880 -0.546 25447
1288 1 4 . 1 1 5 5 SER H H 5 8.736 8.736 8.336 0.400 25447
1289 1 4 . 1 1 6 6 VAL N N 6 122.866 122.866 121.539 1.327 25447
1290 1 4 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.772 0.333 25447
1291 1 4 . 1 1 6 6 VAL CA C 6 65.732 65.732 66.384 -0.652 25447
1292 1 4 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.729 1.008 25447
1293 1 4 . 1 1 6 6 VAL H H 6 7.660 7.660 7.525 0.135 25447
1294 1 4 . 1 1 7 7 ILE N N 7 121.715 121.715 120.061 1.654 25447
1295 1 4 . 1 1 7 7 ILE HA H 7 4.224 4.224 4.127 0.097 25447
1296 1 4 . 1 1 7 7 ILE CA C 7 65.329 65.329 65.834 -0.505 25447
1297 1 4 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.526 1.167 25447
1298 1 4 . 1 1 7 7 ILE H H 7 8.519 8.519 7.517 1.002 25447
1299 1 4 . 1 1 8 8 ALA N N 8 121.373 121.373 121.398 -0.025 25447
1300 1 4 . 1 1 8 8 ALA HA H 8 3.895 3.895 4.012 -0.117 25447
1301 1 4 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.344 0.913 25447
1302 1 4 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.004 0.636 25447
1303 1 4 . 1 1 8 8 ALA H H 8 8.940 8.940 8.220 0.720 25447
1304 1 4 . 1 1 9 9 GLN N N 9 115.076 115.076 119.283 -4.207 25447
1305 1 4 . 1 1 9 9 GLN HA H 9 3.870 3.870 3.938 -0.068 25447
1306 1 4 . 1 1 9 9 GLN CA C 9 59.192 59.192 59.000 0.192 25447
1307 1 4 . 1 1 9 9 GLN CB C 9 28.138 28.138 28.614 -0.476 25447
1308 1 4 . 1 1 9 9 GLN H H 9 7.729 7.729 7.906 -0.177 25447
1309 1 4 . 1 1 10 10 PHE N N 10 120.207 120.207 118.816 1.391 25447
1310 1 4 . 1 1 10 10 PHE HA H 10 4.085 4.085 3.878 0.207 25447
1311 1 4 . 1 1 10 10 PHE CA C 10 60.893 60.893 61.773 -0.880 25447
1312 1 4 . 1 1 10 10 PHE CB C 10 38.932 38.932 37.959 0.973 25447
1313 1 4 . 1 1 10 10 PHE H H 10 7.301 7.301 7.852 -0.551 25447
1314 1 4 . 1 1 11 11 VAL N N 11 117.569 117.569 120.041 -2.472 25447
1315 1 4 . 1 1 11 11 VAL HA H 11 3.307 3.307 4.033 -0.726 25447
1316 1 4 . 1 1 11 11 VAL CA C 11 66.508 66.508 65.958 0.550 25447
1317 1 4 . 1 1 11 11 VAL CB C 11 31.487 31.487 32.021 -0.534 25447
1318 1 4 . 1 1 11 11 VAL H H 11 8.370 8.370 7.846 0.524 25447
1319 1 4 . 1 1 12 12 VAL N N 12 117.909 117.909 119.876 -1.967 25447
1320 1 4 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.589 0.152 25447
1321 1 4 . 1 1 12 12 VAL CA C 12 65.876 65.876 67.093 -1.217 25447
1322 1 4 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.635 -0.323 25447
1323 1 4 . 1 1 12 12 VAL H H 12 8.294 8.294 8.064 0.230 25447
1324 1 4 . 1 1 13 13 GLU N N 13 117.918 117.918 118.138 -0.220 25447
1325 1 4 . 1 1 13 13 GLU HA H 13 3.742 3.742 3.965 -0.223 25447
1326 1 4 . 1 1 13 13 GLU CA C 13 59.307 59.307 58.427 0.880 25447
1327 1 4 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.268 0.221 25447
1328 1 4 . 1 1 13 13 GLU H H 13 7.750 7.750 8.152 -0.402 25447
1329 1 4 . 1 1 14 14 GLU N N 14 113.478 113.478 118.148 -4.670 25447
1330 1 4 . 1 1 14 14 GLU HA H 14 3.778 3.778 4.126 -0.348 25447
1331 1 4 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.775 -1.975 25447
1332 1 4 . 1 1 14 14 GLU CB C 14 29.643 29.643 30.285 -0.642 25447
1333 1 4 . 1 1 14 14 GLU H H 14 7.603 7.603 7.984 -0.381 25447
1334 1 4 . 1 1 15 15 PHE N N 15 114.193 114.193 115.803 -1.610 25447
1335 1 4 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.585 0.354 25447
1336 1 4 . 1 1 15 15 PHE CA C 15 58.095 58.095 58.584 -0.488 25447
1337 1 4 . 1 1 15 15 PHE CB C 15 42.095 42.095 42.274 -0.179 25447
1338 1 4 . 1 1 15 15 PHE H H 15 7.908 7.908 7.602 0.306 25447
1339 1 4 . 1 1 16 16 LEU N N 16 121.492 121.492 121.645 -0.153 25447
1340 1 4 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.793 0.174 25447
1341 1 4 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.151 0.226 25447
1342 1 4 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.397 1.336 25447
1343 1 4 . 1 1 16 16 LEU H H 16 8.015 8.015 8.020 -0.005 25447
1344 1 4 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.399 -0.016 25447
1345 1 4 . 1 1 17 17 PRO CA C 17 64.858 64.858 64.041 0.817 25447
1346 1 4 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.770 0.059 25447
1347 1 4 . 1 1 18 18 ASP N N 18 116.508 116.508 117.954 -1.446 25447
1348 1 4 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.617 -0.049 25447
1349 1 4 . 1 1 18 18 ASP CA C 18 54.688 54.688 53.554 1.134 25447
1350 1 4 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.846 -0.220 25447
1351 1 4 . 1 1 18 18 ASP H H 18 8.399 8.399 8.473 -0.073 25447
1352 1 4 . 1 1 19 19 VAL N N 19 122.135 122.135 120.723 1.412 25447
1353 1 4 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.152 -0.034 25447
1354 1 4 . 1 1 19 19 VAL CA C 19 61.293 61.293 60.392 0.901 25447
1355 1 4 . 1 1 19 19 VAL CB C 19 33.582 33.582 33.250 0.332 25447
1356 1 4 . 1 1 19 19 VAL H H 19 7.760 7.760 7.268 0.492 25447
1357 1 4 . 1 1 20 20 ALA N N 20 129.301 129.301 130.641 -1.340 25447
1358 1 4 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.545 0.054 25447
1359 1 4 . 1 1 20 20 ALA CA C 20 50.270 50.270 50.125 0.145 25447
1360 1 4 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.394 -0.966 25447
1361 1 4 . 1 1 20 20 ALA H H 20 8.761 8.761 8.482 0.279 25447
1362 1 4 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.168 -0.091 25447
1363 1 4 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.561 0.642 25447
1364 1 4 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.805 -0.397 25447
1365 1 4 . 1 1 22 22 ALA N N 22 116.106 116.106 118.324 -2.218 25447
1366 1 4 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.153 -0.036 25447
1367 1 4 . 1 1 22 22 ALA CA C 22 53.996 53.996 54.047 -0.051 25447
1368 1 4 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.376 0.468 25447
1369 1 4 . 1 1 22 22 ALA H H 22 8.064 8.064 7.986 0.078 25447
1370 1 4 . 1 1 23 23 ASP N N 23 115.541 115.541 117.021 -1.480 25447
1371 1 4 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.561 0.116 25447
1372 1 4 . 1 1 23 23 ASP CA C 23 54.336 54.336 53.731 0.605 25447
1373 1 4 . 1 1 23 23 ASP CB C 23 41.353 41.353 40.299 1.054 25447
1374 1 4 . 1 1 23 23 ASP H H 23 8.003 8.003 8.154 -0.151 25447
1375 1 4 . 1 1 24 24 VAL N N 24 121.517 121.517 121.002 0.515 25447
1376 1 4 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.144 -0.323 25447
1377 1 4 . 1 1 24 24 VAL CA C 24 62.345 62.345 61.652 0.693 25447
1378 1 4 . 1 1 24 24 VAL CB C 24 31.733 31.733 32.992 -1.259 25447
1379 1 4 . 1 1 24 24 VAL H H 24 7.069 7.069 7.459 -0.390 25447
1380 1 4 . 1 1 25 25 ASP N N 25 129.329 129.329 126.873 2.456 25447
1381 1 4 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.836 -0.262 25447
1382 1 4 . 1 1 25 25 ASP CA C 25 54.566 54.566 53.497 1.069 25447
1383 1 4 . 1 1 25 25 ASP CB C 25 42.333 42.333 41.480 0.853 25447
1384 1 4 . 1 1 25 25 ASP H H 25 8.474 8.474 8.692 -0.218 25447
1385 1 4 . 1 1 26 26 VAL N N 26 121.920 121.920 120.206 1.714 25447
1386 1 4 . 1 1 26 26 VAL HA H 26 4.108 4.108 4.053 0.055 25447
1387 1 4 . 1 1 26 26 VAL CA C 26 64.518 64.518 63.422 1.096 25447
1388 1 4 . 1 1 26 26 VAL CB C 26 31.198 31.198 32.201 -1.003 25447
1389 1 4 . 1 1 26 26 VAL H H 26 8.591 8.591 8.532 0.059 25447
1390 1 4 . 1 1 27 27 ASP N N 27 116.286 116.286 118.968 -2.682 25447
1391 1 4 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.634 0.511 25447
1392 1 4 . 1 1 27 27 ASP CA C 27 54.181 54.181 55.147 -0.966 25447
1393 1 4 . 1 1 27 27 ASP CB C 27 42.575 42.575 40.807 1.768 25447
1394 1 4 . 1 1 27 27 ASP H H 27 8.609 8.609 8.235 0.374 25447
1395 1 4 . 1 1 28 28 LEU N N 28 125.116 125.116 121.932 3.184 25447
1396 1 4 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.452 -0.441 25447
1397 1 4 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.568 1.520 25447
1398 1 4 . 1 1 28 28 LEU CB C 28 43.321 43.321 43.708 -0.387 25447
1399 1 4 . 1 1 28 28 LEU H H 28 7.374 7.374 7.268 0.106 25447
1400 1 4 . 1 1 29 29 ASP N N 29 125.924 125.924 124.860 1.064 25447
1401 1 4 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.619 0.215 25447
1402 1 4 . 1 1 29 29 ASP CA C 29 53.920 53.920 55.081 -1.161 25447
1403 1 4 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.373 0.006 25447
1404 1 4 . 1 1 29 29 ASP H H 29 8.699 8.699 8.640 0.059 25447
1405 1 4 . 1 1 30 30 LEU N N 30 129.975 129.975 124.729 5.246 25447
1406 1 4 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.107 -0.190 25447
1407 1 4 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.449 -1.061 25447
1408 1 4 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.428 -0.189 25447
1409 1 4 . 1 1 30 30 LEU H H 30 9.718 9.718 8.288 1.430 25447
1410 1 4 . 1 1 31 31 VAL N N 31 121.212 121.212 117.855 3.357 25447
1411 1 4 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.574 0.619 25447
1412 1 4 . 1 1 31 31 VAL CA C 31 64.433 64.433 66.512 -2.079 25447
1413 1 4 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.719 0.456 25447
1414 1 4 . 1 1 31 31 VAL H H 31 8.163 8.163 7.593 0.570 25447
1415 1 4 . 1 1 32 32 ASP N N 32 124.893 124.893 118.603 6.290 25447
1416 1 4 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.318 0.040 25447
1417 1 4 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.773 0.452 25447
1418 1 4 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.054 0.681 25447
1419 1 4 . 1 1 32 32 ASP H H 32 9.385 9.385 8.741 0.644 25447
1420 1 4 . 1 1 33 33 ASN N N 33 111.484 111.484 116.340 -4.856 25447
1421 1 4 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.583 0.137 25447
1422 1 4 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.669 0.217 25447
1423 1 4 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.024 -0.018 25447
1424 1 4 . 1 1 33 33 ASN H H 33 7.396 7.396 7.681 -0.285 25447
1425 1 4 . 1 1 34 34 GLY N N 34 106.957 106.957 106.064 0.893 25447
1426 1 4 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.733 0.873 25447
1427 1 4 . 1 1 34 34 GLY H H 34 7.618 7.618 7.934 -0.316 25447
1428 1 4 . 1 1 35 35 VAL N N 35 120.424 120.424 118.545 1.879 25447
1429 1 4 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.491 0.275 25447
1430 1 4 . 1 1 35 35 VAL CA C 35 65.125 65.125 64.838 0.287 25447
1431 1 4 . 1 1 35 35 VAL CB C 35 31.879 31.879 32.161 -0.282 25447
1432 1 4 . 1 1 35 35 VAL H H 35 7.792 7.792 7.748 0.044 25447
1433 1 4 . 1 1 36 36 ILE N N 36 116.364 116.364 120.085 -3.721 25447
1434 1 4 . 1 1 36 36 ILE HA H 36 3.737 3.737 3.875 -0.138 25447
1435 1 4 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.766 -1.081 25447
1436 1 4 . 1 1 36 36 ILE CB C 36 38.807 38.807 37.202 1.605 25447
1437 1 4 . 1 1 36 36 ILE H H 36 7.331 7.331 7.929 -0.598 25447
1438 1 4 . 1 1 37 37 ASP N N 37 127.306 127.306 128.192 -0.886 25447
1439 1 4 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.742 -0.078 25447
1440 1 4 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.967 -1.351 25447
1441 1 4 . 1 1 37 37 ASP CB C 37 41.209 41.209 42.494 -1.285 25447
1442 1 4 . 1 1 37 37 ASP H H 37 7.874 7.874 7.813 0.061 25447
1443 1 4 . 1 1 38 38 ALA N N 38 120.352 120.352 122.954 -2.602 25447
1444 1 4 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.113 -0.118 25447
1445 1 4 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.271 1.021 25447
1446 1 4 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.605 -0.293 25447
1447 1 4 . 1 1 38 38 ALA H H 38 8.244 8.244 8.316 -0.072 25447
1448 1 4 . 1 1 39 39 LEU N N 39 117.438 117.438 118.392 -0.954 25447
1449 1 4 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.182 0.068 25447
1450 1 4 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.020 0.335 25447
1451 1 4 . 1 1 39 39 LEU CB C 39 41.236 41.236 41.156 0.080 25447
1452 1 4 . 1 1 39 39 LEU H H 39 7.688 7.688 8.411 -0.723 25447
1453 1 4 . 1 1 40 40 GLY N N 40 112.015 112.015 107.869 4.146 25447
1454 1 4 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.153 0.946 25447
1455 1 4 . 1 1 40 40 GLY H H 40 8.732 8.732 8.289 0.443 25447
1456 1 4 . 1 1 41 41 LEU N N 41 122.983 122.983 123.229 -0.246 25447
1457 1 4 . 1 1 41 41 LEU HA H 41 3.851 3.851 3.972 -0.121 25447
1458 1 4 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.513 0.819 25447
1459 1 4 . 1 1 41 41 LEU CB C 41 41.639 41.639 41.922 -0.283 25447
1460 1 4 . 1 1 41 41 LEU H H 41 8.548 8.548 8.116 0.432 25447
1461 1 4 . 1 1 42 42 LEU N N 42 116.076 116.076 120.055 -3.979 25447
1462 1 4 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.889 0.139 25447
1463 1 4 . 1 1 42 42 LEU CA C 42 58.064 58.064 58.527 -0.463 25447
1464 1 4 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.789 -0.849 25447
1465 1 4 . 1 1 42 42 LEU H H 42 7.168 7.168 7.634 -0.466 25447
1466 1 4 . 1 1 43 43 LYS N N 43 119.831 119.831 119.048 0.783 25447
1467 1 4 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.042 0.242 25447
1468 1 4 . 1 1 43 43 LYS CA C 43 59.644 59.644 60.097 -0.453 25447
1469 1 4 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.358 0.169 25447
1470 1 4 . 1 1 43 43 LYS H H 43 7.640 7.640 8.299 -0.659 25447
1471 1 4 . 1 1 44 44 VAL N N 44 121.046 121.046 120.235 0.811 25447
1472 1 4 . 1 1 44 44 VAL HA H 44 3.949 3.949 3.943 0.006 25447
1473 1 4 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.947 -0.304 25447
1474 1 4 . 1 1 44 44 VAL H H 44 8.269 8.269 7.755 0.514 25447
1475 1 4 . 1 1 45 45 ILE N N 45 119.333 119.333 119.635 -0.302 25447
1476 1 4 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.700 -0.296 25447
1477 1 4 . 1 1 45 45 ILE CA C 45 66.148 66.148 63.995 2.153 25447
1478 1 4 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.469 0.808 25447
1479 1 4 . 1 1 45 45 ILE H H 45 8.145 8.145 7.738 0.407 25447
1480 1 4 . 1 1 46 46 ALA N N 46 121.213 121.213 123.167 -1.954 25447
1481 1 4 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.043 0.214 25447
1482 1 4 . 1 1 46 46 ALA CA C 46 55.164 55.164 55.350 -0.186 25447
1483 1 4 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.537 -0.169 25447
1484 1 4 . 1 1 46 46 ALA H H 46 7.792 7.792 8.261 -0.469 25447
1485 1 4 . 1 1 47 47 TRP N N 47 121.416 121.416 120.304 1.112 25447
1486 1 4 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.437 -0.203 25447
1487 1 4 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.641 2.029 25447
1488 1 4 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.265 -1.026 25447
1489 1 4 . 1 1 47 47 TRP H H 47 8.093 8.093 7.939 0.154 25447
1490 1 4 . 1 1 48 48 LEU N N 48 118.963 118.963 120.792 -1.829 25447
1491 1 4 . 1 1 48 48 LEU HA H 48 3.586 3.586 2.818 0.768 25447
1492 1 4 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.810 0.385 25447
1493 1 4 . 1 1 48 48 LEU CB C 48 42.251 42.251 41.216 1.035 25447
1494 1 4 . 1 1 48 48 LEU H H 48 8.693 8.693 7.165 1.528 25447
1495 1 4 . 1 1 49 49 GLU N N 49 119.131 119.131 116.889 2.242 25447
1496 1 4 . 1 1 49 49 GLU HA H 49 4.050 4.050 3.975 0.075 25447
1497 1 4 . 1 1 49 49 GLU CA C 49 59.862 59.862 59.010 0.852 25447
1498 1 4 . 1 1 49 49 GLU CB C 49 29.586 29.586 28.892 0.694 25447
1499 1 4 . 1 1 49 49 GLU H H 49 7.771 7.771 7.585 0.186 25447
1500 1 4 . 1 1 50 50 ASP N N 50 119.941 119.941 120.490 -0.549 25447
1501 1 4 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.465 -0.228 25447
1502 1 4 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.735 0.620 25447
1503 1 4 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.732 1.651 25447
1504 1 4 . 1 1 50 50 ASP H H 50 7.697 7.697 7.716 -0.019 25447
1505 1 4 . 1 1 51 51 ARG N N 51 116.911 116.911 119.770 -2.859 25447
1506 1 4 . 1 1 51 51 ARG HA H 51 3.736 3.736 4.091 -0.355 25447
1507 1 4 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.923 -2.559 25447
1508 1 4 . 1 1 51 51 ARG CB C 51 29.315 29.315 30.239 -0.924 25447
1509 1 4 . 1 1 51 51 ARG H H 51 8.881 8.881 7.887 0.994 25447
1510 1 4 . 1 1 52 52 PHE N N 52 112.328 112.328 116.611 -4.283 25447
1511 1 4 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.620 0.055 25447
1512 1 4 . 1 1 52 52 PHE CA C 52 57.413 57.413 58.013 -0.600 25447
1513 1 4 . 1 1 52 52 PHE CB C 52 40.892 40.892 38.989 1.903 25447
1514 1 4 . 1 1 52 52 PHE H H 52 7.284 7.284 7.810 -0.526 25447
1515 1 4 . 1 1 53 53 GLY N N 53 109.826 109.826 108.541 1.285 25447
1516 1 4 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.499 1.302 25447
1517 1 4 . 1 1 53 53 GLY H H 53 7.427 7.427 7.695 -0.268 25447
1518 1 4 . 1 1 54 54 ILE N N 54 119.127 119.127 114.474 4.653 25447
1519 1 4 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.525 -0.574 25447
1520 1 4 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.203 1.482 25447
1521 1 4 . 1 1 54 54 ILE CB C 54 39.490 39.490 40.030 -0.540 25447
1522 1 4 . 1 1 54 54 ILE H H 54 6.876 6.876 7.713 -0.837 25447
1523 1 4 . 1 1 55 55 ALA N N 55 129.823 129.823 124.233 5.590 25447
1524 1 4 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.663 -0.249 25447
1525 1 4 . 1 1 55 55 ALA CA C 55 51.610 51.610 50.245 1.365 25447
1526 1 4 . 1 1 55 55 ALA CB C 55 19.262 19.262 20.688 -1.426 25447
1527 1 4 . 1 1 55 55 ALA H H 55 8.499 8.499 8.260 0.239 25447
1528 1 4 . 1 1 56 56 ALA N N 56 126.300 126.300 126.059 0.241 25447
1529 1 4 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.025 0.244 25447
1530 1 4 . 1 1 56 56 ALA CA C 56 53.474 53.474 54.347 -0.874 25447
1531 1 4 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.307 0.937 25447
1532 1 4 . 1 1 56 56 ALA H H 56 8.641 8.641 8.805 -0.164 25447
1533 1 4 . 1 1 57 57 ASP N N 57 116.395 116.395 117.239 -0.844 25447
1534 1 4 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.389 0.090 25447
1535 1 4 . 1 1 57 57 ASP CA C 57 55.226 55.226 56.385 -1.159 25447
1536 1 4 . 1 1 57 57 ASP CB C 57 40.922 40.922 40.453 0.469 25447
1537 1 4 . 1 1 57 57 ASP H H 57 8.337 8.337 8.508 -0.171 25447
1538 1 4 . 1 1 58 58 ASP N N 58 118.557 118.557 119.141 -0.584 25447
1539 1 4 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.424 0.212 25447
1540 1 4 . 1 1 58 58 ASP CA C 58 55.144 55.144 56.068 -0.923 25447
1541 1 4 . 1 1 58 58 ASP CB C 58 41.504 41.504 41.340 0.164 25447
1542 1 4 . 1 1 58 58 ASP H H 58 8.027 8.027 7.884 0.143 25447
1543 1 4 . 1 1 59 59 VAL N N 59 118.898 118.898 118.165 0.733 25447
1544 1 4 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.250 -0.074 25447
1545 1 4 . 1 1 59 59 VAL CA C 59 62.300 62.300 61.124 1.175 25447
1546 1 4 . 1 1 59 59 VAL CB C 59 33.078 33.078 35.084 -2.006 25447
1547 1 4 . 1 1 59 59 VAL H H 59 7.716 7.716 7.422 0.294 25447
1548 1 4 . 1 1 60 60 GLU N N 60 122.888 122.888 125.530 -2.642 25447
1549 1 4 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.517 -0.233 25447
1550 1 4 . 1 1 60 60 GLU CA C 60 56.546 56.546 55.618 0.928 25447
1551 1 4 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.910 -1.129 25447
1552 1 4 . 1 1 60 60 GLU H H 60 8.367 8.367 8.327 0.040 25447
1553 1 4 . 1 1 61 61 LEU N N 61 124.827 124.827 123.510 1.317 25447
1554 1 4 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.422 -0.064 25447
1555 1 4 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.412 0.404 25447
1556 1 4 . 1 1 61 61 LEU CB C 61 41.937 41.937 43.298 -1.361 25447
1557 1 4 . 1 1 61 61 LEU H H 61 8.198 8.198 8.430 -0.232 25447
1558 1 4 . 1 1 62 62 SER N N 62 118.715 118.715 117.681 1.034 25447
1559 1 4 . 1 1 62 62 SER HA H 62 4.809 4.809 4.959 -0.150 25447
1560 1 4 . 1 1 62 62 SER CA C 62 55.732 55.732 55.041 0.691 25447
1561 1 4 . 1 1 62 62 SER CB C 62 64.017 64.017 64.596 -0.579 25447
1562 1 4 . 1 1 62 62 SER H H 62 8.137 8.137 8.340 -0.203 25447
1563 1 4 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.259 -0.006 25447
1564 1 4 . 1 1 63 63 PRO CA C 63 64.896 64.896 65.221 -0.325 25447
1565 1 4 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.787 0.265 25447
1566 1 4 . 1 1 64 64 GLU N N 64 116.554 116.554 118.259 -1.705 25447
1567 1 4 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.181 -0.308 25447
1568 1 4 . 1 1 64 64 GLU CA C 64 58.719 58.719 59.051 -0.332 25447
1569 1 4 . 1 1 64 64 GLU CB C 64 28.681 28.681 28.995 -0.314 25447
1570 1 4 . 1 1 64 64 GLU H H 64 8.316 8.316 9.030 -0.714 25447
1571 1 4 . 1 1 65 65 HIS N N 65 115.487 115.487 119.596 -4.109 25447
1572 1 4 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.250 0.030 25447
1573 1 4 . 1 1 65 65 HIS CA C 65 57.652 57.652 58.201 -0.549 25447
1574 1 4 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.605 0.277 25447
1575 1 4 . 1 1 65 65 HIS H H 65 7.274 7.274 8.247 -0.973 25447
1576 1 4 . 1 1 66 66 PHE N N 66 116.127 116.127 116.709 -0.582 25447
1577 1 4 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.423 0.343 25447
1578 1 4 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.577 -1.795 25447
1579 1 4 . 1 1 66 66 PHE CB C 66 38.908 38.908 37.340 1.569 25447
1580 1 4 . 1 1 66 66 PHE H H 66 7.239 7.239 7.681 -0.442 25447
1581 1 4 . 1 1 67 67 ARG N N 67 112.468 112.468 119.226 -6.758 25447
1582 1 4 . 1 1 67 67 ARG HA H 67 4.085 4.085 3.970 0.115 25447
1583 1 4 . 1 1 67 67 ARG CA C 67 58.287 58.287 59.108 -0.821 25447
1584 1 4 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.318 1.442 25447
1585 1 4 . 1 1 67 67 ARG H H 67 6.628 6.628 7.779 -1.151 25447
1586 1 4 . 1 1 68 68 SER N N 68 109.305 109.305 110.233 -0.928 25447
1587 1 4 . 1 1 68 68 SER HA H 68 4.980 4.980 4.845 0.135 25447
1588 1 4 . 1 1 68 68 SER CA C 68 55.785 55.785 56.644 -0.859 25447
1589 1 4 . 1 1 68 68 SER CB C 68 67.691 67.691 66.390 1.301 25447
1590 1 4 . 1 1 68 68 SER H H 68 8.145 8.145 7.285 0.860 25447
1591 1 4 . 1 1 69 69 ILE N N 69 122.602 122.602 122.408 0.194 25447
1592 1 4 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.722 -0.046 25447
1593 1 4 . 1 1 69 69 ILE CA C 69 66.754 66.754 65.377 1.377 25447
1594 1 4 . 1 1 69 69 ILE CB C 69 37.296 37.296 37.542 -0.246 25447
1595 1 4 . 1 1 69 69 ILE H H 69 9.775 9.775 9.105 0.670 25447
1596 1 4 . 1 1 70 70 ARG N N 70 118.764 118.764 118.802 -0.038 25447
1597 1 4 . 1 1 70 70 ARG HA H 70 3.955 3.955 3.927 0.028 25447
1598 1 4 . 1 1 70 70 ARG CA C 70 60.533 60.533 60.063 0.470 25447
1599 1 4 . 1 1 70 70 ARG CB C 70 30.418 30.418 29.656 0.762 25447
1600 1 4 . 1 1 70 70 ARG H H 70 8.910 8.910 8.410 0.500 25447
1601 1 4 . 1 1 71 71 SER N N 71 117.670 117.670 114.912 2.758 25447
1602 1 4 . 1 1 71 71 SER HA H 71 4.330 4.330 4.288 0.042 25447
1603 1 4 . 1 1 71 71 SER CA C 71 62.287 62.287 61.324 0.963 25447
1604 1 4 . 1 1 71 71 SER CB C 71 63.278 63.278 62.673 0.605 25447
1605 1 4 . 1 1 71 71 SER H H 71 8.518 8.518 7.544 0.974 25447
1606 1 4 . 1 1 72 72 ILE N N 72 127.447 127.447 123.437 4.010 25447
1607 1 4 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.739 0.171 25447
1608 1 4 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.309 1.502 25447
1609 1 4 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.489 0.909 25447
1610 1 4 . 1 1 72 72 ILE H H 72 8.762 8.762 7.517 1.245 25447
1611 1 4 . 1 1 73 73 ASP N N 73 121.636 121.636 120.292 1.344 25447
1612 1 4 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.335 -0.322 25447
1613 1 4 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.315 1.833 25447
1614 1 4 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.665 2.875 25447
1615 1 4 . 1 1 73 73 ASP H H 73 8.677 8.677 8.159 0.518 25447
1616 1 4 . 1 1 74 74 ALA N N 74 118.793 118.793 122.128 -3.335 25447
1617 1 4 . 1 1 74 74 ALA HA H 74 4.044 4.044 3.977 0.067 25447
1618 1 4 . 1 1 74 74 ALA CA C 74 55.321 55.321 55.318 0.003 25447
1619 1 4 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.564 -0.620 25447
1620 1 4 . 1 1 74 74 ALA H H 74 8.005 8.005 7.757 0.248 25447
1621 1 4 . 1 1 75 75 PHE N N 75 121.235 121.235 119.914 1.321 25447
1622 1 4 . 1 1 75 75 PHE HA H 75 4.038 4.038 4.018 0.020 25447
1623 1 4 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.917 -0.902 25447
1624 1 4 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.334 -0.496 25447
1625 1 4 . 1 1 75 75 PHE H H 75 8.353 8.353 8.563 -0.210 25447
1626 1 4 . 1 1 76 76 VAL N N 76 120.866 120.866 119.033 1.833 25447
1627 1 4 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.330 -0.387 25447
1628 1 4 . 1 1 76 76 VAL CA C 76 66.901 66.901 66.037 0.864 25447
1629 1 4 . 1 1 76 76 VAL CB C 76 31.247 31.247 30.945 0.302 25447
1630 1 4 . 1 1 76 76 VAL H H 76 8.544 8.544 8.211 0.333 25447
1631 1 4 . 1 1 77 77 VAL N N 77 121.408 121.408 119.644 1.764 25447
1632 1 4 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.691 -0.196 25447
1633 1 4 . 1 1 77 77 VAL CA C 77 66.833 66.833 66.715 0.118 25447
1634 1 4 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.187 0.743 25447
1635 1 4 . 1 1 77 77 VAL H H 77 8.708 8.708 8.346 0.362 25447
1636 1 4 . 1 1 78 78 GLY N N 78 106.402 106.402 107.009 -0.607 25447
1637 1 4 . 1 1 78 78 GLY CA C 78 46.840 46.840 47.058 -0.218 25447
1638 1 4 . 1 1 78 78 GLY H H 78 7.945 7.945 8.618 -0.673 25447
1639 1 4 . 1 1 79 79 ALA N N 79 121.146 121.146 122.728 -1.582 25447
1640 1 4 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.898 0.309 25447
1641 1 4 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.233 -1.304 25447
1642 1 4 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.083 1.178 25447
1643 1 4 . 1 1 79 79 ALA H H 79 7.639 7.639 7.520 0.119 25447
1644 1 4 . 1 1 80 80 THR N N 80 107.668 107.668 109.491 -1.823 25447
1645 1 4 . 1 1 80 80 THR HA H 80 4.443 4.443 4.188 0.255 25447
1646 1 4 . 1 1 80 80 THR CA C 80 61.406 61.406 63.177 -1.771 25447
1647 1 4 . 1 1 80 80 THR CB C 80 70.767 70.767 69.677 1.090 25447
1648 1 4 . 1 1 80 80 THR H H 80 7.449 7.449 7.621 -0.172 25447
1649 1 4 . 1 1 81 81 THR N N 81 119.953 119.953 116.187 3.766 25447
1650 1 4 . 1 1 81 81 THR HA H 81 4.665 4.665 4.835 -0.170 25447
1651 1 4 . 1 1 81 81 THR CA C 81 60.412 60.412 58.644 1.768 25447
1652 1 4 . 1 1 81 81 THR CB C 81 70.113 70.113 70.010 0.103 25447
1653 1 4 . 1 1 81 81 THR H H 81 7.685 7.685 7.942 -0.257 25447
1654 1 4 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.599 0.090 25447
1655 1 4 . 1 1 82 82 PRO CA C 82 61.688 61.688 61.958 -0.270 25447
1656 1 4 . 1 1 82 82 PRO CB C 82 30.969 30.969 30.681 0.288 25447
1657 1 4 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.520 -0.039 25447
1658 1 4 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.419 0.512 25447
1659 1 4 . 1 1 83 83 PRO CB C 83 32.193 32.193 32.756 -0.563 25447
1660 1 4 . 1 1 84 84 VAL N N 84 120.691 120.691 117.041 3.650 25447
1661 1 4 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.366 -0.273 25447
1662 1 4 . 1 1 84 84 VAL CA C 84 62.339 62.339 61.207 1.132 25447
1663 1 4 . 1 1 84 84 VAL CB C 84 32.851 32.851 33.458 -0.607 25447
1664 1 4 . 1 1 84 84 VAL H H 84 8.257 8.257 8.086 0.171 25447
1665 1 4 . 1 1 85 85 GLU N N 85 127.655 127.655 120.405 7.250 25447
1666 1 4 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.851 0.433 25447
1667 1 4 . 1 1 85 85 GLU CA C 85 56.754 56.754 56.453 0.301 25447
1668 1 4 . 1 1 85 85 GLU CB C 85 30.559 30.559 28.102 2.458 25447
1669 1 4 . 1 1 85 85 GLU H H 85 8.202 8.202 8.676 -0.474 25447
1670 1 4 . 1 1 86 86 ALA N N 86 126.437 126.437 121.242 5.195 25447
1671 1 4 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.108 -0.057 25447
1672 1 4 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.859 -0.711 25447
1673 1 4 . 1 1 86 86 ALA CB C 86 19.460 19.460 19.463 -0.003 25447
1674 1 4 . 1 1 86 86 ALA H H 86 8.323 8.323 8.110 0.213 25447
1675 1 4 . 1 1 87 87 LYS N N 87 121.796 121.796 121.384 0.412 25447
1676 1 4 . 1 1 87 87 LYS HA H 87 4.347 4.347 4.042 0.305 25447
1677 1 4 . 1 1 87 87 LYS CA C 87 56.297 56.297 58.004 -1.707 25447
1678 1 4 . 1 1 87 87 LYS CB C 87 33.276 33.276 32.657 0.619 25447
1679 1 4 . 1 1 87 87 LYS H H 87 8.333 8.333 8.481 -0.148 25447
1680 1 4 . 1 1 88 88 LEU N N 88 125.576 125.576 120.371 5.205 25447
1681 1 4 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.403 -0.496 25447
1682 1 4 . 1 1 88 88 LEU CA C 88 55.772 55.772 54.609 1.163 25447
1683 1 4 . 1 1 88 88 LEU CB C 88 42.472 42.472 42.396 0.076 25447
1684 1 4 . 1 1 88 88 LEU H H 88 8.444 8.444 7.555 0.889 25447
1685 1 5 . 1 1 1 1 MET N N 1 120.668 120.668 121.452 -0.784 25447
1686 1 5 . 1 1 1 1 MET HA H 1 4.484 4.484 4.146 0.338 25447
1687 1 5 . 1 1 1 1 MET CA C 1 55.257 55.257 55.743 -0.486 25447
1688 1 5 . 1 1 1 1 MET CB C 1 34.517 34.517 32.000 2.517 25447
1689 1 5 . 1 1 1 1 MET H H 1 8.313 8.313 8.801 -0.488 25447
1690 1 5 . 1 1 2 2 GLN N N 2 123.739 123.739 121.892 1.847 25447
1691 1 5 . 1 1 2 2 GLN HA H 2 4.030 4.030 3.892 0.138 25447
1692 1 5 . 1 1 2 2 GLN CA C 2 57.874 57.874 57.631 0.243 25447
1693 1 5 . 1 1 2 2 GLN CB C 2 29.938 29.938 28.979 0.959 25447
1694 1 5 . 1 1 2 2 GLN H H 2 9.455 9.455 8.637 0.818 25447
1695 1 5 . 1 1 3 3 HIS N N 3 119.115 119.115 113.281 5.834 25447
1696 1 5 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.864 0.252 25447
1697 1 5 . 1 1 3 3 HIS CA C 3 55.494 55.494 55.526 -0.032 25447
1698 1 5 . 1 1 3 3 HIS CB C 3 31.015 31.015 29.223 1.792 25447
1699 1 5 . 1 1 3 3 HIS H H 3 9.783 9.783 7.922 1.861 25447
1700 1 5 . 1 1 4 4 ALA N N 4 122.648 122.648 124.383 -1.735 25447
1701 1 5 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.213 -0.310 25447
1702 1 5 . 1 1 4 4 ALA CA C 4 56.479 56.479 55.273 1.206 25447
1703 1 5 . 1 1 4 4 ALA CB C 4 19.194 19.194 19.150 0.044 25447
1704 1 5 . 1 1 4 4 ALA H H 4 7.551 7.551 8.105 -0.554 25447
1705 1 5 . 1 1 5 5 SER N N 5 112.599 112.599 114.387 -1.788 25447
1706 1 5 . 1 1 5 5 SER HA H 5 4.298 4.298 4.203 0.095 25447
1707 1 5 . 1 1 5 5 SER CA C 5 62.117 62.117 61.729 0.388 25447
1708 1 5 . 1 1 5 5 SER CB C 5 62.334 62.334 62.288 0.045 25447
1709 1 5 . 1 1 5 5 SER H H 5 8.736 8.736 8.415 0.321 25447
1710 1 5 . 1 1 6 6 VAL N N 6 122.866 122.866 122.394 0.472 25447
1711 1 5 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.788 0.317 25447
1712 1 5 . 1 1 6 6 VAL CA C 6 65.732 65.732 66.275 -0.543 25447
1713 1 5 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.729 1.008 25447
1714 1 5 . 1 1 6 6 VAL H H 6 7.660 7.660 7.360 0.300 25447
1715 1 5 . 1 1 7 7 ILE N N 7 121.715 121.715 120.467 1.248 25447
1716 1 5 . 1 1 7 7 ILE HA H 7 4.224 4.224 3.785 0.439 25447
1717 1 5 . 1 1 7 7 ILE CA C 7 65.329 65.329 66.056 -0.727 25447
1718 1 5 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.582 1.111 25447
1719 1 5 . 1 1 7 7 ILE H H 7 8.519 8.519 7.629 0.890 25447
1720 1 5 . 1 1 8 8 ALA N N 8 121.373 121.373 121.469 -0.096 25447
1721 1 5 . 1 1 8 8 ALA HA H 8 3.895 3.895 3.964 -0.069 25447
1722 1 5 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.553 0.703 25447
1723 1 5 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.159 0.481 25447
1724 1 5 . 1 1 8 8 ALA H H 8 8.940 8.940 8.389 0.551 25447
1725 1 5 . 1 1 9 9 GLN N N 9 115.076 115.076 119.636 -4.560 25447
1726 1 5 . 1 1 9 9 GLN HA H 9 3.870 3.870 4.091 -0.221 25447
1727 1 5 . 1 1 9 9 GLN CA C 9 59.192 59.192 58.868 0.324 25447
1728 1 5 . 1 1 9 9 GLN CB C 9 28.138 28.138 28.990 -0.852 25447
1729 1 5 . 1 1 9 9 GLN H H 9 7.729 7.729 8.247 -0.518 25447
1730 1 5 . 1 1 10 10 PHE N N 10 120.207 120.207 120.027 0.180 25447
1731 1 5 . 1 1 10 10 PHE HA H 10 4.085 4.085 4.341 -0.256 25447
1732 1 5 . 1 1 10 10 PHE CA C 10 60.893 60.893 60.143 0.750 25447
1733 1 5 . 1 1 10 10 PHE CB C 10 38.932 38.932 39.026 -0.094 25447
1734 1 5 . 1 1 10 10 PHE H H 10 7.301 7.301 8.670 -1.369 25447
1735 1 5 . 1 1 11 11 VAL N N 11 117.569 117.569 120.681 -3.112 25447
1736 1 5 . 1 1 11 11 VAL HA H 11 3.307 3.307 2.461 0.846 25447
1737 1 5 . 1 1 11 11 VAL CA C 11 66.508 66.508 65.470 1.038 25447
1738 1 5 . 1 1 11 11 VAL CB C 11 31.487 31.487 31.617 -0.130 25447
1739 1 5 . 1 1 11 11 VAL H H 11 8.370 8.370 8.196 0.174 25447
1740 1 5 . 1 1 12 12 VAL N N 12 117.909 117.909 119.401 -1.492 25447
1741 1 5 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.544 0.197 25447
1742 1 5 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.248 -0.372 25447
1743 1 5 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.644 -0.332 25447
1744 1 5 . 1 1 12 12 VAL H H 12 8.294 8.294 7.577 0.717 25447
1745 1 5 . 1 1 13 13 GLU N N 13 117.918 117.918 119.768 -1.850 25447
1746 1 5 . 1 1 13 13 GLU HA H 13 3.742 3.742 4.088 -0.346 25447
1747 1 5 . 1 1 13 13 GLU CA C 13 59.307 59.307 58.966 0.341 25447
1748 1 5 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.456 0.033 25447
1749 1 5 . 1 1 13 13 GLU H H 13 7.750 7.750 7.697 0.053 25447
1750 1 5 . 1 1 14 14 GLU N N 14 113.478 113.478 118.367 -4.889 25447
1751 1 5 . 1 1 14 14 GLU HA H 14 3.778 3.778 3.868 -0.090 25447
1752 1 5 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.657 -1.857 25447
1753 1 5 . 1 1 14 14 GLU CB C 14 29.643 29.643 29.509 0.134 25447
1754 1 5 . 1 1 14 14 GLU H H 14 7.603 7.603 7.503 0.100 25447
1755 1 5 . 1 1 15 15 PHE N N 15 114.193 114.193 115.777 -1.584 25447
1756 1 5 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.405 0.534 25447
1757 1 5 . 1 1 15 15 PHE CA C 15 58.095 58.095 60.361 -2.266 25447
1758 1 5 . 1 1 15 15 PHE CB C 15 42.095 42.095 40.352 1.743 25447
1759 1 5 . 1 1 15 15 PHE H H 15 7.908 7.908 7.515 0.393 25447
1760 1 5 . 1 1 16 16 LEU N N 16 121.492 121.492 120.295 1.197 25447
1761 1 5 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.823 0.144 25447
1762 1 5 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.229 0.148 25447
1763 1 5 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.324 1.409 25447
1764 1 5 . 1 1 16 16 LEU H H 16 8.015 8.015 8.476 -0.461 25447
1765 1 5 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.397 -0.014 25447
1766 1 5 . 1 1 17 17 PRO CA C 17 64.858 64.858 64.190 0.668 25447
1767 1 5 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.798 0.031 25447
1768 1 5 . 1 1 18 18 ASP N N 18 116.508 116.508 118.417 -1.909 25447
1769 1 5 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.746 -0.178 25447
1770 1 5 . 1 1 18 18 ASP CA C 18 54.688 54.688 53.928 0.760 25447
1771 1 5 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.643 -0.017 25447
1772 1 5 . 1 1 18 18 ASP H H 18 8.399 8.399 8.637 -0.238 25447
1773 1 5 . 1 1 19 19 VAL N N 19 122.135 122.135 120.698 1.437 25447
1774 1 5 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.141 -0.023 25447
1775 1 5 . 1 1 19 19 VAL CA C 19 61.293 61.293 61.251 0.042 25447
1776 1 5 . 1 1 19 19 VAL CB C 19 33.582 33.582 34.180 -0.598 25447
1777 1 5 . 1 1 19 19 VAL H H 19 7.760 7.760 7.346 0.414 25447
1778 1 5 . 1 1 20 20 ALA N N 20 129.301 129.301 130.351 -1.050 25447
1779 1 5 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.556 0.043 25447
1780 1 5 . 1 1 20 20 ALA CA C 20 50.270 50.270 50.161 0.109 25447
1781 1 5 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.199 -0.771 25447
1782 1 5 . 1 1 20 20 ALA H H 20 8.761 8.761 8.390 0.371 25447
1783 1 5 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.130 -0.053 25447
1784 1 5 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.605 0.598 25447
1785 1 5 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.809 -0.401 25447
1786 1 5 . 1 1 22 22 ALA N N 22 116.106 116.106 116.944 -0.838 25447
1787 1 5 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.163 -0.046 25447
1788 1 5 . 1 1 22 22 ALA CA C 22 53.996 53.996 54.061 -0.065 25447
1789 1 5 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.317 0.527 25447
1790 1 5 . 1 1 22 22 ALA H H 22 8.064 8.064 8.002 0.062 25447
1791 1 5 . 1 1 23 23 ASP N N 23 115.541 115.541 117.872 -2.331 25447
1792 1 5 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.689 -0.012 25447
1793 1 5 . 1 1 23 23 ASP CA C 23 54.336 54.336 54.375 -0.039 25447
1794 1 5 . 1 1 23 23 ASP CB C 23 41.353 41.353 40.784 0.569 25447
1795 1 5 . 1 1 23 23 ASP H H 23 8.003 8.003 8.143 -0.140 25447
1796 1 5 . 1 1 24 24 VAL N N 24 121.517 121.517 121.029 0.488 25447
1797 1 5 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.108 -0.287 25447
1798 1 5 . 1 1 24 24 VAL CA C 24 62.345 62.345 61.539 0.806 25447
1799 1 5 . 1 1 24 24 VAL CB C 24 31.733 31.733 33.124 -1.391 25447
1800 1 5 . 1 1 24 24 VAL H H 24 7.069 7.069 7.411 -0.342 25447
1801 1 5 . 1 1 25 25 ASP N N 25 129.329 129.329 127.925 1.404 25447
1802 1 5 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.834 -0.260 25447
1803 1 5 . 1 1 25 25 ASP CA C 25 54.566 54.566 53.215 1.351 25447
1804 1 5 . 1 1 25 25 ASP CB C 25 42.333 42.333 41.668 0.665 25447
1805 1 5 . 1 1 25 25 ASP H H 25 8.474 8.474 8.725 -0.251 25447
1806 1 5 . 1 1 26 26 VAL N N 26 121.920 121.920 121.270 0.650 25447
1807 1 5 . 1 1 26 26 VAL HA H 26 4.108 4.108 4.024 0.084 25447
1808 1 5 . 1 1 26 26 VAL CA C 26 64.518 64.518 63.139 1.379 25447
1809 1 5 . 1 1 26 26 VAL CB C 26 31.198 31.198 31.918 -0.720 25447
1810 1 5 . 1 1 26 26 VAL H H 26 8.591 8.591 8.584 0.007 25447
1811 1 5 . 1 1 27 27 ASP N N 27 116.286 116.286 118.561 -2.275 25447
1812 1 5 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.608 0.537 25447
1813 1 5 . 1 1 27 27 ASP CA C 27 54.181 54.181 55.430 -1.249 25447
1814 1 5 . 1 1 27 27 ASP CB C 27 42.575 42.575 40.597 1.978 25447
1815 1 5 . 1 1 27 27 ASP H H 27 8.609 8.609 8.135 0.474 25447
1816 1 5 . 1 1 28 28 LEU N N 28 125.116 125.116 121.970 3.146 25447
1817 1 5 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.449 -0.438 25447
1818 1 5 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.555 1.532 25447
1819 1 5 . 1 1 28 28 LEU CB C 28 43.321 43.321 43.737 -0.416 25447
1820 1 5 . 1 1 28 28 LEU H H 28 7.374 7.374 7.266 0.108 25447
1821 1 5 . 1 1 29 29 ASP N N 29 125.924 125.924 124.859 1.065 25447
1822 1 5 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.629 0.205 25447
1823 1 5 . 1 1 29 29 ASP CA C 29 53.920 53.920 55.037 -1.117 25447
1824 1 5 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.404 -0.025 25447
1825 1 5 . 1 1 29 29 ASP H H 29 8.699 8.699 8.601 0.098 25447
1826 1 5 . 1 1 30 30 LEU N N 30 129.975 129.975 124.638 5.337 25447
1827 1 5 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.091 -0.174 25447
1828 1 5 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.420 -1.032 25447
1829 1 5 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.413 -0.175 25447
1830 1 5 . 1 1 30 30 LEU H H 30 9.718 9.718 8.318 1.400 25447
1831 1 5 . 1 1 31 31 VAL N N 31 121.212 121.212 117.839 3.373 25447
1832 1 5 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.563 0.630 25447
1833 1 5 . 1 1 31 31 VAL CA C 31 64.433 64.433 66.458 -2.025 25447
1834 1 5 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.710 0.465 25447
1835 1 5 . 1 1 31 31 VAL H H 31 8.163 8.163 7.666 0.497 25447
1836 1 5 . 1 1 32 32 ASP N N 32 124.893 124.893 118.620 6.273 25447
1837 1 5 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.314 0.044 25447
1838 1 5 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.774 0.451 25447
1839 1 5 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.047 0.688 25447
1840 1 5 . 1 1 32 32 ASP H H 32 9.385 9.385 8.728 0.657 25447
1841 1 5 . 1 1 33 33 ASN N N 33 111.484 111.484 116.318 -4.834 25447
1842 1 5 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.580 0.140 25447
1843 1 5 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.669 0.217 25447
1844 1 5 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.017 -0.011 25447
1845 1 5 . 1 1 33 33 ASN H H 33 7.396 7.396 7.692 -0.296 25447
1846 1 5 . 1 1 34 34 GLY N N 34 106.957 106.957 106.021 0.936 25447
1847 1 5 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.718 0.889 25447
1848 1 5 . 1 1 34 34 GLY H H 34 7.618 7.618 7.933 -0.315 25447
1849 1 5 . 1 1 35 35 VAL N N 35 120.424 120.424 118.453 1.971 25447
1850 1 5 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.619 0.147 25447
1851 1 5 . 1 1 35 35 VAL CA C 35 65.125 65.125 64.829 0.296 25447
1852 1 5 . 1 1 35 35 VAL CB C 35 31.879 31.879 32.048 -0.169 25447
1853 1 5 . 1 1 35 35 VAL H H 35 7.792 7.792 7.754 0.038 25447
1854 1 5 . 1 1 36 36 ILE N N 36 116.364 116.364 120.304 -3.940 25447
1855 1 5 . 1 1 36 36 ILE HA H 36 3.737 3.737 3.699 0.038 25447
1856 1 5 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.565 -0.880 25447
1857 1 5 . 1 1 36 36 ILE CB C 36 38.807 38.807 37.284 1.523 25447
1858 1 5 . 1 1 36 36 ILE H H 36 7.331 7.331 7.717 -0.386 25447
1859 1 5 . 1 1 37 37 ASP N N 37 127.306 127.306 127.944 -0.638 25447
1860 1 5 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.750 -0.086 25447
1861 1 5 . 1 1 37 37 ASP CA C 37 51.616 51.616 53.115 -1.499 25447
1862 1 5 . 1 1 37 37 ASP CB C 37 41.209 41.209 42.437 -1.228 25447
1863 1 5 . 1 1 37 37 ASP H H 37 7.874 7.874 7.839 0.035 25447
1864 1 5 . 1 1 38 38 ALA N N 38 120.352 120.352 123.302 -2.950 25447
1865 1 5 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.125 -0.130 25447
1866 1 5 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.257 1.035 25447
1867 1 5 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.601 -0.289 25447
1868 1 5 . 1 1 38 38 ALA H H 38 8.244 8.244 8.336 -0.092 25447
1869 1 5 . 1 1 39 39 LEU N N 39 117.438 117.438 118.905 -1.467 25447
1870 1 5 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.254 -0.004 25447
1871 1 5 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.579 -0.224 25447
1872 1 5 . 1 1 39 39 LEU CB C 39 41.236 41.236 40.692 0.544 25447
1873 1 5 . 1 1 39 39 LEU H H 39 7.688 7.688 8.519 -0.831 25447
1874 1 5 . 1 1 40 40 GLY N N 40 112.015 112.015 107.901 4.114 25447
1875 1 5 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.290 0.809 25447
1876 1 5 . 1 1 40 40 GLY H H 40 8.732 8.732 8.362 0.370 25447
1877 1 5 . 1 1 41 41 LEU N N 41 122.983 122.983 123.207 -0.224 25447
1878 1 5 . 1 1 41 41 LEU HA H 41 3.851 3.851 3.989 -0.138 25447
1879 1 5 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.541 0.791 25447
1880 1 5 . 1 1 41 41 LEU CB C 41 41.639 41.639 42.008 -0.369 25447
1881 1 5 . 1 1 41 41 LEU H H 41 8.548 8.548 8.271 0.277 25447
1882 1 5 . 1 1 42 42 LEU N N 42 116.076 116.076 120.144 -4.068 25447
1883 1 5 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.905 0.123 25447
1884 1 5 . 1 1 42 42 LEU CA C 42 58.064 58.064 58.540 -0.476 25447
1885 1 5 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.814 -0.874 25447
1886 1 5 . 1 1 42 42 LEU H H 42 7.168 7.168 7.697 -0.529 25447
1887 1 5 . 1 1 43 43 LYS N N 43 119.831 119.831 119.102 0.729 25447
1888 1 5 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.055 0.229 25447
1889 1 5 . 1 1 43 43 LYS CA C 43 59.644 59.644 59.995 -0.351 25447
1890 1 5 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.298 0.229 25447
1891 1 5 . 1 1 43 43 LYS H H 43 7.640 7.640 8.353 -0.713 25447
1892 1 5 . 1 1 44 44 VAL N N 44 121.046 121.046 120.237 0.809 25447
1893 1 5 . 1 1 44 44 VAL HA H 44 3.949 3.949 4.186 -0.237 25447
1894 1 5 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.727 -0.084 25447
1895 1 5 . 1 1 44 44 VAL H H 44 8.269 8.269 7.906 0.363 25447
1896 1 5 . 1 1 45 45 ILE N N 45 119.333 119.333 120.062 -0.729 25447
1897 1 5 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.683 -0.279 25447
1898 1 5 . 1 1 45 45 ILE CA C 45 66.148 66.148 64.128 2.020 25447
1899 1 5 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.081 1.196 25447
1900 1 5 . 1 1 45 45 ILE H H 45 8.145 8.145 7.867 0.278 25447
1901 1 5 . 1 1 46 46 ALA N N 46 121.213 121.213 123.753 -2.540 25447
1902 1 5 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.483 -0.226 25447
1903 1 5 . 1 1 46 46 ALA CA C 46 55.164 55.164 54.888 0.276 25447
1904 1 5 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.610 -0.242 25447
1905 1 5 . 1 1 46 46 ALA H H 46 7.792 7.792 8.059 -0.267 25447
1906 1 5 . 1 1 47 47 TRP N N 47 121.416 121.416 120.304 1.112 25447
1907 1 5 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.538 -0.304 25447
1908 1 5 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.609 2.061 25447
1909 1 5 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.621 -1.382 25447
1910 1 5 . 1 1 47 47 TRP H H 47 8.093 8.093 8.178 -0.085 25447
1911 1 5 . 1 1 48 48 LEU N N 48 118.963 118.963 121.156 -2.193 25447
1912 1 5 . 1 1 48 48 LEU HA H 48 3.586 3.586 2.987 0.599 25447
1913 1 5 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.819 0.376 25447
1914 1 5 . 1 1 48 48 LEU CB C 48 42.251 42.251 41.510 0.741 25447
1915 1 5 . 1 1 48 48 LEU H H 48 8.693 8.693 7.752 0.941 25447
1916 1 5 . 1 1 49 49 GLU N N 49 119.131 119.131 117.579 1.552 25447
1917 1 5 . 1 1 49 49 GLU HA H 49 4.050 4.050 3.950 0.100 25447
1918 1 5 . 1 1 49 49 GLU CA C 49 59.862 59.862 59.010 0.852 25447
1919 1 5 . 1 1 49 49 GLU CB C 49 29.586 29.586 28.897 0.689 25447
1920 1 5 . 1 1 49 49 GLU H H 49 7.771 7.771 7.818 -0.047 25447
1921 1 5 . 1 1 50 50 ASP N N 50 119.941 119.941 121.193 -1.252 25447
1922 1 5 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.424 -0.187 25447
1923 1 5 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.320 1.035 25447
1924 1 5 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.700 1.683 25447
1925 1 5 . 1 1 50 50 ASP H H 50 7.697 7.697 7.742 -0.045 25447
1926 1 5 . 1 1 51 51 ARG N N 51 116.911 116.911 117.793 -0.882 25447
1927 1 5 . 1 1 51 51 ARG HA H 51 3.736 3.736 4.054 -0.318 25447
1928 1 5 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.432 -2.068 25447
1929 1 5 . 1 1 51 51 ARG CB C 51 29.315 29.315 30.573 -1.258 25447
1930 1 5 . 1 1 51 51 ARG H H 51 8.881 8.881 7.841 1.040 25447
1931 1 5 . 1 1 52 52 PHE N N 52 112.328 112.328 115.392 -3.064 25447
1932 1 5 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.651 0.024 25447
1933 1 5 . 1 1 52 52 PHE CA C 52 57.413 57.413 57.618 -0.205 25447
1934 1 5 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.728 1.164 25447
1935 1 5 . 1 1 52 52 PHE H H 52 7.284 7.284 7.669 -0.385 25447
1936 1 5 . 1 1 53 53 GLY N N 53 109.826 109.826 109.862 -0.036 25447
1937 1 5 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.552 1.249 25447
1938 1 5 . 1 1 53 53 GLY H H 53 7.427 7.427 8.477 -1.050 25447
1939 1 5 . 1 1 54 54 ILE N N 54 119.127 119.127 116.705 2.422 25447
1940 1 5 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.428 -0.477 25447
1941 1 5 . 1 1 54 54 ILE CA C 54 60.685 60.685 60.161 0.524 25447
1942 1 5 . 1 1 54 54 ILE CB C 54 39.490 39.490 38.697 0.793 25447
1943 1 5 . 1 1 54 54 ILE H H 54 6.876 6.876 7.428 -0.552 25447
1944 1 5 . 1 1 55 55 ALA N N 55 129.823 129.823 128.518 1.305 25447
1945 1 5 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.304 0.110 25447
1946 1 5 . 1 1 55 55 ALA CA C 55 51.610 51.610 51.878 -0.268 25447
1947 1 5 . 1 1 55 55 ALA CB C 55 19.262 19.262 19.768 -0.506 25447
1948 1 5 . 1 1 55 55 ALA H H 55 8.499 8.499 8.375 0.124 25447
1949 1 5 . 1 1 56 56 ALA N N 56 126.300 126.300 125.398 0.902 25447
1950 1 5 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.011 0.258 25447
1951 1 5 . 1 1 56 56 ALA CA C 56 53.474 53.474 54.721 -1.247 25447
1952 1 5 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.740 0.504 25447
1953 1 5 . 1 1 56 56 ALA H H 56 8.641 8.641 8.870 -0.229 25447
1954 1 5 . 1 1 57 57 ASP N N 57 116.395 116.395 117.550 -1.155 25447
1955 1 5 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.332 0.147 25447
1956 1 5 . 1 1 57 57 ASP CA C 57 55.226 55.226 56.154 -0.928 25447
1957 1 5 . 1 1 57 57 ASP CB C 57 40.922 40.922 40.627 0.295 25447
1958 1 5 . 1 1 57 57 ASP H H 57 8.337 8.337 8.145 0.192 25447
1959 1 5 . 1 1 58 58 ASP N N 58 118.557 118.557 118.502 0.055 25447
1960 1 5 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.462 0.174 25447
1961 1 5 . 1 1 58 58 ASP CA C 58 55.144 55.144 55.780 -0.636 25447
1962 1 5 . 1 1 58 58 ASP CB C 58 41.504 41.504 41.511 -0.007 25447
1963 1 5 . 1 1 58 58 ASP H H 58 8.027 8.027 7.884 0.143 25447
1964 1 5 . 1 1 59 59 VAL N N 59 118.898 118.898 118.939 -0.041 25447
1965 1 5 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.235 -0.059 25447
1966 1 5 . 1 1 59 59 VAL CA C 59 62.300 62.300 61.303 0.996 25447
1967 1 5 . 1 1 59 59 VAL CB C 59 33.078 33.078 34.209 -1.131 25447
1968 1 5 . 1 1 59 59 VAL H H 59 7.716 7.716 7.488 0.228 25447
1969 1 5 . 1 1 60 60 GLU N N 60 122.888 122.888 126.245 -3.357 25447
1970 1 5 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.409 -0.125 25447
1971 1 5 . 1 1 60 60 GLU CA C 60 56.546 56.546 55.804 0.742 25447
1972 1 5 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.668 -0.886 25447
1973 1 5 . 1 1 60 60 GLU H H 60 8.367 8.367 8.390 -0.023 25447
1974 1 5 . 1 1 61 61 LEU N N 61 124.827 124.827 125.653 -0.826 25447
1975 1 5 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.461 -0.103 25447
1976 1 5 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.258 0.558 25447
1977 1 5 . 1 1 61 61 LEU CB C 61 41.937 41.937 42.586 -0.649 25447
1978 1 5 . 1 1 61 61 LEU H H 61 8.198 8.198 8.412 -0.214 25447
1979 1 5 . 1 1 62 62 SER N N 62 118.715 118.715 119.255 -0.540 25447
1980 1 5 . 1 1 62 62 SER HA H 62 4.809 4.809 4.957 -0.148 25447
1981 1 5 . 1 1 62 62 SER CA C 62 55.732 55.732 55.682 0.050 25447
1982 1 5 . 1 1 62 62 SER CB C 62 64.017 64.017 64.923 -0.906 25447
1983 1 5 . 1 1 62 62 SER H H 62 8.137 8.137 8.209 -0.072 25447
1984 1 5 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.293 -0.040 25447
1985 1 5 . 1 1 63 63 PRO CA C 63 64.896 64.896 65.142 -0.246 25447
1986 1 5 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.834 0.218 25447
1987 1 5 . 1 1 64 64 GLU N N 64 116.554 116.554 119.086 -2.532 25447
1988 1 5 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.148 -0.275 25447
1989 1 5 . 1 1 64 64 GLU CA C 64 58.719 58.719 58.868 -0.149 25447
1990 1 5 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.264 -0.583 25447
1991 1 5 . 1 1 64 64 GLU H H 64 8.316 8.316 8.490 -0.174 25447
1992 1 5 . 1 1 65 65 HIS N N 65 115.487 115.487 120.275 -4.788 25447
1993 1 5 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.197 0.083 25447
1994 1 5 . 1 1 65 65 HIS CA C 65 57.652 57.652 58.596 -0.944 25447
1995 1 5 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.407 0.475 25447
1996 1 5 . 1 1 65 65 HIS H H 65 7.274 7.274 8.495 -1.221 25447
1997 1 5 . 1 1 66 66 PHE N N 66 116.127 116.127 117.075 -0.948 25447
1998 1 5 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.778 -0.012 25447
1999 1 5 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.550 -1.768 25447
2000 1 5 . 1 1 66 66 PHE CB C 66 38.908 38.908 37.718 1.190 25447
2001 1 5 . 1 1 66 66 PHE H H 66 7.239 7.239 7.873 -0.634 25447
2002 1 5 . 1 1 67 67 ARG N N 67 112.468 112.468 120.064 -7.596 25447
2003 1 5 . 1 1 67 67 ARG HA H 67 4.085 4.085 4.000 0.085 25447
2004 1 5 . 1 1 67 67 ARG CA C 67 58.287 58.287 59.077 -0.790 25447
2005 1 5 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.433 1.327 25447
2006 1 5 . 1 1 67 67 ARG H H 67 6.628 6.628 7.952 -1.324 25447
2007 1 5 . 1 1 68 68 SER N N 68 109.305 109.305 111.609 -2.304 25447
2008 1 5 . 1 1 68 68 SER HA H 68 4.980 4.980 4.847 0.133 25447
2009 1 5 . 1 1 68 68 SER CA C 68 55.785 55.785 56.972 -1.187 25447
2010 1 5 . 1 1 68 68 SER CB C 68 67.691 67.691 66.418 1.273 25447
2011 1 5 . 1 1 68 68 SER H H 68 8.145 8.145 7.568 0.577 25447
2012 1 5 . 1 1 69 69 ILE N N 69 122.602 122.602 122.429 0.173 25447
2013 1 5 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.830 -0.154 25447
2014 1 5 . 1 1 69 69 ILE CA C 69 66.754 66.754 65.179 1.575 25447
2015 1 5 . 1 1 69 69 ILE CB C 69 37.296 37.296 37.600 -0.304 25447
2016 1 5 . 1 1 69 69 ILE H H 69 9.775 9.775 9.128 0.647 25447
2017 1 5 . 1 1 70 70 ARG N N 70 118.764 118.764 118.790 -0.026 25447
2018 1 5 . 1 1 70 70 ARG HA H 70 3.955 3.955 3.945 0.010 25447
2019 1 5 . 1 1 70 70 ARG CA C 70 60.533 60.533 60.041 0.492 25447
2020 1 5 . 1 1 70 70 ARG CB C 70 30.418 30.418 29.805 0.613 25447
2021 1 5 . 1 1 70 70 ARG H H 70 8.910 8.910 8.565 0.345 25447
2022 1 5 . 1 1 71 71 SER N N 71 117.670 117.670 115.514 2.156 25447
2023 1 5 . 1 1 71 71 SER HA H 71 4.330 4.330 4.210 0.120 25447
2024 1 5 . 1 1 71 71 SER CA C 71 62.287 62.287 61.665 0.622 25447
2025 1 5 . 1 1 71 71 SER CB C 71 63.278 63.278 62.802 0.476 25447
2026 1 5 . 1 1 71 71 SER H H 71 8.518 8.518 7.669 0.849 25447
2027 1 5 . 1 1 72 72 ILE N N 72 127.447 127.447 123.997 3.450 25447
2028 1 5 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.282 0.628 25447
2029 1 5 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.649 1.162 25447
2030 1 5 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.660 0.738 25447
2031 1 5 . 1 1 72 72 ILE H H 72 8.762 8.762 7.570 1.192 25447
2032 1 5 . 1 1 73 73 ASP N N 73 121.636 121.636 119.825 1.811 25447
2033 1 5 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.465 -0.452 25447
2034 1 5 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.518 1.630 25447
2035 1 5 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.081 3.458 25447
2036 1 5 . 1 1 73 73 ASP H H 73 8.677 8.677 8.282 0.395 25447
2037 1 5 . 1 1 74 74 ALA N N 74 118.793 118.793 122.366 -3.573 25447
2038 1 5 . 1 1 74 74 ALA HA H 74 4.044 4.044 4.126 -0.082 25447
2039 1 5 . 1 1 74 74 ALA CA C 74 55.321 55.321 54.827 0.494 25447
2040 1 5 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.384 -0.438 25447
2041 1 5 . 1 1 74 74 ALA H H 74 8.005 8.005 7.971 0.034 25447
2042 1 5 . 1 1 75 75 PHE N N 75 121.235 121.235 119.958 1.277 25447
2043 1 5 . 1 1 75 75 PHE HA H 75 4.038 4.038 4.032 0.006 25447
2044 1 5 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.919 -0.903 25447
2045 1 5 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.287 -0.450 25447
2046 1 5 . 1 1 75 75 PHE H H 75 8.353 8.353 8.589 -0.236 25447
2047 1 5 . 1 1 76 76 VAL N N 76 120.866 120.866 119.002 1.864 25447
2048 1 5 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.352 -0.409 25447
2049 1 5 . 1 1 76 76 VAL CA C 76 66.901 66.901 67.109 -0.207 25447
2050 1 5 . 1 1 76 76 VAL CB C 76 31.247 31.247 31.801 -0.554 25447
2051 1 5 . 1 1 76 76 VAL H H 76 8.544 8.544 7.821 0.723 25447
2052 1 5 . 1 1 77 77 VAL N N 77 121.408 121.408 120.079 1.329 25447
2053 1 5 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.813 -0.318 25447
2054 1 5 . 1 1 77 77 VAL CA C 77 66.833 66.833 66.279 0.554 25447
2055 1 5 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.160 0.770 25447
2056 1 5 . 1 1 77 77 VAL H H 77 8.708 8.708 8.056 0.652 25447
2057 1 5 . 1 1 78 78 GLY N N 78 106.402 106.402 107.235 -0.833 25447
2058 1 5 . 1 1 78 78 GLY CA C 78 46.840 46.840 47.153 -0.313 25447
2059 1 5 . 1 1 78 78 GLY H H 78 7.945 7.945 8.679 -0.734 25447
2060 1 5 . 1 1 79 79 ALA N N 79 121.146 121.146 122.744 -1.598 25447
2061 1 5 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.970 0.237 25447
2062 1 5 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.489 -1.560 25447
2063 1 5 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.259 1.002 25447
2064 1 5 . 1 1 79 79 ALA H H 79 7.639 7.639 7.575 0.064 25447
2065 1 5 . 1 1 80 80 THR N N 80 107.668 107.668 110.141 -2.473 25447
2066 1 5 . 1 1 80 80 THR HA H 80 4.443 4.443 4.279 0.164 25447
2067 1 5 . 1 1 80 80 THR CA C 80 61.406 61.406 63.308 -1.902 25447
2068 1 5 . 1 1 80 80 THR CB C 80 70.767 70.767 69.645 1.122 25447
2069 1 5 . 1 1 80 80 THR H H 80 7.449 7.449 7.688 -0.239 25447
2070 1 5 . 1 1 81 81 THR N N 81 119.953 119.953 116.413 3.540 25447
2071 1 5 . 1 1 81 81 THR HA H 81 4.665 4.665 4.839 -0.174 25447
2072 1 5 . 1 1 81 81 THR CA C 81 60.412 60.412 59.128 1.284 25447
2073 1 5 . 1 1 81 81 THR CB C 81 70.113 70.113 69.797 0.316 25447
2074 1 5 . 1 1 81 81 THR H H 81 7.685 7.685 8.091 -0.406 25447
2075 1 5 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.702 -0.013 25447
2076 1 5 . 1 1 82 82 PRO CA C 82 61.688 61.688 61.851 -0.163 25447
2077 1 5 . 1 1 82 82 PRO CB C 82 30.969 30.969 30.763 0.206 25447
2078 1 5 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.471 0.010 25447
2079 1 5 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.206 0.725 25447
2080 1 5 . 1 1 83 83 PRO CB C 83 32.193 32.193 32.863 -0.670 25447
2081 1 5 . 1 1 84 84 VAL N N 84 120.691 120.691 117.930 2.761 25447
2082 1 5 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.311 -0.218 25447
2083 1 5 . 1 1 84 84 VAL CA C 84 62.339 62.339 60.886 1.453 25447
2084 1 5 . 1 1 84 84 VAL CB C 84 32.851 32.851 32.928 -0.077 25447
2085 1 5 . 1 1 84 84 VAL H H 84 8.257 8.257 7.961 0.296 25447
2086 1 5 . 1 1 85 85 GLU N N 85 127.655 127.655 123.841 3.814 25447
2087 1 5 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.877 0.407 25447
2088 1 5 . 1 1 85 85 GLU CA C 85 56.754 56.754 56.182 0.572 25447
2089 1 5 . 1 1 85 85 GLU CB C 85 30.559 30.559 29.656 0.903 25447
2090 1 5 . 1 1 85 85 GLU H H 85 8.202 8.202 8.644 -0.442 25447
2091 1 5 . 1 1 86 86 ALA N N 86 126.437 126.437 123.191 3.246 25447
2092 1 5 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.111 -0.060 25447
2093 1 5 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.768 -0.620 25447
2094 1 5 . 1 1 86 86 ALA CB C 86 19.460 19.460 19.708 -0.248 25447
2095 1 5 . 1 1 86 86 ALA H H 86 8.323 8.323 8.313 0.010 25447
2096 1 5 . 1 1 87 87 LYS N N 87 121.796 121.796 120.688 1.108 25447
2097 1 5 . 1 1 87 87 LYS HA H 87 4.347 4.347 4.047 0.300 25447
2098 1 5 . 1 1 87 87 LYS CA C 87 56.297 56.297 57.745 -1.448 25447
2099 1 5 . 1 1 87 87 LYS CB C 87 33.276 33.276 32.597 0.679 25447
2100 1 5 . 1 1 87 87 LYS H H 87 8.333 8.333 8.415 -0.082 25447
2101 1 5 . 1 1 88 88 LEU N N 88 125.576 125.576 120.421 5.155 25447
2102 1 5 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.416 -0.509 25447
2103 1 5 . 1 1 88 88 LEU CA C 88 55.772 55.772 54.280 1.492 25447
2104 1 5 . 1 1 88 88 LEU CB C 88 42.472 42.472 42.402 0.070 25447
2105 1 5 . 1 1 88 88 LEU H H 88 8.444 8.444 7.512 0.932 25447
2106 1 6 . 1 1 1 1 MET N N 1 120.668 120.668 115.645 5.023 25447
2107 1 6 . 1 1 1 1 MET HA H 1 4.484 4.484 4.467 0.017 25447
2108 1 6 . 1 1 1 1 MET CA C 1 55.257 55.257 55.264 -0.007 25447
2109 1 6 . 1 1 1 1 MET CB C 1 34.517 34.517 33.997 0.520 25447
2110 1 6 . 1 1 1 1 MET H H 1 8.313 8.313 7.541 0.772 25447
2111 1 6 . 1 1 2 2 GLN N N 2 123.739 123.739 118.749 4.990 25447
2112 1 6 . 1 1 2 2 GLN HA H 2 4.030 4.030 4.271 -0.241 25447
2113 1 6 . 1 1 2 2 GLN CA C 2 57.874 57.874 54.654 3.220 25447
2114 1 6 . 1 1 2 2 GLN CB C 2 29.938 29.938 29.812 0.126 25447
2115 1 6 . 1 1 2 2 GLN H H 2 9.455 9.455 8.334 1.121 25447
2116 1 6 . 1 1 3 3 HIS N N 3 119.115 119.115 120.848 -1.733 25447
2117 1 6 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.171 0.945 25447
2118 1 6 . 1 1 3 3 HIS CA C 3 55.494 55.494 57.187 -1.692 25447
2119 1 6 . 1 1 3 3 HIS CB C 3 31.015 31.015 27.419 3.596 25447
2120 1 6 . 1 1 3 3 HIS H H 3 9.783 9.783 8.734 1.049 25447
2121 1 6 . 1 1 4 4 ALA N N 4 122.648 122.648 122.131 0.517 25447
2122 1 6 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.028 -0.125 25447
2123 1 6 . 1 1 4 4 ALA CA C 4 56.479 56.479 55.015 1.464 25447
2124 1 6 . 1 1 4 4 ALA CB C 4 19.194 19.194 18.756 0.438 25447
2125 1 6 . 1 1 4 4 ALA H H 4 7.551 7.551 8.394 -0.843 25447
2126 1 6 . 1 1 5 5 SER N N 5 112.599 112.599 113.756 -1.157 25447
2127 1 6 . 1 1 5 5 SER HA H 5 4.298 4.298 4.249 0.049 25447
2128 1 6 . 1 1 5 5 SER CA C 5 62.117 62.117 61.378 0.739 25447
2129 1 6 . 1 1 5 5 SER CB C 5 62.334 62.334 62.511 -0.177 25447
2130 1 6 . 1 1 5 5 SER H H 5 8.736 8.736 8.981 -0.245 25447
2131 1 6 . 1 1 6 6 VAL N N 6 122.866 122.866 122.991 -0.125 25447
2132 1 6 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.800 0.305 25447
2133 1 6 . 1 1 6 6 VAL CA C 6 65.732 65.732 66.528 -0.796 25447
2134 1 6 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.588 1.149 25447
2135 1 6 . 1 1 6 6 VAL H H 6 7.660 7.660 7.256 0.404 25447
2136 1 6 . 1 1 7 7 ILE N N 7 121.715 121.715 120.101 1.614 25447
2137 1 6 . 1 1 7 7 ILE HA H 7 4.224 4.224 4.158 0.066 25447
2138 1 6 . 1 1 7 7 ILE CA C 7 65.329 65.329 65.889 -0.560 25447
2139 1 6 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.560 1.133 25447
2140 1 6 . 1 1 7 7 ILE H H 7 8.519 8.519 7.842 0.677 25447
2141 1 6 . 1 1 8 8 ALA N N 8 121.373 121.373 121.271 0.102 25447
2142 1 6 . 1 1 8 8 ALA HA H 8 3.895 3.895 4.012 -0.117 25447
2143 1 6 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.333 0.924 25447
2144 1 6 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.016 0.624 25447
2145 1 6 . 1 1 8 8 ALA H H 8 8.940 8.940 7.942 0.998 25447
2146 1 6 . 1 1 9 9 GLN N N 9 115.076 115.076 119.228 -4.152 25447
2147 1 6 . 1 1 9 9 GLN HA H 9 3.870 3.870 3.944 -0.074 25447
2148 1 6 . 1 1 9 9 GLN CA C 9 59.192 59.192 58.991 0.201 25447
2149 1 6 . 1 1 9 9 GLN CB C 9 28.138 28.138 28.615 -0.477 25447
2150 1 6 . 1 1 9 9 GLN H H 9 7.729 7.729 7.886 -0.157 25447
2151 1 6 . 1 1 10 10 PHE N N 10 120.207 120.207 118.774 1.433 25447
2152 1 6 . 1 1 10 10 PHE HA H 10 4.085 4.085 3.847 0.238 25447
2153 1 6 . 1 1 10 10 PHE CA C 10 60.893 60.893 61.748 -0.855 25447
2154 1 6 . 1 1 10 10 PHE CB C 10 38.932 38.932 38.069 0.863 25447
2155 1 6 . 1 1 10 10 PHE H H 10 7.301 7.301 7.866 -0.565 25447
2156 1 6 . 1 1 11 11 VAL N N 11 117.569 117.569 117.495 0.074 25447
2157 1 6 . 1 1 11 11 VAL HA H 11 3.307 3.307 3.912 -0.605 25447
2158 1 6 . 1 1 11 11 VAL CA C 11 66.508 66.508 65.853 0.655 25447
2159 1 6 . 1 1 11 11 VAL CB C 11 31.487 31.487 31.397 0.090 25447
2160 1 6 . 1 1 11 11 VAL H H 11 8.370 8.370 7.861 0.509 25447
2161 1 6 . 1 1 12 12 VAL N N 12 117.909 117.909 121.177 -3.268 25447
2162 1 6 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.640 0.101 25447
2163 1 6 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.981 -1.105 25447
2164 1 6 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.408 -0.096 25447
2165 1 6 . 1 1 12 12 VAL H H 12 8.294 8.294 8.115 0.179 25447
2166 1 6 . 1 1 13 13 GLU N N 13 117.918 117.918 118.960 -1.042 25447
2167 1 6 . 1 1 13 13 GLU HA H 13 3.742 3.742 4.002 -0.260 25447
2168 1 6 . 1 1 13 13 GLU CA C 13 59.307 59.307 58.877 0.430 25447
2169 1 6 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.294 0.195 25447
2170 1 6 . 1 1 13 13 GLU H H 13 7.750 7.750 8.215 -0.465 25447
2171 1 6 . 1 1 14 14 GLU N N 14 113.478 113.478 118.201 -4.723 25447
2172 1 6 . 1 1 14 14 GLU HA H 14 3.778 3.778 4.135 -0.357 25447
2173 1 6 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.787 -1.987 25447
2174 1 6 . 1 1 14 14 GLU CB C 14 29.643 29.643 30.314 -0.672 25447
2175 1 6 . 1 1 14 14 GLU H H 14 7.603 7.603 8.020 -0.417 25447
2176 1 6 . 1 1 15 15 PHE N N 15 114.193 114.193 115.983 -1.790 25447
2177 1 6 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.639 0.300 25447
2178 1 6 . 1 1 15 15 PHE CA C 15 58.095 58.095 58.893 -0.798 25447
2179 1 6 . 1 1 15 15 PHE CB C 15 42.095 42.095 42.196 -0.101 25447
2180 1 6 . 1 1 15 15 PHE H H 15 7.908 7.908 7.616 0.292 25447
2181 1 6 . 1 1 16 16 LEU N N 16 121.492 121.492 121.519 -0.027 25447
2182 1 6 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.779 0.188 25447
2183 1 6 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.114 0.263 25447
2184 1 6 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.381 1.352 25447
2185 1 6 . 1 1 16 16 LEU H H 16 8.015 8.015 7.956 0.059 25447
2186 1 6 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.402 -0.019 25447
2187 1 6 . 1 1 17 17 PRO CA C 17 64.858 64.858 63.817 1.041 25447
2188 1 6 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.731 0.098 25447
2189 1 6 . 1 1 18 18 ASP N N 18 116.508 116.508 117.954 -1.446 25447
2190 1 6 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.554 0.014 25447
2191 1 6 . 1 1 18 18 ASP CA C 18 54.688 54.688 53.261 1.427 25447
2192 1 6 . 1 1 18 18 ASP CB C 18 40.626 40.626 39.969 0.656 25447
2193 1 6 . 1 1 18 18 ASP H H 18 8.399 8.399 8.599 -0.200 25447
2194 1 6 . 1 1 19 19 VAL N N 19 122.135 122.135 120.842 1.293 25447
2195 1 6 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.159 -0.041 25447
2196 1 6 . 1 1 19 19 VAL CA C 19 61.293 61.293 61.251 0.042 25447
2197 1 6 . 1 1 19 19 VAL CB C 19 33.582 33.582 34.643 -1.061 25447
2198 1 6 . 1 1 19 19 VAL H H 19 7.760 7.760 7.178 0.582 25447
2199 1 6 . 1 1 20 20 ALA N N 20 129.301 129.301 130.130 -0.829 25447
2200 1 6 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.509 0.090 25447
2201 1 6 . 1 1 20 20 ALA CA C 20 50.270 50.270 50.252 0.018 25447
2202 1 6 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.197 -0.769 25447
2203 1 6 . 1 1 20 20 ALA H H 20 8.761 8.761 8.402 0.359 25447
2204 1 6 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.158 -0.081 25447
2205 1 6 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.384 0.819 25447
2206 1 6 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.781 -0.373 25447
2207 1 6 . 1 1 22 22 ALA N N 22 116.106 116.106 117.987 -1.881 25447
2208 1 6 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.131 -0.014 25447
2209 1 6 . 1 1 22 22 ALA CA C 22 53.996 53.996 54.172 -0.176 25447
2210 1 6 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.225 0.619 25447
2211 1 6 . 1 1 22 22 ALA H H 22 8.064 8.064 7.904 0.160 25447
2212 1 6 . 1 1 23 23 ASP N N 23 115.541 115.541 118.183 -2.642 25447
2213 1 6 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.623 0.054 25447
2214 1 6 . 1 1 23 23 ASP CA C 23 54.336 54.336 54.007 0.329 25447
2215 1 6 . 1 1 23 23 ASP CB C 23 41.353 41.353 40.889 0.464 25447
2216 1 6 . 1 1 23 23 ASP H H 23 8.003 8.003 8.108 -0.105 25447
2217 1 6 . 1 1 24 24 VAL N N 24 121.517 121.517 120.426 1.091 25447
2218 1 6 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.164 -0.343 25447
2219 1 6 . 1 1 24 24 VAL CA C 24 62.345 62.345 61.460 0.885 25447
2220 1 6 . 1 1 24 24 VAL CB C 24 31.733 31.733 33.338 -1.605 25447
2221 1 6 . 1 1 24 24 VAL H H 24 7.069 7.069 7.452 -0.383 25447
2222 1 6 . 1 1 25 25 ASP N N 25 129.329 129.329 126.741 2.588 25447
2223 1 6 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.828 -0.254 25447
2224 1 6 . 1 1 25 25 ASP CA C 25 54.566 54.566 53.488 1.078 25447
2225 1 6 . 1 1 25 25 ASP CB C 25 42.333 42.333 41.447 0.886 25447
2226 1 6 . 1 1 25 25 ASP H H 25 8.474 8.474 8.674 -0.200 25447
2227 1 6 . 1 1 26 26 VAL N N 26 121.920 121.920 120.450 1.470 25447
2228 1 6 . 1 1 26 26 VAL HA H 26 4.108 4.108 4.032 0.076 25447
2229 1 6 . 1 1 26 26 VAL CA C 26 64.518 64.518 63.573 0.945 25447
2230 1 6 . 1 1 26 26 VAL CB C 26 31.198 31.198 32.152 -0.954 25447
2231 1 6 . 1 1 26 26 VAL H H 26 8.591 8.591 8.564 0.027 25447
2232 1 6 . 1 1 27 27 ASP N N 27 116.286 116.286 119.421 -3.135 25447
2233 1 6 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.614 0.531 25447
2234 1 6 . 1 1 27 27 ASP CA C 27 54.181 54.181 55.532 -1.351 25447
2235 1 6 . 1 1 27 27 ASP CB C 27 42.575 42.575 40.725 1.850 25447
2236 1 6 . 1 1 27 27 ASP H H 27 8.609 8.609 8.273 0.336 25447
2237 1 6 . 1 1 28 28 LEU N N 28 125.116 125.116 121.719 3.397 25447
2238 1 6 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.396 -0.385 25447
2239 1 6 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.728 1.359 25447
2240 1 6 . 1 1 28 28 LEU CB C 28 43.321 43.321 43.358 -0.037 25447
2241 1 6 . 1 1 28 28 LEU H H 28 7.374 7.374 7.292 0.082 25447
2242 1 6 . 1 1 29 29 ASP N N 29 125.924 125.924 124.202 1.722 25447
2243 1 6 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.558 0.276 25447
2244 1 6 . 1 1 29 29 ASP CA C 29 53.920 53.920 55.066 -1.146 25447
2245 1 6 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.252 0.127 25447
2246 1 6 . 1 1 29 29 ASP H H 29 8.699 8.699 8.678 0.021 25447
2247 1 6 . 1 1 30 30 LEU N N 30 129.975 129.975 126.321 3.654 25447
2248 1 6 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.146 -0.230 25447
2249 1 6 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.411 -1.023 25447
2250 1 6 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.354 -0.115 25447
2251 1 6 . 1 1 30 30 LEU H H 30 9.718 9.718 8.504 1.214 25447
2252 1 6 . 1 1 31 31 VAL N N 31 121.212 121.212 118.234 2.978 25447
2253 1 6 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.631 0.562 25447
2254 1 6 . 1 1 31 31 VAL CA C 31 64.433 64.433 65.812 -1.379 25447
2255 1 6 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.095 1.080 25447
2256 1 6 . 1 1 31 31 VAL H H 31 8.163 8.163 7.578 0.585 25447
2257 1 6 . 1 1 32 32 ASP N N 32 124.893 124.893 119.133 5.760 25447
2258 1 6 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.318 0.040 25447
2259 1 6 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.680 0.545 25447
2260 1 6 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.096 0.639 25447
2261 1 6 . 1 1 32 32 ASP H H 32 9.385 9.385 8.713 0.672 25447
2262 1 6 . 1 1 33 33 ASN N N 33 111.484 111.484 116.251 -4.767 25447
2263 1 6 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.579 0.141 25447
2264 1 6 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.675 0.211 25447
2265 1 6 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.059 -0.054 25447
2266 1 6 . 1 1 33 33 ASN H H 33 7.396 7.396 7.673 -0.277 25447
2267 1 6 . 1 1 34 34 GLY N N 34 106.957 106.957 106.186 0.771 25447
2268 1 6 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.395 1.212 25447
2269 1 6 . 1 1 34 34 GLY H H 34 7.618 7.618 7.915 -0.297 25447
2270 1 6 . 1 1 35 35 VAL N N 35 120.424 120.424 118.622 1.802 25447
2271 1 6 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.442 0.324 25447
2272 1 6 . 1 1 35 35 VAL CA C 35 65.125 65.125 64.987 0.138 25447
2273 1 6 . 1 1 35 35 VAL CB C 35 31.879 31.879 31.892 -0.013 25447
2274 1 6 . 1 1 35 35 VAL H H 35 7.792 7.792 7.805 -0.013 25447
2275 1 6 . 1 1 36 36 ILE N N 36 116.364 116.364 119.300 -2.936 25447
2276 1 6 . 1 1 36 36 ILE HA H 36 3.737 3.737 4.041 -0.304 25447
2277 1 6 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.129 -0.444 25447
2278 1 6 . 1 1 36 36 ILE CB C 36 38.807 38.807 38.549 0.258 25447
2279 1 6 . 1 1 36 36 ILE H H 36 7.331 7.331 7.664 -0.333 25447
2280 1 6 . 1 1 37 37 ASP N N 37 127.306 127.306 125.632 1.674 25447
2281 1 6 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.643 0.021 25447
2282 1 6 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.501 -0.885 25447
2283 1 6 . 1 1 37 37 ASP CB C 37 41.209 41.209 43.823 -2.614 25447
2284 1 6 . 1 1 37 37 ASP H H 37 7.874 7.874 8.007 -0.133 25447
2285 1 6 . 1 1 38 38 ALA N N 38 120.352 120.352 122.766 -2.414 25447
2286 1 6 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.072 -0.077 25447
2287 1 6 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.384 0.908 25447
2288 1 6 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.471 -0.159 25447
2289 1 6 . 1 1 38 38 ALA H H 38 8.244 8.244 8.328 -0.084 25447
2290 1 6 . 1 1 39 39 LEU N N 39 117.438 117.438 119.260 -1.822 25447
2291 1 6 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.206 0.044 25447
2292 1 6 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.519 -0.164 25447
2293 1 6 . 1 1 39 39 LEU CB C 39 41.236 41.236 40.944 0.292 25447
2294 1 6 . 1 1 39 39 LEU H H 39 7.688 7.688 8.326 -0.638 25447
2295 1 6 . 1 1 40 40 GLY N N 40 112.015 112.015 107.370 4.645 25447
2296 1 6 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.163 0.936 25447
2297 1 6 . 1 1 40 40 GLY H H 40 8.732 8.732 8.206 0.526 25447
2298 1 6 . 1 1 41 41 LEU N N 41 122.983 122.983 123.163 -0.180 25447
2299 1 6 . 1 1 41 41 LEU HA H 41 3.851 3.851 3.770 0.081 25447
2300 1 6 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.352 0.980 25447
2301 1 6 . 1 1 41 41 LEU CB C 41 41.639 41.639 41.776 -0.138 25447
2302 1 6 . 1 1 41 41 LEU H H 41 8.548 8.548 8.366 0.182 25447
2303 1 6 . 1 1 42 42 LEU N N 42 116.076 116.076 119.941 -3.865 25447
2304 1 6 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.846 0.181 25447
2305 1 6 . 1 1 42 42 LEU CA C 42 58.064 58.064 58.453 -0.389 25447
2306 1 6 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.776 -0.837 25447
2307 1 6 . 1 1 42 42 LEU H H 42 7.168 7.168 7.614 -0.446 25447
2308 1 6 . 1 1 43 43 LYS N N 43 119.831 119.831 118.873 0.958 25447
2309 1 6 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.017 0.267 25447
2310 1 6 . 1 1 43 43 LYS CA C 43 59.644 59.644 59.997 -0.353 25447
2311 1 6 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.340 0.187 25447
2312 1 6 . 1 1 43 43 LYS H H 43 7.640 7.640 8.195 -0.555 25447
2313 1 6 . 1 1 44 44 VAL N N 44 121.046 121.046 120.419 0.627 25447
2314 1 6 . 1 1 44 44 VAL HA H 44 3.949 3.949 3.865 0.084 25447
2315 1 6 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.777 -0.134 25447
2316 1 6 . 1 1 44 44 VAL H H 44 8.269 8.269 7.775 0.494 25447
2317 1 6 . 1 1 45 45 ILE N N 45 119.333 119.333 119.273 0.060 25447
2318 1 6 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.729 -0.325 25447
2319 1 6 . 1 1 45 45 ILE CA C 45 66.148 66.148 62.461 3.687 25447
2320 1 6 . 1 1 45 45 ILE CB C 45 38.277 38.277 35.834 2.443 25447
2321 1 6 . 1 1 45 45 ILE H H 45 8.145 8.145 7.631 0.514 25447
2322 1 6 . 1 1 46 46 ALA N N 46 121.213 121.213 123.367 -2.154 25447
2323 1 6 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.128 0.129 25447
2324 1 6 . 1 1 46 46 ALA CA C 46 55.164 55.164 55.139 0.025 25447
2325 1 6 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.492 -0.124 25447
2326 1 6 . 1 1 46 46 ALA H H 46 7.792 7.792 7.811 -0.019 25447
2327 1 6 . 1 1 47 47 TRP N N 47 121.416 121.416 120.350 1.066 25447
2328 1 6 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.434 -0.200 25447
2329 1 6 . 1 1 47 47 TRP CA C 47 61.670 61.670 60.019 1.651 25447
2330 1 6 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.418 -1.179 25447
2331 1 6 . 1 1 47 47 TRP H H 47 8.093 8.093 8.024 0.069 25447
2332 1 6 . 1 1 48 48 LEU N N 48 118.963 118.963 121.140 -2.177 25447
2333 1 6 . 1 1 48 48 LEU HA H 48 3.586 3.586 2.806 0.780 25447
2334 1 6 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.709 0.486 25447
2335 1 6 . 1 1 48 48 LEU CB C 48 42.251 42.251 41.211 1.040 25447
2336 1 6 . 1 1 48 48 LEU H H 48 8.693 8.693 7.575 1.118 25447
2337 1 6 . 1 1 49 49 GLU N N 49 119.131 119.131 117.518 1.613 25447
2338 1 6 . 1 1 49 49 GLU HA H 49 4.050 4.050 4.002 0.048 25447
2339 1 6 . 1 1 49 49 GLU CA C 49 59.862 59.862 59.147 0.715 25447
2340 1 6 . 1 1 49 49 GLU CB C 49 29.586 29.586 28.683 0.903 25447
2341 1 6 . 1 1 49 49 GLU H H 49 7.771 7.771 7.722 0.049 25447
2342 1 6 . 1 1 50 50 ASP N N 50 119.941 119.941 120.409 -0.468 25447
2343 1 6 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.444 -0.207 25447
2344 1 6 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.474 0.881 25447
2345 1 6 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.761 1.622 25447
2346 1 6 . 1 1 50 50 ASP H H 50 7.697 7.697 7.579 0.118 25447
2347 1 6 . 1 1 51 51 ARG N N 51 116.911 116.911 118.034 -1.123 25447
2348 1 6 . 1 1 51 51 ARG HA H 51 3.736 3.736 4.073 -0.337 25447
2349 1 6 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.090 -1.726 25447
2350 1 6 . 1 1 51 51 ARG CB C 51 29.315 29.315 30.142 -0.827 25447
2351 1 6 . 1 1 51 51 ARG H H 51 8.881 8.881 7.963 0.918 25447
2352 1 6 . 1 1 52 52 PHE N N 52 112.328 112.328 116.407 -4.079 25447
2353 1 6 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.644 0.031 25447
2354 1 6 . 1 1 52 52 PHE CA C 52 57.413 57.413 57.898 -0.485 25447
2355 1 6 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.240 1.652 25447
2356 1 6 . 1 1 52 52 PHE H H 52 7.284 7.284 7.606 -0.322 25447
2357 1 6 . 1 1 53 53 GLY N N 53 109.826 109.826 108.776 1.050 25447
2358 1 6 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.622 1.179 25447
2359 1 6 . 1 1 53 53 GLY H H 53 7.427 7.427 7.894 -0.467 25447
2360 1 6 . 1 1 54 54 ILE N N 54 119.127 119.127 115.276 3.851 25447
2361 1 6 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.501 -0.550 25447
2362 1 6 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.621 1.064 25447
2363 1 6 . 1 1 54 54 ILE CB C 54 39.490 39.490 39.723 -0.233 25447
2364 1 6 . 1 1 54 54 ILE H H 54 6.876 6.876 7.633 -0.757 25447
2365 1 6 . 1 1 55 55 ALA N N 55 129.823 129.823 125.909 3.914 25447
2366 1 6 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.519 -0.105 25447
2367 1 6 . 1 1 55 55 ALA CA C 55 51.610 51.610 51.040 0.570 25447
2368 1 6 . 1 1 55 55 ALA CB C 55 19.262 19.262 20.302 -1.040 25447
2369 1 6 . 1 1 55 55 ALA H H 55 8.499 8.499 8.110 0.389 25447
2370 1 6 . 1 1 56 56 ALA N N 56 126.300 126.300 122.754 3.546 25447
2371 1 6 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.216 0.053 25447
2372 1 6 . 1 1 56 56 ALA CA C 56 53.474 53.474 53.392 0.082 25447
2373 1 6 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.953 0.291 25447
2374 1 6 . 1 1 56 56 ALA H H 56 8.641 8.641 8.380 0.261 25447
2375 1 6 . 1 1 57 57 ASP N N 57 116.395 116.395 116.544 -0.149 25447
2376 1 6 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.411 0.068 25447
2377 1 6 . 1 1 57 57 ASP CA C 57 55.226 55.226 54.410 0.816 25447
2378 1 6 . 1 1 57 57 ASP CB C 57 40.922 40.922 39.616 1.306 25447
2379 1 6 . 1 1 57 57 ASP H H 57 8.337 8.337 8.082 0.255 25447
2380 1 6 . 1 1 58 58 ASP N N 58 118.557 118.557 115.106 3.451 25447
2381 1 6 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.265 0.371 25447
2382 1 6 . 1 1 58 58 ASP CA C 58 55.144 55.144 55.008 0.136 25447
2383 1 6 . 1 1 58 58 ASP CB C 58 41.504 41.504 39.720 1.784 25447
2384 1 6 . 1 1 58 58 ASP H H 58 8.027 8.027 8.537 -0.510 25447
2385 1 6 . 1 1 59 59 VAL N N 59 118.898 118.898 118.535 0.363 25447
2386 1 6 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.244 -0.068 25447
2387 1 6 . 1 1 59 59 VAL CA C 59 62.300 62.300 61.452 0.848 25447
2388 1 6 . 1 1 59 59 VAL CB C 59 33.078 33.078 34.098 -1.020 25447
2389 1 6 . 1 1 59 59 VAL H H 59 7.716 7.716 7.447 0.269 25447
2390 1 6 . 1 1 60 60 GLU N N 60 122.888 122.888 126.676 -3.788 25447
2391 1 6 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.597 -0.313 25447
2392 1 6 . 1 1 60 60 GLU CA C 60 56.546 56.546 55.665 0.881 25447
2393 1 6 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.858 -1.077 25447
2394 1 6 . 1 1 60 60 GLU H H 60 8.367 8.367 8.443 -0.076 25447
2395 1 6 . 1 1 61 61 LEU N N 61 124.827 124.827 125.547 -0.720 25447
2396 1 6 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.626 -0.268 25447
2397 1 6 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.237 0.579 25447
2398 1 6 . 1 1 61 61 LEU CB C 61 41.937 41.937 43.241 -1.304 25447
2399 1 6 . 1 1 61 61 LEU H H 61 8.198 8.198 8.521 -0.323 25447
2400 1 6 . 1 1 62 62 SER N N 62 118.715 118.715 118.358 0.357 25447
2401 1 6 . 1 1 62 62 SER HA H 62 4.809 4.809 4.873 -0.064 25447
2402 1 6 . 1 1 62 62 SER CA C 62 55.732 55.732 55.868 -0.136 25447
2403 1 6 . 1 1 62 62 SER CB C 62 64.017 64.017 63.473 0.544 25447
2404 1 6 . 1 1 62 62 SER H H 62 8.137 8.137 8.200 -0.063 25447
2405 1 6 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.154 0.099 25447
2406 1 6 . 1 1 63 63 PRO CA C 63 64.896 64.896 64.924 -0.028 25447
2407 1 6 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.738 0.314 25447
2408 1 6 . 1 1 64 64 GLU N N 64 116.554 116.554 118.727 -2.173 25447
2409 1 6 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.159 -0.286 25447
2410 1 6 . 1 1 64 64 GLU CA C 64 58.719 58.719 59.366 -0.647 25447
2411 1 6 . 1 1 64 64 GLU CB C 64 28.681 28.681 28.983 -0.302 25447
2412 1 6 . 1 1 64 64 GLU H H 64 8.316 8.316 9.043 -0.727 25447
2413 1 6 . 1 1 65 65 HIS N N 65 115.487 115.487 119.367 -3.880 25447
2414 1 6 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.272 0.008 25447
2415 1 6 . 1 1 65 65 HIS CA C 65 57.652 57.652 58.179 -0.527 25447
2416 1 6 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.689 0.192 25447
2417 1 6 . 1 1 65 65 HIS H H 65 7.274 7.274 8.028 -0.754 25447
2418 1 6 . 1 1 66 66 PHE N N 66 116.127 116.127 115.935 0.192 25447
2419 1 6 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.381 0.385 25447
2420 1 6 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.436 -1.654 25447
2421 1 6 . 1 1 66 66 PHE CB C 66 38.908 38.908 37.835 1.073 25447
2422 1 6 . 1 1 66 66 PHE H H 66 7.239 7.239 7.737 -0.498 25447
2423 1 6 . 1 1 67 67 ARG N N 67 112.468 112.468 119.629 -7.161 25447
2424 1 6 . 1 1 67 67 ARG HA H 67 4.085 4.085 3.965 0.120 25447
2425 1 6 . 1 1 67 67 ARG CA C 67 58.287 58.287 58.938 -0.651 25447
2426 1 6 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.475 1.285 25447
2427 1 6 . 1 1 67 67 ARG H H 67 6.628 6.628 7.820 -1.192 25447
2428 1 6 . 1 1 68 68 SER N N 68 109.305 109.305 111.111 -1.806 25447
2429 1 6 . 1 1 68 68 SER HA H 68 4.980 4.980 4.736 0.244 25447
2430 1 6 . 1 1 68 68 SER CA C 68 55.785 55.785 56.365 -0.580 25447
2431 1 6 . 1 1 68 68 SER CB C 68 67.691 67.691 65.282 2.409 25447
2432 1 6 . 1 1 68 68 SER H H 68 8.145 8.145 7.429 0.716 25447
2433 1 6 . 1 1 69 69 ILE N N 69 122.602 122.602 124.958 -2.356 25447
2434 1 6 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.763 -0.087 25447
2435 1 6 . 1 1 69 69 ILE CA C 69 66.754 66.754 65.401 1.353 25447
2436 1 6 . 1 1 69 69 ILE CB C 69 37.296 37.296 37.695 -0.399 25447
2437 1 6 . 1 1 69 69 ILE H H 69 9.775 9.775 9.035 0.740 25447
2438 1 6 . 1 1 70 70 ARG N N 70 118.764 118.764 119.120 -0.356 25447
2439 1 6 . 1 1 70 70 ARG HA H 70 3.955 3.955 4.018 -0.063 25447
2440 1 6 . 1 1 70 70 ARG CA C 70 60.533 60.533 59.847 0.686 25447
2441 1 6 . 1 1 70 70 ARG CB C 70 30.418 30.418 29.843 0.575 25447
2442 1 6 . 1 1 70 70 ARG H H 70 8.910 8.910 7.695 1.215 25447
2443 1 6 . 1 1 71 71 SER N N 71 117.670 117.670 115.017 2.653 25447
2444 1 6 . 1 1 71 71 SER HA H 71 4.330 4.330 4.279 0.051 25447
2445 1 6 . 1 1 71 71 SER CA C 71 62.287 62.287 61.426 0.861 25447
2446 1 6 . 1 1 71 71 SER CB C 71 63.278 63.278 62.756 0.522 25447
2447 1 6 . 1 1 71 71 SER H H 71 8.518 8.518 7.619 0.899 25447
2448 1 6 . 1 1 72 72 ILE N N 72 127.447 127.447 123.158 4.289 25447
2449 1 6 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.725 0.185 25447
2450 1 6 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.252 1.559 25447
2451 1 6 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.630 0.768 25447
2452 1 6 . 1 1 72 72 ILE H H 72 8.762 8.762 7.621 1.141 25447
2453 1 6 . 1 1 73 73 ASP N N 73 121.636 121.636 120.435 1.201 25447
2454 1 6 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.352 -0.339 25447
2455 1 6 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.396 1.752 25447
2456 1 6 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.624 2.916 25447
2457 1 6 . 1 1 73 73 ASP H H 73 8.677 8.677 8.422 0.255 25447
2458 1 6 . 1 1 74 74 ALA N N 74 118.793 118.793 122.196 -3.403 25447
2459 1 6 . 1 1 74 74 ALA HA H 74 4.044 4.044 3.997 0.047 25447
2460 1 6 . 1 1 74 74 ALA CA C 74 55.321 55.321 55.299 0.022 25447
2461 1 6 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.445 -0.499 25447
2462 1 6 . 1 1 74 74 ALA H H 74 8.005 8.005 7.670 0.335 25447
2463 1 6 . 1 1 75 75 PHE N N 75 121.235 121.235 119.659 1.576 25447
2464 1 6 . 1 1 75 75 PHE HA H 75 4.038 4.038 3.995 0.043 25447
2465 1 6 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.752 -0.737 25447
2466 1 6 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.245 -0.408 25447
2467 1 6 . 1 1 75 75 PHE H H 75 8.353 8.353 8.412 -0.059 25447
2468 1 6 . 1 1 76 76 VAL N N 76 120.866 120.866 118.866 2.000 25447
2469 1 6 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.332 -0.389 25447
2470 1 6 . 1 1 76 76 VAL CA C 76 66.901 66.901 66.697 0.204 25447
2471 1 6 . 1 1 76 76 VAL CB C 76 31.247 31.247 31.213 0.034 25447
2472 1 6 . 1 1 76 76 VAL H H 76 8.544 8.544 8.450 0.094 25447
2473 1 6 . 1 1 77 77 VAL N N 77 121.408 121.408 119.541 1.867 25447
2474 1 6 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.729 -0.234 25447
2475 1 6 . 1 1 77 77 VAL CA C 77 66.833 66.833 64.723 2.110 25447
2476 1 6 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.084 0.846 25447
2477 1 6 . 1 1 77 77 VAL H H 77 8.708 8.708 8.277 0.431 25447
2478 1 6 . 1 1 78 78 GLY N N 78 106.402 106.402 106.978 -0.576 25447
2479 1 6 . 1 1 78 78 GLY CA C 78 46.840 46.840 46.857 -0.017 25447
2480 1 6 . 1 1 78 78 GLY H H 78 7.945 7.945 8.519 -0.574 25447
2481 1 6 . 1 1 79 79 ALA N N 79 121.146 121.146 122.236 -1.090 25447
2482 1 6 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.954 0.253 25447
2483 1 6 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.034 -1.105 25447
2484 1 6 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.677 0.584 25447
2485 1 6 . 1 1 79 79 ALA H H 79 7.639 7.639 7.274 0.365 25447
2486 1 6 . 1 1 80 80 THR N N 80 107.668 107.668 107.337 0.331 25447
2487 1 6 . 1 1 80 80 THR HA H 80 4.443 4.443 4.466 -0.023 25447
2488 1 6 . 1 1 80 80 THR CA C 80 61.406 61.406 62.193 -0.787 25447
2489 1 6 . 1 1 80 80 THR CB C 80 70.767 70.767 70.331 0.437 25447
2490 1 6 . 1 1 80 80 THR H H 80 7.449 7.449 7.718 -0.269 25447
2491 1 6 . 1 1 81 81 THR N N 81 119.953 119.953 117.246 2.707 25447
2492 1 6 . 1 1 81 81 THR HA H 81 4.665 4.665 4.862 -0.197 25447
2493 1 6 . 1 1 81 81 THR CA C 81 60.412 60.412 59.349 1.063 25447
2494 1 6 . 1 1 81 81 THR CB C 81 70.113 70.113 69.112 1.001 25447
2495 1 6 . 1 1 81 81 THR H H 81 7.685 7.685 8.163 -0.478 25447
2496 1 6 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.330 0.359 25447
2497 1 6 . 1 1 82 82 PRO CA C 82 61.688 61.688 62.525 -0.837 25447
2498 1 6 . 1 1 82 82 PRO CB C 82 30.969 30.969 30.863 0.106 25447
2499 1 6 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.314 0.167 25447
2500 1 6 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.324 0.607 25447
2501 1 6 . 1 1 83 83 PRO CB C 83 32.193 32.193 32.200 -0.007 25447
2502 1 6 . 1 1 84 84 VAL N N 84 120.691 120.691 121.154 -0.463 25447
2503 1 6 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.153 -0.060 25447
2504 1 6 . 1 1 84 84 VAL CA C 84 62.339 62.339 61.569 0.770 25447
2505 1 6 . 1 1 84 84 VAL CB C 84 32.851 32.851 32.608 0.243 25447
2506 1 6 . 1 1 84 84 VAL H H 84 8.257 8.257 8.147 0.110 25447
2507 1 6 . 1 1 85 85 GLU N N 85 127.655 127.655 126.362 1.293 25447
2508 1 6 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.921 0.363 25447
2509 1 6 . 1 1 85 85 GLU CA C 85 56.754 56.754 56.188 0.566 25447
2510 1 6 . 1 1 85 85 GLU CB C 85 30.559 30.559 29.275 1.284 25447
2511 1 6 . 1 1 85 85 GLU H H 85 8.202 8.202 8.771 -0.569 25447
2512 1 6 . 1 1 86 86 ALA N N 86 126.437 126.437 122.533 3.904 25447
2513 1 6 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.155 -0.104 25447
2514 1 6 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.859 -0.711 25447
2515 1 6 . 1 1 86 86 ALA CB C 86 19.460 19.460 19.606 -0.146 25447
2516 1 6 . 1 1 86 86 ALA H H 86 8.323 8.323 8.177 0.146 25447
2517 1 6 . 1 1 87 87 LYS N N 87 121.796 121.796 121.337 0.459 25447
2518 1 6 . 1 1 87 87 LYS HA H 87 4.347 4.347 4.267 0.080 25447
2519 1 6 . 1 1 87 87 LYS CA C 87 56.297 56.297 56.061 0.236 25447
2520 1 6 . 1 1 87 87 LYS CB C 87 33.276 33.276 33.133 0.143 25447
2521 1 6 . 1 1 87 87 LYS H H 87 8.333 8.333 8.371 -0.038 25447
2522 1 6 . 1 1 88 88 LEU N N 88 125.576 125.576 121.272 4.304 25447
2523 1 6 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.385 -0.478 25447
2524 1 6 . 1 1 88 88 LEU CA C 88 55.772 55.772 54.757 1.015 25447
2525 1 6 . 1 1 88 88 LEU CB C 88 42.472 42.472 42.117 0.355 25447
2526 1 6 . 1 1 88 88 LEU H H 88 8.444 8.444 8.140 0.304 25447
2527 1 7 . 1 1 1 1 MET N N 1 120.668 120.668 115.908 4.760 25447
2528 1 7 . 1 1 1 1 MET HA H 1 4.484 4.484 4.523 -0.039 25447
2529 1 7 . 1 1 1 1 MET CA C 1 55.257 55.257 54.785 0.472 25447
2530 1 7 . 1 1 1 1 MET CB C 1 34.517 34.517 33.886 0.631 25447
2531 1 7 . 1 1 1 1 MET H H 1 8.313 8.313 7.523 0.790 25447
2532 1 7 . 1 1 2 2 GLN N N 2 123.739 123.739 118.858 4.881 25447
2533 1 7 . 1 1 2 2 GLN HA H 2 4.030 4.030 4.271 -0.240 25447
2534 1 7 . 1 1 2 2 GLN CA C 2 57.874 57.874 54.977 2.897 25447
2535 1 7 . 1 1 2 2 GLN CB C 2 29.938 29.938 28.057 1.881 25447
2536 1 7 . 1 1 2 2 GLN H H 2 9.455 9.455 8.327 1.128 25447
2537 1 7 . 1 1 3 3 HIS N N 3 119.115 119.115 120.523 -1.408 25447
2538 1 7 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.122 0.994 25447
2539 1 7 . 1 1 3 3 HIS CA C 3 55.494 55.494 56.745 -1.251 25447
2540 1 7 . 1 1 3 3 HIS CB C 3 31.015 31.015 28.213 2.802 25447
2541 1 7 . 1 1 3 3 HIS H H 3 9.783 9.783 8.863 0.920 25447
2542 1 7 . 1 1 4 4 ALA N N 4 122.648 122.648 122.054 0.594 25447
2543 1 7 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.118 -0.215 25447
2544 1 7 . 1 1 4 4 ALA CA C 4 56.479 56.479 55.405 1.074 25447
2545 1 7 . 1 1 4 4 ALA CB C 4 19.194 19.194 18.792 0.402 25447
2546 1 7 . 1 1 4 4 ALA H H 4 7.551 7.551 8.423 -0.872 25447
2547 1 7 . 1 1 5 5 SER N N 5 112.599 112.599 113.761 -1.162 25447
2548 1 7 . 1 1 5 5 SER HA H 5 4.298 4.298 4.330 -0.032 25447
2549 1 7 . 1 1 5 5 SER CA C 5 62.117 62.117 61.138 0.979 25447
2550 1 7 . 1 1 5 5 SER CB C 5 62.334 62.334 62.715 -0.381 25447
2551 1 7 . 1 1 5 5 SER H H 5 8.736 8.736 8.418 0.318 25447
2552 1 7 . 1 1 6 6 VAL N N 6 122.866 122.866 122.916 -0.050 25447
2553 1 7 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.821 0.284 25447
2554 1 7 . 1 1 6 6 VAL CA C 6 65.732 65.732 66.036 -0.304 25447
2555 1 7 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.346 1.391 25447
2556 1 7 . 1 1 6 6 VAL H H 6 7.660 7.660 8.019 -0.359 25447
2557 1 7 . 1 1 7 7 ILE N N 7 121.715 121.715 120.524 1.191 25447
2558 1 7 . 1 1 7 7 ILE HA H 7 4.224 4.224 3.943 0.281 25447
2559 1 7 . 1 1 7 7 ILE CA C 7 65.329 65.329 65.968 -0.639 25447
2560 1 7 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.502 1.191 25447
2561 1 7 . 1 1 7 7 ILE H H 7 8.519 8.519 7.997 0.522 25447
2562 1 7 . 1 1 8 8 ALA N N 8 121.373 121.373 121.225 0.148 25447
2563 1 7 . 1 1 8 8 ALA HA H 8 3.895 3.895 3.938 -0.043 25447
2564 1 7 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.293 0.964 25447
2565 1 7 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.029 0.611 25447
2566 1 7 . 1 1 8 8 ALA H H 8 8.940 8.940 7.892 1.048 25447
2567 1 7 . 1 1 9 9 GLN N N 9 115.076 115.076 119.460 -4.384 25447
2568 1 7 . 1 1 9 9 GLN HA H 9 3.870 3.870 4.097 -0.227 25447
2569 1 7 . 1 1 9 9 GLN CA C 9 59.192 59.192 58.818 0.374 25447
2570 1 7 . 1 1 9 9 GLN CB C 9 28.138 28.138 29.030 -0.892 25447
2571 1 7 . 1 1 9 9 GLN H H 9 7.729 7.729 8.126 -0.397 25447
2572 1 7 . 1 1 10 10 PHE N N 10 120.207 120.207 120.061 0.146 25447
2573 1 7 . 1 1 10 10 PHE HA H 10 4.085 4.085 4.344 -0.259 25447
2574 1 7 . 1 1 10 10 PHE CA C 10 60.893 60.893 59.674 1.219 25447
2575 1 7 . 1 1 10 10 PHE CB C 10 38.932 38.932 38.709 0.223 25447
2576 1 7 . 1 1 10 10 PHE H H 10 7.301 7.301 8.606 -1.305 25447
2577 1 7 . 1 1 11 11 VAL N N 11 117.569 117.569 119.921 -2.352 25447
2578 1 7 . 1 1 11 11 VAL HA H 11 3.307 3.307 2.454 0.853 25447
2579 1 7 . 1 1 11 11 VAL CA C 11 66.508 66.508 65.822 0.686 25447
2580 1 7 . 1 1 11 11 VAL CB C 11 31.487 31.487 31.312 0.174 25447
2581 1 7 . 1 1 11 11 VAL H H 11 8.370 8.370 7.921 0.449 25447
2582 1 7 . 1 1 12 12 VAL N N 12 117.909 117.909 119.495 -1.586 25447
2583 1 7 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.536 0.205 25447
2584 1 7 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.924 -1.048 25447
2585 1 7 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.486 -0.174 25447
2586 1 7 . 1 1 12 12 VAL H H 12 8.294 8.294 7.683 0.611 25447
2587 1 7 . 1 1 13 13 GLU N N 13 117.918 117.918 119.610 -1.692 25447
2588 1 7 . 1 1 13 13 GLU HA H 13 3.742 3.742 4.004 -0.262 25447
2589 1 7 . 1 1 13 13 GLU CA C 13 59.307 59.307 59.191 0.116 25447
2590 1 7 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.390 0.099 25447
2591 1 7 . 1 1 13 13 GLU H H 13 7.750 7.750 7.657 0.093 25447
2592 1 7 . 1 1 14 14 GLU N N 14 113.478 113.478 118.418 -4.940 25447
2593 1 7 . 1 1 14 14 GLU HA H 14 3.778 3.778 4.092 -0.314 25447
2594 1 7 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.574 -1.774 25447
2595 1 7 . 1 1 14 14 GLU CB C 14 29.643 29.643 30.034 -0.391 25447
2596 1 7 . 1 1 14 14 GLU H H 14 7.603 7.603 7.690 -0.087 25447
2597 1 7 . 1 1 15 15 PHE N N 15 114.193 114.193 118.180 -3.987 25447
2598 1 7 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.405 0.534 25447
2599 1 7 . 1 1 15 15 PHE CA C 15 58.095 58.095 60.385 -2.290 25447
2600 1 7 . 1 1 15 15 PHE CB C 15 42.095 42.095 40.795 1.300 25447
2601 1 7 . 1 1 15 15 PHE H H 15 7.908 7.908 7.893 0.015 25447
2602 1 7 . 1 1 16 16 LEU N N 16 121.492 121.492 120.511 0.981 25447
2603 1 7 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.727 0.240 25447
2604 1 7 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.046 0.331 25447
2605 1 7 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.128 1.605 25447
2606 1 7 . 1 1 16 16 LEU H H 16 8.015 8.015 8.362 -0.347 25447
2607 1 7 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.387 -0.004 25447
2608 1 7 . 1 1 17 17 PRO CA C 17 64.858 64.858 64.427 0.431 25447
2609 1 7 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.735 0.094 25447
2610 1 7 . 1 1 18 18 ASP N N 18 116.508 116.508 118.459 -1.951 25447
2611 1 7 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.658 -0.090 25447
2612 1 7 . 1 1 18 18 ASP CA C 18 54.688 54.688 53.572 1.115 25447
2613 1 7 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.915 -0.289 25447
2614 1 7 . 1 1 18 18 ASP H H 18 8.399 8.399 8.560 -0.161 25447
2615 1 7 . 1 1 19 19 VAL N N 19 122.135 122.135 120.898 1.237 25447
2616 1 7 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.148 -0.030 25447
2617 1 7 . 1 1 19 19 VAL CA C 19 61.293 61.293 60.819 0.474 25447
2618 1 7 . 1 1 19 19 VAL CB C 19 33.582 33.582 34.150 -0.568 25447
2619 1 7 . 1 1 19 19 VAL H H 19 7.760 7.760 7.290 0.470 25447
2620 1 7 . 1 1 20 20 ALA N N 20 129.301 129.301 130.379 -1.078 25447
2621 1 7 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.613 -0.014 25447
2622 1 7 . 1 1 20 20 ALA CA C 20 50.270 50.270 49.832 0.438 25447
2623 1 7 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.404 -0.976 25447
2624 1 7 . 1 1 20 20 ALA H H 20 8.761 8.761 8.446 0.315 25447
2625 1 7 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.161 -0.084 25447
2626 1 7 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.555 0.648 25447
2627 1 7 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.818 -0.410 25447
2628 1 7 . 1 1 22 22 ALA N N 22 116.106 116.106 118.451 -2.345 25447
2629 1 7 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.154 -0.037 25447
2630 1 7 . 1 1 22 22 ALA CA C 22 53.996 53.996 54.066 -0.070 25447
2631 1 7 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.411 0.433 25447
2632 1 7 . 1 1 22 22 ALA H H 22 8.064 8.064 8.005 0.059 25447
2633 1 7 . 1 1 23 23 ASP N N 23 115.541 115.541 115.796 -0.255 25447
2634 1 7 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.605 0.072 25447
2635 1 7 . 1 1 23 23 ASP CA C 23 54.336 54.336 53.850 0.486 25447
2636 1 7 . 1 1 23 23 ASP CB C 23 41.353 41.353 40.691 0.663 25447
2637 1 7 . 1 1 23 23 ASP H H 23 8.003 8.003 8.084 -0.081 25447
2638 1 7 . 1 1 24 24 VAL N N 24 121.517 121.517 121.076 0.441 25447
2639 1 7 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.177 -0.356 25447
2640 1 7 . 1 1 24 24 VAL CA C 24 62.345 62.345 61.060 1.285 25447
2641 1 7 . 1 1 24 24 VAL CB C 24 31.733 31.733 32.890 -1.157 25447
2642 1 7 . 1 1 24 24 VAL H H 24 7.069 7.069 7.546 -0.477 25447
2643 1 7 . 1 1 25 25 ASP N N 25 129.329 129.329 126.913 2.416 25447
2644 1 7 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.710 -0.136 25447
2645 1 7 . 1 1 25 25 ASP CA C 25 54.566 54.566 52.910 1.656 25447
2646 1 7 . 1 1 25 25 ASP CB C 25 42.333 42.333 42.364 -0.031 25447
2647 1 7 . 1 1 25 25 ASP H H 25 8.474 8.474 8.659 -0.185 25447
2648 1 7 . 1 1 26 26 VAL N N 26 121.920 121.920 126.211 -4.291 25447
2649 1 7 . 1 1 26 26 VAL HA H 26 4.108 4.108 3.918 0.190 25447
2650 1 7 . 1 1 26 26 VAL CA C 26 64.518 64.518 63.196 1.323 25447
2651 1 7 . 1 1 26 26 VAL CB C 26 31.198 31.198 31.856 -0.658 25447
2652 1 7 . 1 1 26 26 VAL H H 26 8.591 8.591 8.737 -0.146 25447
2653 1 7 . 1 1 27 27 ASP N N 27 116.286 116.286 118.314 -2.028 25447
2654 1 7 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.721 0.424 25447
2655 1 7 . 1 1 27 27 ASP CA C 27 54.181 54.181 53.677 0.504 25447
2656 1 7 . 1 1 27 27 ASP CB C 27 42.575 42.575 41.436 1.139 25447
2657 1 7 . 1 1 27 27 ASP H H 27 8.609 8.609 7.790 0.819 25447
2658 1 7 . 1 1 28 28 LEU N N 28 125.116 125.116 122.739 2.377 25447
2659 1 7 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.513 -0.502 25447
2660 1 7 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.069 2.018 25447
2661 1 7 . 1 1 28 28 LEU CB C 28 43.321 43.321 44.222 -0.901 25447
2662 1 7 . 1 1 28 28 LEU H H 28 7.374 7.374 7.704 -0.330 25447
2663 1 7 . 1 1 29 29 ASP N N 29 125.924 125.924 124.781 1.143 25447
2664 1 7 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.632 0.202 25447
2665 1 7 . 1 1 29 29 ASP CA C 29 53.920 53.920 54.719 -0.799 25447
2666 1 7 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.288 0.092 25447
2667 1 7 . 1 1 29 29 ASP H H 29 8.699 8.699 8.559 0.140 25447
2668 1 7 . 1 1 30 30 LEU N N 30 129.975 129.975 123.606 6.369 25447
2669 1 7 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.031 -0.114 25447
2670 1 7 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.459 -1.071 25447
2671 1 7 . 1 1 30 30 LEU CB C 30 42.239 42.239 41.993 0.246 25447
2672 1 7 . 1 1 30 30 LEU H H 30 9.718 9.718 9.123 0.595 25447
2673 1 7 . 1 1 31 31 VAL N N 31 121.212 121.212 115.963 5.249 25447
2674 1 7 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.564 0.629 25447
2675 1 7 . 1 1 31 31 VAL CA C 31 64.433 64.433 66.245 -1.812 25447
2676 1 7 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.162 1.013 25447
2677 1 7 . 1 1 31 31 VAL H H 31 8.163 8.163 7.206 0.957 25447
2678 1 7 . 1 1 32 32 ASP N N 32 124.893 124.893 119.102 5.791 25447
2679 1 7 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.382 -0.024 25447
2680 1 7 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.424 0.801 25447
2681 1 7 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.170 0.565 25447
2682 1 7 . 1 1 32 32 ASP H H 32 9.385 9.385 8.522 0.863 25447
2683 1 7 . 1 1 33 33 ASN N N 33 111.484 111.484 116.280 -4.796 25447
2684 1 7 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.598 0.122 25447
2685 1 7 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.770 0.116 25447
2686 1 7 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.176 -0.170 25447
2687 1 7 . 1 1 33 33 ASN H H 33 7.396 7.396 7.471 -0.075 25447
2688 1 7 . 1 1 34 34 GLY N N 34 106.957 106.957 106.681 0.276 25447
2689 1 7 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.583 1.024 25447
2690 1 7 . 1 1 34 34 GLY H H 34 7.618 7.618 8.210 -0.592 25447
2691 1 7 . 1 1 35 35 VAL N N 35 120.424 120.424 119.005 1.419 25447
2692 1 7 . 1 1 35 35 VAL HA H 35 3.766 3.766 2.894 0.872 25447
2693 1 7 . 1 1 35 35 VAL CA C 35 65.125 65.125 65.230 -0.105 25447
2694 1 7 . 1 1 35 35 VAL CB C 35 31.879 31.879 31.505 0.374 25447
2695 1 7 . 1 1 35 35 VAL H H 35 7.792 7.792 7.289 0.503 25447
2696 1 7 . 1 1 36 36 ILE N N 36 116.364 116.364 119.117 -2.753 25447
2697 1 7 . 1 1 36 36 ILE HA H 36 3.737 3.737 3.863 -0.126 25447
2698 1 7 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.813 -1.128 25447
2699 1 7 . 1 1 36 36 ILE CB C 36 38.807 38.807 37.836 0.971 25447
2700 1 7 . 1 1 36 36 ILE H H 36 7.331 7.331 7.365 -0.034 25447
2701 1 7 . 1 1 37 37 ASP N N 37 127.306 127.306 126.102 1.204 25447
2702 1 7 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.672 -0.008 25447
2703 1 7 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.907 -1.291 25447
2704 1 7 . 1 1 37 37 ASP CB C 37 41.209 41.209 43.874 -2.665 25447
2705 1 7 . 1 1 37 37 ASP H H 37 7.874 7.874 8.018 -0.144 25447
2706 1 7 . 1 1 38 38 ALA N N 38 120.352 120.352 122.963 -2.611 25447
2707 1 7 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.140 -0.145 25447
2708 1 7 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.461 0.831 25447
2709 1 7 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.507 -0.195 25447
2710 1 7 . 1 1 38 38 ALA H H 38 8.244 8.244 8.388 -0.144 25447
2711 1 7 . 1 1 39 39 LEU N N 39 117.438 117.438 119.264 -1.826 25447
2712 1 7 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.260 -0.010 25447
2713 1 7 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.520 -0.165 25447
2714 1 7 . 1 1 39 39 LEU CB C 39 41.236 41.236 40.989 0.247 25447
2715 1 7 . 1 1 39 39 LEU H H 39 7.688 7.688 8.376 -0.688 25447
2716 1 7 . 1 1 40 40 GLY N N 40 112.015 112.015 107.436 4.579 25447
2717 1 7 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.203 0.896 25447
2718 1 7 . 1 1 40 40 GLY H H 40 8.732 8.732 8.286 0.446 25447
2719 1 7 . 1 1 41 41 LEU N N 41 122.983 122.983 122.907 0.076 25447
2720 1 7 . 1 1 41 41 LEU HA H 41 3.851 3.851 3.880 -0.029 25447
2721 1 7 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.539 0.793 25447
2722 1 7 . 1 1 41 41 LEU CB C 41 41.639 41.639 42.026 -0.387 25447
2723 1 7 . 1 1 41 41 LEU H H 41 8.548 8.548 8.433 0.115 25447
2724 1 7 . 1 1 42 42 LEU N N 42 116.076 116.076 119.819 -3.743 25447
2725 1 7 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.915 0.113 25447
2726 1 7 . 1 1 42 42 LEU CA C 42 58.064 58.064 57.994 0.070 25447
2727 1 7 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.482 -0.542 25447
2728 1 7 . 1 1 42 42 LEU H H 42 7.168 7.168 7.704 -0.536 25447
2729 1 7 . 1 1 43 43 LYS N N 43 119.831 119.831 119.065 0.766 25447
2730 1 7 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.066 0.218 25447
2731 1 7 . 1 1 43 43 LYS CA C 43 59.644 59.644 60.097 -0.453 25447
2732 1 7 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.407 0.120 25447
2733 1 7 . 1 1 43 43 LYS H H 43 7.640 7.640 8.207 -0.567 25447
2734 1 7 . 1 1 44 44 VAL N N 44 121.046 121.046 120.561 0.485 25447
2735 1 7 . 1 1 44 44 VAL HA H 44 3.949 3.949 3.793 0.156 25447
2736 1 7 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.717 -0.074 25447
2737 1 7 . 1 1 44 44 VAL H H 44 8.269 8.269 7.741 0.528 25447
2738 1 7 . 1 1 45 45 ILE N N 45 119.333 119.333 119.236 0.097 25447
2739 1 7 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.658 -0.254 25447
2740 1 7 . 1 1 45 45 ILE CA C 45 66.148 66.148 64.553 1.595 25447
2741 1 7 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.385 0.892 25447
2742 1 7 . 1 1 45 45 ILE H H 45 8.145 8.145 7.584 0.561 25447
2743 1 7 . 1 1 46 46 ALA N N 46 121.213 121.213 123.187 -1.974 25447
2744 1 7 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.498 -0.241 25447
2745 1 7 . 1 1 46 46 ALA CA C 46 55.164 55.164 54.813 0.351 25447
2746 1 7 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.666 -0.298 25447
2747 1 7 . 1 1 46 46 ALA H H 46 7.792 7.792 8.125 -0.333 25447
2748 1 7 . 1 1 47 47 TRP N N 47 121.416 121.416 120.209 1.207 25447
2749 1 7 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.560 -0.326 25447
2750 1 7 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.712 1.958 25447
2751 1 7 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.532 -1.293 25447
2752 1 7 . 1 1 47 47 TRP H H 47 8.093 8.093 8.257 -0.164 25447
2753 1 7 . 1 1 48 48 LEU N N 48 118.963 118.963 121.386 -2.423 25447
2754 1 7 . 1 1 48 48 LEU HA H 48 3.586 3.586 3.180 0.406 25447
2755 1 7 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.964 0.231 25447
2756 1 7 . 1 1 48 48 LEU CB C 48 42.251 42.251 41.453 0.798 25447
2757 1 7 . 1 1 48 48 LEU H H 48 8.693 8.693 7.471 1.222 25447
2758 1 7 . 1 1 49 49 GLU N N 49 119.131 119.131 117.160 1.971 25447
2759 1 7 . 1 1 49 49 GLU HA H 49 4.050 4.050 4.006 0.044 25447
2760 1 7 . 1 1 49 49 GLU CA C 49 59.862 59.862 59.106 0.756 25447
2761 1 7 . 1 1 49 49 GLU CB C 49 29.586 29.586 29.002 0.584 25447
2762 1 7 . 1 1 49 49 GLU H H 49 7.771 7.771 7.780 -0.009 25447
2763 1 7 . 1 1 50 50 ASP N N 50 119.941 119.941 121.345 -1.404 25447
2764 1 7 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.472 -0.235 25447
2765 1 7 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.408 0.947 25447
2766 1 7 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.826 1.557 25447
2767 1 7 . 1 1 50 50 ASP H H 50 7.697 7.697 7.782 -0.085 25447
2768 1 7 . 1 1 51 51 ARG N N 51 116.911 116.911 117.875 -0.964 25447
2769 1 7 . 1 1 51 51 ARG HA H 51 3.736 3.736 4.091 -0.355 25447
2770 1 7 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.467 -2.103 25447
2771 1 7 . 1 1 51 51 ARG CB C 51 29.315 29.315 30.509 -1.194 25447
2772 1 7 . 1 1 51 51 ARG H H 51 8.881 8.881 7.894 0.987 25447
2773 1 7 . 1 1 52 52 PHE N N 52 112.328 112.328 116.549 -4.221 25447
2774 1 7 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.682 -0.007 25447
2775 1 7 . 1 1 52 52 PHE CA C 52 57.413 57.413 57.934 -0.521 25447
2776 1 7 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.361 1.531 25447
2777 1 7 . 1 1 52 52 PHE H H 52 7.284 7.284 7.717 -0.433 25447
2778 1 7 . 1 1 53 53 GLY N N 53 109.826 109.826 108.975 0.851 25447
2779 1 7 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.700 1.101 25447
2780 1 7 . 1 1 53 53 GLY H H 53 7.427 7.427 8.005 -0.578 25447
2781 1 7 . 1 1 54 54 ILE N N 54 119.127 119.127 114.756 4.371 25447
2782 1 7 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.543 -0.592 25447
2783 1 7 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.264 1.421 25447
2784 1 7 . 1 1 54 54 ILE CB C 54 39.490 39.490 39.692 -0.202 25447
2785 1 7 . 1 1 54 54 ILE H H 54 6.876 6.876 7.545 -0.669 25447
2786 1 7 . 1 1 55 55 ALA N N 55 129.823 129.823 123.513 6.310 25447
2787 1 7 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.631 -0.217 25447
2788 1 7 . 1 1 55 55 ALA CA C 55 51.610 51.610 50.579 1.031 25447
2789 1 7 . 1 1 55 55 ALA CB C 55 19.262 19.262 20.086 -0.824 25447
2790 1 7 . 1 1 55 55 ALA H H 55 8.499 8.499 8.474 0.025 25447
2791 1 7 . 1 1 56 56 ALA N N 56 126.300 126.300 126.362 -0.062 25447
2792 1 7 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.080 0.189 25447
2793 1 7 . 1 1 56 56 ALA CA C 56 53.474 53.474 54.798 -1.325 25447
2794 1 7 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.791 0.453 25447
2795 1 7 . 1 1 56 56 ALA H H 56 8.641 8.641 8.593 0.048 25447
2796 1 7 . 1 1 57 57 ASP N N 57 116.395 116.395 117.334 -0.939 25447
2797 1 7 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.358 0.121 25447
2798 1 7 . 1 1 57 57 ASP CA C 57 55.226 55.226 56.329 -1.103 25447
2799 1 7 . 1 1 57 57 ASP CB C 57 40.922 40.922 40.600 0.322 25447
2800 1 7 . 1 1 57 57 ASP H H 57 8.337 8.337 8.418 -0.081 25447
2801 1 7 . 1 1 58 58 ASP N N 58 118.557 118.557 118.789 -0.232 25447
2802 1 7 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.446 0.190 25447
2803 1 7 . 1 1 58 58 ASP CA C 58 55.144 55.144 56.089 -0.945 25447
2804 1 7 . 1 1 58 58 ASP CB C 58 41.504 41.504 41.308 0.196 25447
2805 1 7 . 1 1 58 58 ASP H H 58 8.027 8.027 7.931 0.096 25447
2806 1 7 . 1 1 59 59 VAL N N 59 118.898 118.898 118.742 0.156 25447
2807 1 7 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.218 -0.042 25447
2808 1 7 . 1 1 59 59 VAL CA C 59 62.300 62.300 61.032 1.268 25447
2809 1 7 . 1 1 59 59 VAL CB C 59 33.078 33.078 34.901 -1.823 25447
2810 1 7 . 1 1 59 59 VAL H H 59 7.716 7.716 7.482 0.234 25447
2811 1 7 . 1 1 60 60 GLU N N 60 122.888 122.888 125.132 -2.244 25447
2812 1 7 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.354 -0.070 25447
2813 1 7 . 1 1 60 60 GLU CA C 60 56.546 56.546 56.503 0.043 25447
2814 1 7 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.211 -0.429 25447
2815 1 7 . 1 1 60 60 GLU H H 60 8.367 8.367 8.412 -0.045 25447
2816 1 7 . 1 1 61 61 LEU N N 61 124.827 124.827 124.908 -0.081 25447
2817 1 7 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.599 -0.241 25447
2818 1 7 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.391 0.425 25447
2819 1 7 . 1 1 61 61 LEU CB C 61 41.937 41.937 43.651 -1.714 25447
2820 1 7 . 1 1 61 61 LEU H H 61 8.198 8.198 8.463 -0.265 25447
2821 1 7 . 1 1 62 62 SER N N 62 118.715 118.715 118.664 0.051 25447
2822 1 7 . 1 1 62 62 SER HA H 62 4.809 4.809 5.010 -0.201 25447
2823 1 7 . 1 1 62 62 SER CA C 62 55.732 55.732 54.823 0.909 25447
2824 1 7 . 1 1 62 62 SER CB C 62 64.017 64.017 64.969 -0.952 25447
2825 1 7 . 1 1 62 62 SER H H 62 8.137 8.137 8.270 -0.133 25447
2826 1 7 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.279 -0.026 25447
2827 1 7 . 1 1 63 63 PRO CA C 63 64.896 64.896 65.056 -0.160 25447
2828 1 7 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.858 0.194 25447
2829 1 7 . 1 1 64 64 GLU N N 64 116.554 116.554 119.133 -2.579 25447
2830 1 7 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.089 -0.216 25447
2831 1 7 . 1 1 64 64 GLU CA C 64 58.719 58.719 59.044 -0.325 25447
2832 1 7 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.121 -0.440 25447
2833 1 7 . 1 1 64 64 GLU H H 64 8.316 8.316 8.384 -0.068 25447
2834 1 7 . 1 1 65 65 HIS N N 65 115.487 115.487 119.612 -4.125 25447
2835 1 7 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.262 0.018 25447
2836 1 7 . 1 1 65 65 HIS CA C 65 57.652 57.652 58.514 -0.862 25447
2837 1 7 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.583 0.299 25447
2838 1 7 . 1 1 65 65 HIS H H 65 7.274 7.274 7.919 -0.645 25447
2839 1 7 . 1 1 66 66 PHE N N 66 116.127 116.127 116.524 -0.397 25447
2840 1 7 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.267 0.499 25447
2841 1 7 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.545 -1.763 25447
2842 1 7 . 1 1 66 66 PHE CB C 66 38.908 38.908 38.101 0.807 25447
2843 1 7 . 1 1 66 66 PHE H H 66 7.239 7.239 7.552 -0.313 25447
2844 1 7 . 1 1 67 67 ARG N N 67 112.468 112.468 119.014 -6.546 25447
2845 1 7 . 1 1 67 67 ARG HA H 67 4.085 4.085 3.958 0.127 25447
2846 1 7 . 1 1 67 67 ARG CA C 67 58.287 58.287 58.497 -0.210 25447
2847 1 7 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.401 1.359 25447
2848 1 7 . 1 1 67 67 ARG H H 67 6.628 6.628 7.725 -1.097 25447
2849 1 7 . 1 1 68 68 SER N N 68 109.305 109.305 112.048 -2.743 25447
2850 1 7 . 1 1 68 68 SER HA H 68 4.980 4.980 4.865 0.115 25447
2851 1 7 . 1 1 68 68 SER CA C 68 55.785 55.785 55.960 -0.175 25447
2852 1 7 . 1 1 68 68 SER CB C 68 67.691 67.691 65.365 2.326 25447
2853 1 7 . 1 1 68 68 SER H H 68 8.145 8.145 7.349 0.796 25447
2854 1 7 . 1 1 69 69 ILE N N 69 122.602 122.602 125.438 -2.836 25447
2855 1 7 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.725 -0.049 25447
2856 1 7 . 1 1 69 69 ILE CA C 69 66.754 66.754 65.033 1.721 25447
2857 1 7 . 1 1 69 69 ILE CB C 69 37.296 37.296 37.575 -0.279 25447
2858 1 7 . 1 1 69 69 ILE H H 69 9.775 9.775 8.932 0.843 25447
2859 1 7 . 1 1 70 70 ARG N N 70 118.764 118.764 119.242 -0.478 25447
2860 1 7 . 1 1 70 70 ARG HA H 70 3.955 3.955 4.215 -0.260 25447
2861 1 7 . 1 1 70 70 ARG CA C 70 60.533 60.533 59.333 1.200 25447
2862 1 7 . 1 1 70 70 ARG CB C 70 30.418 30.418 29.375 1.043 25447
2863 1 7 . 1 1 70 70 ARG H H 70 8.910 8.910 7.747 1.163 25447
2864 1 7 . 1 1 71 71 SER N N 71 117.670 117.670 115.208 2.462 25447
2865 1 7 . 1 1 71 71 SER HA H 71 4.330 4.330 4.252 0.078 25447
2866 1 7 . 1 1 71 71 SER CA C 71 62.287 62.287 61.525 0.762 25447
2867 1 7 . 1 1 71 71 SER CB C 71 63.278 63.278 62.584 0.694 25447
2868 1 7 . 1 1 71 71 SER H H 71 8.518 8.518 7.570 0.948 25447
2869 1 7 . 1 1 72 72 ILE N N 72 127.447 127.447 123.556 3.891 25447
2870 1 7 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.922 -0.012 25447
2871 1 7 . 1 1 72 72 ILE CA C 72 66.811 66.811 64.462 2.349 25447
2872 1 7 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.800 0.598 25447
2873 1 7 . 1 1 72 72 ILE H H 72 8.762 8.762 7.147 1.615 25447
2874 1 7 . 1 1 73 73 ASP N N 73 121.636 121.636 120.122 1.514 25447
2875 1 7 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.395 -0.382 25447
2876 1 7 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.471 1.677 25447
2877 1 7 . 1 1 73 73 ASP CB C 73 43.540 43.540 39.938 3.602 25447
2878 1 7 . 1 1 73 73 ASP H H 73 8.677 8.677 8.052 0.625 25447
2879 1 7 . 1 1 74 74 ALA N N 74 118.793 118.793 122.061 -3.268 25447
2880 1 7 . 1 1 74 74 ALA HA H 74 4.044 4.044 4.069 -0.025 25447
2881 1 7 . 1 1 74 74 ALA CA C 74 55.321 55.321 54.826 0.495 25447
2882 1 7 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.326 -0.381 25447
2883 1 7 . 1 1 74 74 ALA H H 74 8.005 8.005 7.799 0.206 25447
2884 1 7 . 1 1 75 75 PHE N N 75 121.235 121.235 119.343 1.892 25447
2885 1 7 . 1 1 75 75 PHE HA H 75 4.038 4.038 3.920 0.118 25447
2886 1 7 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.737 -0.722 25447
2887 1 7 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.223 -0.386 25447
2888 1 7 . 1 1 75 75 PHE H H 75 8.353 8.353 8.491 -0.138 25447
2889 1 7 . 1 1 76 76 VAL N N 76 120.866 120.866 118.908 1.958 25447
2890 1 7 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.361 -0.418 25447
2891 1 7 . 1 1 76 76 VAL CA C 76 66.901 66.901 66.756 0.145 25447
2892 1 7 . 1 1 76 76 VAL CB C 76 31.247 31.247 30.971 0.276 25447
2893 1 7 . 1 1 76 76 VAL H H 76 8.544 8.544 8.483 0.061 25447
2894 1 7 . 1 1 77 77 VAL N N 77 121.408 121.408 119.273 2.135 25447
2895 1 7 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.787 -0.292 25447
2896 1 7 . 1 1 77 77 VAL CA C 77 66.833 66.833 64.983 1.850 25447
2897 1 7 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.001 0.929 25447
2898 1 7 . 1 1 77 77 VAL H H 77 8.708 8.708 8.278 0.430 25447
2899 1 7 . 1 1 78 78 GLY N N 78 106.402 106.402 106.914 -0.512 25447
2900 1 7 . 1 1 78 78 GLY CA C 78 46.840 46.840 46.451 0.389 25447
2901 1 7 . 1 1 78 78 GLY H H 78 7.945 7.945 8.478 -0.533 25447
2902 1 7 . 1 1 79 79 ALA N N 79 121.146 121.146 122.195 -1.049 25447
2903 1 7 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.863 0.344 25447
2904 1 7 . 1 1 79 79 ALA CA C 79 52.929 52.929 53.881 -0.952 25447
2905 1 7 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.388 0.873 25447
2906 1 7 . 1 1 79 79 ALA H H 79 7.639 7.639 7.597 0.042 25447
2907 1 7 . 1 1 80 80 THR N N 80 107.668 107.668 108.889 -1.221 25447
2908 1 7 . 1 1 80 80 THR HA H 80 4.443 4.443 4.271 0.172 25447
2909 1 7 . 1 1 80 80 THR CA C 80 61.406 61.406 62.885 -1.479 25447
2910 1 7 . 1 1 80 80 THR CB C 80 70.767 70.767 69.566 1.201 25447
2911 1 7 . 1 1 80 80 THR H H 80 7.449 7.449 7.736 -0.287 25447
2912 1 7 . 1 1 81 81 THR N N 81 119.953 119.953 115.922 4.031 25447
2913 1 7 . 1 1 81 81 THR HA H 81 4.665 4.665 4.745 -0.080 25447
2914 1 7 . 1 1 81 81 THR CA C 81 60.412 60.412 59.023 1.389 25447
2915 1 7 . 1 1 81 81 THR CB C 81 70.113 70.113 69.237 0.876 25447
2916 1 7 . 1 1 81 81 THR H H 81 7.685 7.685 7.495 0.190 25447
2917 1 7 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.436 0.253 25447
2918 1 7 . 1 1 82 82 PRO CA C 82 61.688 61.688 62.628 -0.940 25447
2919 1 7 . 1 1 82 82 PRO CB C 82 30.969 30.969 30.630 0.339 25447
2920 1 7 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.274 0.207 25447
2921 1 7 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.784 0.147 25447
2922 1 7 . 1 1 83 83 PRO CB C 83 32.193 32.193 31.982 0.211 25447
2923 1 7 . 1 1 84 84 VAL N N 84 120.691 120.691 118.205 2.486 25447
2924 1 7 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.277 -0.184 25447
2925 1 7 . 1 1 84 84 VAL CA C 84 62.339 62.339 61.161 1.178 25447
2926 1 7 . 1 1 84 84 VAL CB C 84 32.851 32.851 33.054 -0.203 25447
2927 1 7 . 1 1 84 84 VAL H H 84 8.257 8.257 8.155 0.102 25447
2928 1 7 . 1 1 85 85 GLU N N 85 127.655 127.655 121.484 6.171 25447
2929 1 7 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.874 0.410 25447
2930 1 7 . 1 1 85 85 GLU CA C 85 56.754 56.754 56.398 0.356 25447
2931 1 7 . 1 1 85 85 GLU CB C 85 30.559 30.559 27.793 2.766 25447
2932 1 7 . 1 1 85 85 GLU H H 85 8.202 8.202 8.761 -0.559 25447
2933 1 7 . 1 1 86 86 ALA N N 86 126.437 126.437 121.123 5.314 25447
2934 1 7 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.203 -0.152 25447
2935 1 7 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.278 -0.130 25447
2936 1 7 . 1 1 86 86 ALA CB C 86 19.460 19.460 19.753 -0.293 25447
2937 1 7 . 1 1 86 86 ALA H H 86 8.323 8.323 8.040 0.283 25447
2938 1 7 . 1 1 87 87 LYS N N 87 121.796 121.796 120.065 1.731 25447
2939 1 7 . 1 1 87 87 LYS HA H 87 4.347 4.347 4.083 0.264 25447
2940 1 7 . 1 1 87 87 LYS CA C 87 56.297 56.297 57.853 -1.556 25447
2941 1 7 . 1 1 87 87 LYS CB C 87 33.276 33.276 32.580 0.696 25447
2942 1 7 . 1 1 87 87 LYS H H 87 8.333 8.333 8.478 -0.145 25447
2943 1 7 . 1 1 88 88 LEU N N 88 125.576 125.576 120.703 4.873 25447
2944 1 7 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.469 -0.562 25447
2945 1 7 . 1 1 88 88 LEU CA C 88 55.772 55.772 54.017 1.755 25447
2946 1 7 . 1 1 88 88 LEU CB C 88 42.472 42.472 41.807 0.665 25447
2947 1 7 . 1 1 88 88 LEU H H 88 8.444 8.444 7.594 0.850 25447
2948 1 8 . 1 1 1 1 MET N N 1 120.668 120.668 116.934 3.734 25447
2949 1 8 . 1 1 1 1 MET HA H 1 4.484 4.484 4.618 -0.134 25447
2950 1 8 . 1 1 1 1 MET CA C 1 55.257 55.257 54.503 0.754 25447
2951 1 8 . 1 1 1 1 MET CB C 1 34.517 34.517 33.070 1.447 25447
2952 1 8 . 1 1 1 1 MET H H 1 8.313 8.313 7.567 0.746 25447
2953 1 8 . 1 1 2 2 GLN N N 2 123.739 123.739 119.511 4.228 25447
2954 1 8 . 1 1 2 2 GLN HA H 2 4.030 4.030 4.265 -0.235 25447
2955 1 8 . 1 1 2 2 GLN CA C 2 57.874 57.874 54.758 3.116 25447
2956 1 8 . 1 1 2 2 GLN CB C 2 29.938 29.938 29.640 0.298 25447
2957 1 8 . 1 1 2 2 GLN H H 2 9.455 9.455 8.697 0.758 25447
2958 1 8 . 1 1 3 3 HIS N N 3 119.115 119.115 120.803 -1.688 25447
2959 1 8 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.178 0.938 25447
2960 1 8 . 1 1 3 3 HIS CA C 3 55.494 55.494 57.305 -1.811 25447
2961 1 8 . 1 1 3 3 HIS CB C 3 31.015 31.015 27.269 3.746 25447
2962 1 8 . 1 1 3 3 HIS H H 3 9.783 9.783 8.760 1.023 25447
2963 1 8 . 1 1 4 4 ALA N N 4 122.648 122.648 120.291 2.357 25447
2964 1 8 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.054 -0.151 25447
2965 1 8 . 1 1 4 4 ALA CA C 4 56.479 56.479 55.316 1.163 25447
2966 1 8 . 1 1 4 4 ALA CB C 4 19.194 19.194 18.783 0.411 25447
2967 1 8 . 1 1 4 4 ALA H H 4 7.551 7.551 8.390 -0.839 25447
2968 1 8 . 1 1 5 5 SER N N 5 112.599 112.599 112.611 -0.012 25447
2969 1 8 . 1 1 5 5 SER HA H 5 4.298 4.298 4.210 0.088 25447
2970 1 8 . 1 1 5 5 SER CA C 5 62.117 62.117 61.350 0.767 25447
2971 1 8 . 1 1 5 5 SER CB C 5 62.334 62.334 62.499 -0.165 25447
2972 1 8 . 1 1 5 5 SER H H 5 8.736 8.736 8.224 0.512 25447
2973 1 8 . 1 1 6 6 VAL N N 6 122.866 122.866 122.714 0.152 25447
2974 1 8 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.795 0.310 25447
2975 1 8 . 1 1 6 6 VAL CA C 6 65.732 65.732 65.447 0.285 25447
2976 1 8 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.462 1.275 25447
2977 1 8 . 1 1 6 6 VAL H H 6 7.660 7.660 7.608 0.052 25447
2978 1 8 . 1 1 7 7 ILE N N 7 121.715 121.715 120.003 1.712 25447
2979 1 8 . 1 1 7 7 ILE HA H 7 4.224 4.224 4.152 0.072 25447
2980 1 8 . 1 1 7 7 ILE CA C 7 65.329 65.329 66.011 -0.682 25447
2981 1 8 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.459 1.234 25447
2982 1 8 . 1 1 7 7 ILE H H 7 8.519 8.519 7.586 0.933 25447
2983 1 8 . 1 1 8 8 ALA N N 8 121.373 121.373 121.746 -0.373 25447
2984 1 8 . 1 1 8 8 ALA HA H 8 3.895 3.895 4.019 -0.124 25447
2985 1 8 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.417 0.840 25447
2986 1 8 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.056 0.584 25447
2987 1 8 . 1 1 8 8 ALA H H 8 8.940 8.940 7.854 1.086 25447
2988 1 8 . 1 1 9 9 GLN N N 9 115.076 115.076 118.565 -3.489 25447
2989 1 8 . 1 1 9 9 GLN HA H 9 3.870 3.870 3.904 -0.034 25447
2990 1 8 . 1 1 9 9 GLN CA C 9 59.192 59.192 58.945 0.247 25447
2991 1 8 . 1 1 9 9 GLN CB C 9 28.138 28.138 28.623 -0.485 25447
2992 1 8 . 1 1 9 9 GLN H H 9 7.729 7.729 7.839 -0.110 25447
2993 1 8 . 1 1 10 10 PHE N N 10 120.207 120.207 119.336 0.871 25447
2994 1 8 . 1 1 10 10 PHE HA H 10 4.085 4.085 3.834 0.251 25447
2995 1 8 . 1 1 10 10 PHE CA C 10 60.893 60.893 61.720 -0.827 25447
2996 1 8 . 1 1 10 10 PHE CB C 10 38.932 38.932 37.916 1.016 25447
2997 1 8 . 1 1 10 10 PHE H H 10 7.301 7.301 7.839 -0.538 25447
2998 1 8 . 1 1 11 11 VAL N N 11 117.569 117.569 117.493 0.076 25447
2999 1 8 . 1 1 11 11 VAL HA H 11 3.307 3.307 3.948 -0.641 25447
3000 1 8 . 1 1 11 11 VAL CA C 11 66.508 66.508 65.970 0.538 25447
3001 1 8 . 1 1 11 11 VAL CB C 11 31.487 31.487 31.522 -0.035 25447
3002 1 8 . 1 1 11 11 VAL H H 11 8.370 8.370 7.874 0.496 25447
3003 1 8 . 1 1 12 12 VAL N N 12 117.909 117.909 121.376 -3.467 25447
3004 1 8 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.581 0.160 25447
3005 1 8 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.777 -0.901 25447
3006 1 8 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.631 -0.319 25447
3007 1 8 . 1 1 12 12 VAL H H 12 8.294 8.294 8.194 0.100 25447
3008 1 8 . 1 1 13 13 GLU N N 13 117.918 117.918 118.413 -0.495 25447
3009 1 8 . 1 1 13 13 GLU HA H 13 3.742 3.742 3.951 -0.209 25447
3010 1 8 . 1 1 13 13 GLU CA C 13 59.307 59.307 58.508 0.799 25447
3011 1 8 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.177 0.312 25447
3012 1 8 . 1 1 13 13 GLU H H 13 7.750 7.750 8.261 -0.511 25447
3013 1 8 . 1 1 14 14 GLU N N 14 113.478 113.478 118.180 -4.702 25447
3014 1 8 . 1 1 14 14 GLU HA H 14 3.778 3.778 3.850 -0.072 25447
3015 1 8 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.582 -1.782 25447
3016 1 8 . 1 1 14 14 GLU CB C 14 29.643 29.643 29.836 -0.193 25447
3017 1 8 . 1 1 14 14 GLU H H 14 7.603 7.603 7.882 -0.279 25447
3018 1 8 . 1 1 15 15 PHE N N 15 114.193 114.193 113.388 0.805 25447
3019 1 8 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.641 0.298 25447
3020 1 8 . 1 1 15 15 PHE CA C 15 58.095 58.095 58.655 -0.560 25447
3021 1 8 . 1 1 15 15 PHE CB C 15 42.095 42.095 42.005 0.090 25447
3022 1 8 . 1 1 15 15 PHE H H 15 7.908 7.908 7.520 0.388 25447
3023 1 8 . 1 1 16 16 LEU N N 16 121.492 121.492 121.380 0.112 25447
3024 1 8 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.871 0.096 25447
3025 1 8 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.486 -0.109 25447
3026 1 8 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.580 1.153 25447
3027 1 8 . 1 1 16 16 LEU H H 16 8.015 8.015 8.264 -0.249 25447
3028 1 8 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.449 -0.066 25447
3029 1 8 . 1 1 17 17 PRO CA C 17 64.858 64.858 63.950 0.908 25447
3030 1 8 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.896 -0.067 25447
3031 1 8 . 1 1 18 18 ASP N N 18 116.508 116.508 118.391 -1.883 25447
3032 1 8 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.730 -0.162 25447
3033 1 8 . 1 1 18 18 ASP CA C 18 54.688 54.688 53.927 0.761 25447
3034 1 8 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.681 -0.055 25447
3035 1 8 . 1 1 18 18 ASP H H 18 8.399 8.399 8.613 -0.214 25447
3036 1 8 . 1 1 19 19 VAL N N 19 122.135 122.135 120.621 1.514 25447
3037 1 8 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.166 -0.048 25447
3038 1 8 . 1 1 19 19 VAL CA C 19 61.293 61.293 60.464 0.829 25447
3039 1 8 . 1 1 19 19 VAL CB C 19 33.582 33.582 33.424 0.158 25447
3040 1 8 . 1 1 19 19 VAL H H 19 7.760 7.760 7.226 0.534 25447
3041 1 8 . 1 1 20 20 ALA N N 20 129.301 129.301 130.669 -1.368 25447
3042 1 8 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.536 0.063 25447
3043 1 8 . 1 1 20 20 ALA CA C 20 50.270 50.270 50.250 0.020 25447
3044 1 8 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.382 -0.954 25447
3045 1 8 . 1 1 20 20 ALA H H 20 8.761 8.761 8.506 0.255 25447
3046 1 8 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.174 -0.097 25447
3047 1 8 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.477 0.726 25447
3048 1 8 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.802 -0.394 25447
3049 1 8 . 1 1 22 22 ALA N N 22 116.106 116.106 118.293 -2.187 25447
3050 1 8 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.154 -0.037 25447
3051 1 8 . 1 1 22 22 ALA CA C 22 53.996 53.996 53.987 0.009 25447
3052 1 8 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.350 0.494 25447
3053 1 8 . 1 1 22 22 ALA H H 22 8.064 8.064 7.988 0.076 25447
3054 1 8 . 1 1 23 23 ASP N N 23 115.541 115.541 115.758 -0.217 25447
3055 1 8 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.594 0.083 25447
3056 1 8 . 1 1 23 23 ASP CA C 23 54.336 54.336 53.778 0.558 25447
3057 1 8 . 1 1 23 23 ASP CB C 23 41.353 41.353 40.605 0.748 25447
3058 1 8 . 1 1 23 23 ASP H H 23 8.003 8.003 8.101 -0.098 25447
3059 1 8 . 1 1 24 24 VAL N N 24 121.517 121.517 121.298 0.219 25447
3060 1 8 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.187 -0.366 25447
3061 1 8 . 1 1 24 24 VAL CA C 24 62.345 62.345 61.030 1.315 25447
3062 1 8 . 1 1 24 24 VAL CB C 24 31.733 31.733 32.537 -0.804 25447
3063 1 8 . 1 1 24 24 VAL H H 24 7.069 7.069 7.554 -0.485 25447
3064 1 8 . 1 1 25 25 ASP N N 25 129.329 129.329 126.558 2.771 25447
3065 1 8 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.762 -0.188 25447
3066 1 8 . 1 1 25 25 ASP CA C 25 54.566 54.566 52.773 1.793 25447
3067 1 8 . 1 1 25 25 ASP CB C 25 42.333 42.333 42.282 0.051 25447
3068 1 8 . 1 1 25 25 ASP H H 25 8.474 8.474 8.684 -0.210 25447
3069 1 8 . 1 1 26 26 VAL N N 26 121.920 121.920 122.277 -0.357 25447
3070 1 8 . 1 1 26 26 VAL HA H 26 4.108 4.108 4.127 -0.019 25447
3071 1 8 . 1 1 26 26 VAL CA C 26 64.518 64.518 62.853 1.665 25447
3072 1 8 . 1 1 26 26 VAL CB C 26 31.198 31.198 31.059 0.139 25447
3073 1 8 . 1 1 26 26 VAL H H 26 8.591 8.591 8.741 -0.150 25447
3074 1 8 . 1 1 27 27 ASP N N 27 116.286 116.286 119.182 -2.896 25447
3075 1 8 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.662 0.483 25447
3076 1 8 . 1 1 27 27 ASP CA C 27 54.181 54.181 55.166 -0.985 25447
3077 1 8 . 1 1 27 27 ASP CB C 27 42.575 42.575 41.641 0.934 25447
3078 1 8 . 1 1 27 27 ASP H H 27 8.609 8.609 8.220 0.389 25447
3079 1 8 . 1 1 28 28 LEU N N 28 125.116 125.116 122.180 2.936 25447
3080 1 8 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.540 -0.529 25447
3081 1 8 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.380 1.707 25447
3082 1 8 . 1 1 28 28 LEU CB C 28 43.321 43.321 43.899 -0.578 25447
3083 1 8 . 1 1 28 28 LEU H H 28 7.374 7.374 7.348 0.026 25447
3084 1 8 . 1 1 29 29 ASP N N 29 125.924 125.924 124.681 1.243 25447
3085 1 8 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.630 0.204 25447
3086 1 8 . 1 1 29 29 ASP CA C 29 53.920 53.920 54.942 -1.022 25447
3087 1 8 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.244 0.135 25447
3088 1 8 . 1 1 29 29 ASP H H 29 8.699 8.699 8.549 0.150 25447
3089 1 8 . 1 1 30 30 LEU N N 30 129.975 129.975 124.892 5.083 25447
3090 1 8 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.129 -0.212 25447
3091 1 8 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.453 -1.065 25447
3092 1 8 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.432 -0.193 25447
3093 1 8 . 1 1 30 30 LEU H H 30 9.718 9.718 8.252 1.466 25447
3094 1 8 . 1 1 31 31 VAL N N 31 121.212 121.212 117.458 3.754 25447
3095 1 8 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.668 0.525 25447
3096 1 8 . 1 1 31 31 VAL CA C 31 64.433 64.433 65.780 -1.347 25447
3097 1 8 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.142 1.033 25447
3098 1 8 . 1 1 31 31 VAL H H 31 8.163 8.163 7.602 0.561 25447
3099 1 8 . 1 1 32 32 ASP N N 32 124.893 124.893 118.627 6.266 25447
3100 1 8 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.333 0.025 25447
3101 1 8 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.686 0.539 25447
3102 1 8 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.717 0.018 25447
3103 1 8 . 1 1 32 32 ASP H H 32 9.385 9.385 8.703 0.682 25447
3104 1 8 . 1 1 33 33 ASN N N 33 111.484 111.484 116.664 -5.180 25447
3105 1 8 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.574 0.146 25447
3106 1 8 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.628 0.258 25447
3107 1 8 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.038 -0.032 25447
3108 1 8 . 1 1 33 33 ASN H H 33 7.396 7.396 7.676 -0.280 25447
3109 1 8 . 1 1 34 34 GLY N N 34 106.957 106.957 106.095 0.862 25447
3110 1 8 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.698 0.909 25447
3111 1 8 . 1 1 34 34 GLY H H 34 7.618 7.618 7.947 -0.329 25447
3112 1 8 . 1 1 35 35 VAL N N 35 120.424 120.424 118.517 1.907 25447
3113 1 8 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.443 0.323 25447
3114 1 8 . 1 1 35 35 VAL CA C 35 65.125 65.125 64.648 0.477 25447
3115 1 8 . 1 1 35 35 VAL CB C 35 31.879 31.879 32.142 -0.263 25447
3116 1 8 . 1 1 35 35 VAL H H 35 7.792 7.792 7.750 0.042 25447
3117 1 8 . 1 1 36 36 ILE N N 36 116.364 116.364 120.427 -4.063 25447
3118 1 8 . 1 1 36 36 ILE HA H 36 3.737 3.737 3.922 -0.185 25447
3119 1 8 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.666 -0.981 25447
3120 1 8 . 1 1 36 36 ILE CB C 36 38.807 38.807 37.428 1.379 25447
3121 1 8 . 1 1 36 36 ILE H H 36 7.331 7.331 7.774 -0.443 25447
3122 1 8 . 1 1 37 37 ASP N N 37 127.306 127.306 128.059 -0.753 25447
3123 1 8 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.718 -0.054 25447
3124 1 8 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.894 -1.278 25447
3125 1 8 . 1 1 37 37 ASP CB C 37 41.209 41.209 42.521 -1.312 25447
3126 1 8 . 1 1 37 37 ASP H H 37 7.874 7.874 7.884 -0.010 25447
3127 1 8 . 1 1 38 38 ALA N N 38 120.352 120.352 122.951 -2.599 25447
3128 1 8 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.109 -0.114 25447
3129 1 8 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.322 0.970 25447
3130 1 8 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.612 -0.300 25447
3131 1 8 . 1 1 38 38 ALA H H 38 8.244 8.244 8.334 -0.090 25447
3132 1 8 . 1 1 39 39 LEU N N 39 117.438 117.438 118.392 -0.954 25447
3133 1 8 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.206 0.044 25447
3134 1 8 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.062 0.293 25447
3135 1 8 . 1 1 39 39 LEU CB C 39 41.236 41.236 41.195 0.041 25447
3136 1 8 . 1 1 39 39 LEU H H 39 7.688 7.688 8.441 -0.753 25447
3137 1 8 . 1 1 40 40 GLY N N 40 112.015 112.015 107.995 4.020 25447
3138 1 8 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.314 0.785 25447
3139 1 8 . 1 1 40 40 GLY H H 40 8.732 8.732 8.369 0.363 25447
3140 1 8 . 1 1 41 41 LEU N N 41 122.983 122.983 123.371 -0.388 25447
3141 1 8 . 1 1 41 41 LEU HA H 41 3.851 3.851 4.007 -0.156 25447
3142 1 8 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.597 0.735 25447
3143 1 8 . 1 1 41 41 LEU CB C 41 41.639 41.639 41.930 -0.291 25447
3144 1 8 . 1 1 41 41 LEU H H 41 8.548 8.548 8.211 0.337 25447
3145 1 8 . 1 1 42 42 LEU N N 42 116.076 116.076 119.997 -3.921 25447
3146 1 8 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.903 0.125 25447
3147 1 8 . 1 1 42 42 LEU CA C 42 58.064 58.064 58.527 -0.463 25447
3148 1 8 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.826 -0.886 25447
3149 1 8 . 1 1 42 42 LEU H H 42 7.168 7.168 7.647 -0.479 25447
3150 1 8 . 1 1 43 43 LYS N N 43 119.831 119.831 119.114 0.717 25447
3151 1 8 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.041 0.243 25447
3152 1 8 . 1 1 43 43 LYS CA C 43 59.644 59.644 59.898 -0.254 25447
3153 1 8 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.290 0.237 25447
3154 1 8 . 1 1 43 43 LYS H H 43 7.640 7.640 8.340 -0.700 25447
3155 1 8 . 1 1 44 44 VAL N N 44 121.046 121.046 120.177 0.869 25447
3156 1 8 . 1 1 44 44 VAL HA H 44 3.949 3.949 4.045 -0.096 25447
3157 1 8 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.647 -0.004 25447
3158 1 8 . 1 1 44 44 VAL H H 44 8.269 8.269 7.898 0.371 25447
3159 1 8 . 1 1 45 45 ILE N N 45 119.333 119.333 119.896 -0.563 25447
3160 1 8 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.673 -0.269 25447
3161 1 8 . 1 1 45 45 ILE CA C 45 66.148 66.148 64.234 1.914 25447
3162 1 8 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.204 1.073 25447
3163 1 8 . 1 1 45 45 ILE H H 45 8.145 8.145 7.859 0.286 25447
3164 1 8 . 1 1 46 46 ALA N N 46 121.213 121.213 123.614 -2.401 25447
3165 1 8 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.447 -0.190 25447
3166 1 8 . 1 1 46 46 ALA CA C 46 55.164 55.164 54.835 0.329 25447
3167 1 8 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.565 -0.197 25447
3168 1 8 . 1 1 46 46 ALA H H 46 7.792 7.792 8.025 -0.233 25447
3169 1 8 . 1 1 47 47 TRP N N 47 121.416 121.416 120.063 1.353 25447
3170 1 8 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.438 -0.204 25447
3171 1 8 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.507 2.163 25447
3172 1 8 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.335 -1.096 25447
3173 1 8 . 1 1 47 47 TRP H H 47 8.093 8.093 7.962 0.131 25447
3174 1 8 . 1 1 48 48 LEU N N 48 118.963 118.963 121.210 -2.247 25447
3175 1 8 . 1 1 48 48 LEU HA H 48 3.586 3.586 2.797 0.789 25447
3176 1 8 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.684 0.511 25447
3177 1 8 . 1 1 48 48 LEU CB C 48 42.251 42.251 41.209 1.042 25447
3178 1 8 . 1 1 48 48 LEU H H 48 8.693 8.693 7.314 1.379 25447
3179 1 8 . 1 1 49 49 GLU N N 49 119.131 119.131 117.013 2.118 25447
3180 1 8 . 1 1 49 49 GLU HA H 49 4.050 4.050 3.975 0.075 25447
3181 1 8 . 1 1 49 49 GLU CA C 49 59.862 59.862 59.058 0.804 25447
3182 1 8 . 1 1 49 49 GLU CB C 49 29.586 29.586 28.927 0.659 25447
3183 1 8 . 1 1 49 49 GLU H H 49 7.771 7.771 7.641 0.130 25447
3184 1 8 . 1 1 50 50 ASP N N 50 119.941 119.941 120.910 -0.969 25447
3185 1 8 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.419 -0.182 25447
3186 1 8 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.531 0.824 25447
3187 1 8 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.720 1.663 25447
3188 1 8 . 1 1 50 50 ASP H H 50 7.697 7.697 7.613 0.084 25447
3189 1 8 . 1 1 51 51 ARG N N 51 116.911 116.911 117.816 -0.905 25447
3190 1 8 . 1 1 51 51 ARG HA H 51 3.736 3.736 4.032 -0.296 25447
3191 1 8 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.285 -1.921 25447
3192 1 8 . 1 1 51 51 ARG CB C 51 29.315 29.315 30.252 -0.937 25447
3193 1 8 . 1 1 51 51 ARG H H 51 8.881 8.881 7.743 1.138 25447
3194 1 8 . 1 1 52 52 PHE N N 52 112.328 112.328 116.722 -4.394 25447
3195 1 8 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.619 0.056 25447
3196 1 8 . 1 1 52 52 PHE CA C 52 57.413 57.413 58.095 -0.682 25447
3197 1 8 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.460 1.432 25447
3198 1 8 . 1 1 52 52 PHE H H 52 7.284 7.284 7.461 -0.177 25447
3199 1 8 . 1 1 53 53 GLY N N 53 109.826 109.826 108.795 1.031 25447
3200 1 8 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.567 1.234 25447
3201 1 8 . 1 1 53 53 GLY H H 53 7.427 7.427 7.945 -0.518 25447
3202 1 8 . 1 1 54 54 ILE N N 54 119.127 119.127 115.273 3.854 25447
3203 1 8 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.528 -0.577 25447
3204 1 8 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.538 1.147 25447
3205 1 8 . 1 1 54 54 ILE CB C 54 39.490 39.490 39.829 -0.339 25447
3206 1 8 . 1 1 54 54 ILE H H 54 6.876 6.876 7.628 -0.751 25447
3207 1 8 . 1 1 55 55 ALA N N 55 129.823 129.823 123.872 5.951 25447
3208 1 8 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.540 -0.126 25447
3209 1 8 . 1 1 55 55 ALA CA C 55 51.610 51.610 50.665 0.945 25447
3210 1 8 . 1 1 55 55 ALA CB C 55 19.262 19.262 20.078 -0.816 25447
3211 1 8 . 1 1 55 55 ALA H H 55 8.499 8.499 8.098 0.401 25447
3212 1 8 . 1 1 56 56 ALA N N 56 126.300 126.300 126.713 -0.413 25447
3213 1 8 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.058 0.211 25447
3214 1 8 . 1 1 56 56 ALA CA C 56 53.474 53.474 54.572 -1.098 25447
3215 1 8 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.599 0.645 25447
3216 1 8 . 1 1 56 56 ALA H H 56 8.641 8.641 8.805 -0.164 25447
3217 1 8 . 1 1 57 57 ASP N N 57 116.395 116.395 117.663 -1.268 25447
3218 1 8 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.373 0.106 25447
3219 1 8 . 1 1 57 57 ASP CA C 57 55.226 55.226 56.472 -1.246 25447
3220 1 8 . 1 1 57 57 ASP CB C 57 40.922 40.922 40.017 0.905 25447
3221 1 8 . 1 1 57 57 ASP H H 57 8.337 8.337 8.571 -0.234 25447
3222 1 8 . 1 1 58 58 ASP N N 58 118.557 118.557 118.842 -0.285 25447
3223 1 8 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.459 0.177 25447
3224 1 8 . 1 1 58 58 ASP CA C 58 55.144 55.144 55.713 -0.569 25447
3225 1 8 . 1 1 58 58 ASP CB C 58 41.504 41.504 41.630 -0.126 25447
3226 1 8 . 1 1 58 58 ASP H H 58 8.027 8.027 7.954 0.073 25447
3227 1 8 . 1 1 59 59 VAL N N 59 118.898 118.898 118.093 0.805 25447
3228 1 8 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.294 -0.118 25447
3229 1 8 . 1 1 59 59 VAL CA C 59 62.300 62.300 60.823 1.477 25447
3230 1 8 . 1 1 59 59 VAL CB C 59 33.078 33.078 33.841 -0.763 25447
3231 1 8 . 1 1 59 59 VAL H H 59 7.716 7.716 7.541 0.175 25447
3232 1 8 . 1 1 60 60 GLU N N 60 122.888 122.888 126.681 -3.793 25447
3233 1 8 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.455 -0.171 25447
3234 1 8 . 1 1 60 60 GLU CA C 60 56.546 56.546 55.739 0.807 25447
3235 1 8 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.674 -0.892 25447
3236 1 8 . 1 1 60 60 GLU H H 60 8.367 8.367 8.409 -0.043 25447
3237 1 8 . 1 1 61 61 LEU N N 61 124.827 124.827 125.270 -0.443 25447
3238 1 8 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.460 -0.102 25447
3239 1 8 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.207 0.609 25447
3240 1 8 . 1 1 61 61 LEU CB C 61 41.937 41.937 42.861 -0.924 25447
3241 1 8 . 1 1 61 61 LEU H H 61 8.198 8.198 8.451 -0.253 25447
3242 1 8 . 1 1 62 62 SER N N 62 118.715 118.715 119.091 -0.376 25447
3243 1 8 . 1 1 62 62 SER HA H 62 4.809 4.809 4.968 -0.159 25447
3244 1 8 . 1 1 62 62 SER CA C 62 55.732 55.732 55.700 0.032 25447
3245 1 8 . 1 1 62 62 SER CB C 62 64.017 64.017 65.005 -0.988 25447
3246 1 8 . 1 1 62 62 SER H H 62 8.137 8.137 8.242 -0.105 25447
3247 1 8 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.293 -0.041 25447
3248 1 8 . 1 1 63 63 PRO CA C 63 64.896 64.896 65.176 -0.280 25447
3249 1 8 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.859 0.193 25447
3250 1 8 . 1 1 64 64 GLU N N 64 116.554 116.554 118.646 -2.092 25447
3251 1 8 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.152 -0.279 25447
3252 1 8 . 1 1 64 64 GLU CA C 64 58.719 58.719 58.818 -0.099 25447
3253 1 8 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.210 -0.529 25447
3254 1 8 . 1 1 64 64 GLU H H 64 8.316 8.316 8.433 -0.117 25447
3255 1 8 . 1 1 65 65 HIS N N 65 115.487 115.487 120.004 -4.517 25447
3256 1 8 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.237 0.043 25447
3257 1 8 . 1 1 65 65 HIS CA C 65 57.652 57.652 58.149 -0.497 25447
3258 1 8 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.673 0.209 25447
3259 1 8 . 1 1 65 65 HIS H H 65 7.274 7.274 8.386 -1.112 25447
3260 1 8 . 1 1 66 66 PHE N N 66 116.127 116.127 116.396 -0.269 25447
3261 1 8 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.479 0.287 25447
3262 1 8 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.928 -2.146 25447
3263 1 8 . 1 1 66 66 PHE CB C 66 38.908 38.908 37.410 1.498 25447
3264 1 8 . 1 1 66 66 PHE H H 66 7.239 7.239 7.726 -0.487 25447
3265 1 8 . 1 1 67 67 ARG N N 67 112.468 112.468 119.742 -7.274 25447
3266 1 8 . 1 1 67 67 ARG HA H 67 4.085 4.085 3.977 0.108 25447
3267 1 8 . 1 1 67 67 ARG CA C 67 58.287 58.287 59.080 -0.793 25447
3268 1 8 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.363 1.397 25447
3269 1 8 . 1 1 67 67 ARG H H 67 6.628 6.628 7.889 -1.261 25447
3270 1 8 . 1 1 68 68 SER N N 68 109.305 109.305 110.770 -1.465 25447
3271 1 8 . 1 1 68 68 SER HA H 68 4.980 4.980 4.892 0.088 25447
3272 1 8 . 1 1 68 68 SER CA C 68 55.785 55.785 56.770 -0.985 25447
3273 1 8 . 1 1 68 68 SER CB C 68 67.691 67.691 66.359 1.332 25447
3274 1 8 . 1 1 68 68 SER H H 68 8.145 8.145 7.487 0.658 25447
3275 1 8 . 1 1 69 69 ILE N N 69 122.602 122.602 122.350 0.252 25447
3276 1 8 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.774 -0.098 25447
3277 1 8 . 1 1 69 69 ILE CA C 69 66.754 66.754 65.264 1.489 25447
3278 1 8 . 1 1 69 69 ILE CB C 69 37.296 37.296 37.653 -0.357 25447
3279 1 8 . 1 1 69 69 ILE H H 69 9.775 9.775 9.130 0.645 25447
3280 1 8 . 1 1 70 70 ARG N N 70 118.764 118.764 118.865 -0.101 25447
3281 1 8 . 1 1 70 70 ARG HA H 70 3.955 3.955 3.911 0.044 25447
3282 1 8 . 1 1 70 70 ARG CA C 70 60.533 60.533 60.048 0.485 25447
3283 1 8 . 1 1 70 70 ARG CB C 70 30.418 30.418 29.724 0.694 25447
3284 1 8 . 1 1 70 70 ARG H H 70 8.910 8.910 8.557 0.353 25447
3285 1 8 . 1 1 71 71 SER N N 71 117.670 117.670 115.396 2.274 25447
3286 1 8 . 1 1 71 71 SER HA H 71 4.330 4.330 4.305 0.025 25447
3287 1 8 . 1 1 71 71 SER CA C 71 62.287 62.287 61.720 0.567 25447
3288 1 8 . 1 1 71 71 SER CB C 71 63.278 63.278 62.936 0.342 25447
3289 1 8 . 1 1 71 71 SER H H 71 8.518 8.518 7.680 0.838 25447
3290 1 8 . 1 1 72 72 ILE N N 72 127.447 127.447 124.545 2.902 25447
3291 1 8 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.796 0.114 25447
3292 1 8 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.383 1.428 25447
3293 1 8 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.571 0.827 25447
3294 1 8 . 1 1 72 72 ILE H H 72 8.762 8.762 7.511 1.251 25447
3295 1 8 . 1 1 73 73 ASP N N 73 121.636 121.636 120.042 1.594 25447
3296 1 8 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.336 -0.323 25447
3297 1 8 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.279 1.869 25447
3298 1 8 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.704 2.836 25447
3299 1 8 . 1 1 73 73 ASP H H 73 8.677 8.677 8.052 0.625 25447
3300 1 8 . 1 1 74 74 ALA N N 74 118.793 118.793 121.969 -3.176 25447
3301 1 8 . 1 1 74 74 ALA HA H 74 4.044 4.044 4.091 -0.047 25447
3302 1 8 . 1 1 74 74 ALA CA C 74 55.321 55.321 54.952 0.369 25447
3303 1 8 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.347 -0.402 25447
3304 1 8 . 1 1 74 74 ALA H H 74 8.005 8.005 7.716 0.289 25447
3305 1 8 . 1 1 75 75 PHE N N 75 121.235 121.235 119.898 1.337 25447
3306 1 8 . 1 1 75 75 PHE HA H 75 4.038 4.038 3.983 0.055 25447
3307 1 8 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.898 -0.883 25447
3308 1 8 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.276 -0.439 25447
3309 1 8 . 1 1 75 75 PHE H H 75 8.353 8.353 8.508 -0.155 25447
3310 1 8 . 1 1 76 76 VAL N N 76 120.866 120.866 119.051 1.815 25447
3311 1 8 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.368 -0.425 25447
3312 1 8 . 1 1 76 76 VAL CA C 76 66.901 66.901 67.228 -0.327 25447
3313 1 8 . 1 1 76 76 VAL CB C 76 31.247 31.247 31.564 -0.317 25447
3314 1 8 . 1 1 76 76 VAL H H 76 8.544 8.544 7.914 0.630 25447
3315 1 8 . 1 1 77 77 VAL N N 77 121.408 121.408 119.460 1.948 25447
3316 1 8 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.667 -0.172 25447
3317 1 8 . 1 1 77 77 VAL CA C 77 66.833 66.833 66.446 0.387 25447
3318 1 8 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.235 0.695 25447
3319 1 8 . 1 1 77 77 VAL H H 77 8.708 8.708 8.133 0.575 25447
3320 1 8 . 1 1 78 78 GLY N N 78 106.402 106.402 106.793 -0.391 25447
3321 1 8 . 1 1 78 78 GLY CA C 78 46.840 46.840 47.014 -0.174 25447
3322 1 8 . 1 1 78 78 GLY H H 78 7.945 7.945 8.621 -0.676 25447
3323 1 8 . 1 1 79 79 ALA N N 79 121.146 121.146 122.810 -1.664 25447
3324 1 8 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.887 0.320 25447
3325 1 8 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.429 -1.500 25447
3326 1 8 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.096 1.165 25447
3327 1 8 . 1 1 79 79 ALA H H 79 7.639 7.639 7.475 0.164 25447
3328 1 8 . 1 1 80 80 THR N N 80 107.668 107.668 110.174 -2.506 25447
3329 1 8 . 1 1 80 80 THR HA H 80 4.443 4.443 4.229 0.214 25447
3330 1 8 . 1 1 80 80 THR CA C 80 61.406 61.406 63.246 -1.840 25447
3331 1 8 . 1 1 80 80 THR CB C 80 70.767 70.767 69.674 1.093 25447
3332 1 8 . 1 1 80 80 THR H H 80 7.449 7.449 7.515 -0.066 25447
3333 1 8 . 1 1 81 81 THR N N 81 119.953 119.953 117.818 2.135 25447
3334 1 8 . 1 1 81 81 THR HA H 81 4.665 4.665 4.788 -0.123 25447
3335 1 8 . 1 1 81 81 THR CA C 81 60.412 60.412 59.199 1.213 25447
3336 1 8 . 1 1 81 81 THR CB C 81 70.113 70.113 70.797 -0.685 25447
3337 1 8 . 1 1 81 81 THR H H 81 7.685 7.685 7.840 -0.155 25447
3338 1 8 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.713 -0.024 25447
3339 1 8 . 1 1 82 82 PRO CA C 82 61.688 61.688 62.022 -0.334 25447
3340 1 8 . 1 1 82 82 PRO CB C 82 30.969 30.969 30.538 0.430 25447
3341 1 8 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.537 -0.056 25447
3342 1 8 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.402 0.529 25447
3343 1 8 . 1 1 83 83 PRO CB C 83 32.193 32.193 32.679 -0.486 25447
3344 1 8 . 1 1 84 84 VAL N N 84 120.691 120.691 121.551 -0.860 25447
3345 1 8 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.139 -0.046 25447
3346 1 8 . 1 1 84 84 VAL CA C 84 62.339 62.339 61.719 0.620 25447
3347 1 8 . 1 1 84 84 VAL CB C 84 32.851 32.851 32.793 0.058 25447
3348 1 8 . 1 1 84 84 VAL H H 84 8.257 8.257 8.014 0.243 25447
3349 1 8 . 1 1 85 85 GLU N N 85 127.655 127.655 125.117 2.538 25447
3350 1 8 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.845 0.439 25447
3351 1 8 . 1 1 85 85 GLU CA C 85 56.754 56.754 56.193 0.561 25447
3352 1 8 . 1 1 85 85 GLU CB C 85 30.559 30.559 29.727 0.832 25447
3353 1 8 . 1 1 85 85 GLU H H 85 8.202 8.202 8.650 -0.448 25447
3354 1 8 . 1 1 86 86 ALA N N 86 126.437 126.437 123.241 3.196 25447
3355 1 8 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.128 -0.077 25447
3356 1 8 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.629 -0.481 25447
3357 1 8 . 1 1 86 86 ALA CB C 86 19.460 19.460 19.707 -0.247 25447
3358 1 8 . 1 1 86 86 ALA H H 86 8.323 8.323 8.360 -0.037 25447
3359 1 8 . 1 1 87 87 LYS N N 87 121.796 121.796 120.953 0.843 25447
3360 1 8 . 1 1 87 87 LYS HA H 87 4.347 4.347 4.032 0.315 25447
3361 1 8 . 1 1 87 87 LYS CA C 87 56.297 56.297 57.961 -1.664 25447
3362 1 8 . 1 1 87 87 LYS CB C 87 33.276 33.276 32.538 0.738 25447
3363 1 8 . 1 1 87 87 LYS H H 87 8.333 8.333 8.456 -0.123 25447
3364 1 8 . 1 1 88 88 LEU N N 88 125.576 125.576 120.438 5.138 25447
3365 1 8 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.388 -0.481 25447
3366 1 8 . 1 1 88 88 LEU CA C 88 55.772 55.772 54.538 1.234 25447
3367 1 8 . 1 1 88 88 LEU CB C 88 42.472 42.472 42.377 0.095 25447
3368 1 8 . 1 1 88 88 LEU H H 88 8.444 8.444 7.502 0.942 25447
3369 1 9 . 1 1 1 1 MET N N 1 120.668 120.668 115.052 5.616 25447
3370 1 9 . 1 1 1 1 MET HA H 1 4.484 4.484 4.406 0.078 25447
3371 1 9 . 1 1 1 1 MET CA C 1 55.257 55.257 55.651 -0.394 25447
3372 1 9 . 1 1 1 1 MET CB C 1 34.517 34.517 32.450 2.067 25447
3373 1 9 . 1 1 1 1 MET H H 1 8.313 8.313 7.748 0.565 25447
3374 1 9 . 1 1 2 2 GLN N N 2 123.739 123.739 114.958 8.781 25447
3375 1 9 . 1 1 2 2 GLN HA H 2 4.030 4.030 3.969 0.061 25447
3376 1 9 . 1 1 2 2 GLN CA C 2 57.874 57.874 56.739 1.135 25447
3377 1 9 . 1 1 2 2 GLN CB C 2 29.938 29.938 26.197 3.741 25447
3378 1 9 . 1 1 2 2 GLN H H 2 9.455 9.455 7.928 1.527 25447
3379 1 9 . 1 1 3 3 HIS N N 3 119.115 119.115 114.982 4.133 25447
3380 1 9 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.184 0.932 25447
3381 1 9 . 1 1 3 3 HIS CA C 3 55.494 55.494 56.770 -1.276 25447
3382 1 9 . 1 1 3 3 HIS CB C 3 31.015 31.015 27.846 3.169 25447
3383 1 9 . 1 1 3 3 HIS H H 3 9.783 9.783 8.617 1.166 25447
3384 1 9 . 1 1 4 4 ALA N N 4 122.648 122.648 122.818 -0.170 25447
3385 1 9 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.087 -0.184 25447
3386 1 9 . 1 1 4 4 ALA CA C 4 56.479 56.479 54.821 1.658 25447
3387 1 9 . 1 1 4 4 ALA CB C 4 19.194 19.194 18.796 0.399 25447
3388 1 9 . 1 1 4 4 ALA H H 4 7.551 7.551 8.680 -1.129 25447
3389 1 9 . 1 1 5 5 SER N N 5 112.599 112.599 114.295 -1.696 25447
3390 1 9 . 1 1 5 5 SER HA H 5 4.298 4.298 4.316 -0.018 25447
3391 1 9 . 1 1 5 5 SER CA C 5 62.117 62.117 61.510 0.607 25447
3392 1 9 . 1 1 5 5 SER CB C 5 62.334 62.334 62.700 -0.366 25447
3393 1 9 . 1 1 5 5 SER H H 5 8.736 8.736 8.347 0.389 25447
3394 1 9 . 1 1 6 6 VAL N N 6 122.866 122.866 121.592 1.274 25447
3395 1 9 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.790 0.315 25447
3396 1 9 . 1 1 6 6 VAL CA C 6 65.732 65.732 66.185 -0.453 25447
3397 1 9 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.762 0.976 25447
3398 1 9 . 1 1 6 6 VAL H H 6 7.660 7.660 7.399 0.261 25447
3399 1 9 . 1 1 7 7 ILE N N 7 121.715 121.715 119.694 2.021 25447
3400 1 9 . 1 1 7 7 ILE HA H 7 4.224 4.224 4.189 0.035 25447
3401 1 9 . 1 1 7 7 ILE CA C 7 65.329 65.329 65.591 -0.262 25447
3402 1 9 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.664 1.029 25447
3403 1 9 . 1 1 7 7 ILE H H 7 8.519 8.519 7.482 1.037 25447
3404 1 9 . 1 1 8 8 ALA N N 8 121.373 121.373 121.332 0.041 25447
3405 1 9 . 1 1 8 8 ALA HA H 8 3.895 3.895 4.028 -0.133 25447
3406 1 9 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.304 0.953 25447
3407 1 9 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.046 0.594 25447
3408 1 9 . 1 1 8 8 ALA H H 8 8.940 8.940 7.912 1.028 25447
3409 1 9 . 1 1 9 9 GLN N N 9 115.076 115.076 119.290 -4.214 25447
3410 1 9 . 1 1 9 9 GLN HA H 9 3.870 3.870 3.939 -0.069 25447
3411 1 9 . 1 1 9 9 GLN CA C 9 59.192 59.192 58.998 0.194 25447
3412 1 9 . 1 1 9 9 GLN CB C 9 28.138 28.138 28.633 -0.495 25447
3413 1 9 . 1 1 9 9 GLN H H 9 7.729 7.729 8.312 -0.583 25447
3414 1 9 . 1 1 10 10 PHE N N 10 120.207 120.207 118.865 1.342 25447
3415 1 9 . 1 1 10 10 PHE HA H 10 4.085 4.085 3.797 0.288 25447
3416 1 9 . 1 1 10 10 PHE CA C 10 60.893 60.893 61.686 -0.793 25447
3417 1 9 . 1 1 10 10 PHE CB C 10 38.932 38.932 37.990 0.942 25447
3418 1 9 . 1 1 10 10 PHE H H 10 7.301 7.301 8.040 -0.739 25447
3419 1 9 . 1 1 11 11 VAL N N 11 117.569 117.569 117.306 0.263 25447
3420 1 9 . 1 1 11 11 VAL HA H 11 3.307 3.307 3.952 -0.645 25447
3421 1 9 . 1 1 11 11 VAL CA C 11 66.508 66.508 65.835 0.673 25447
3422 1 9 . 1 1 11 11 VAL CB C 11 31.487 31.487 31.482 0.005 25447
3423 1 9 . 1 1 11 11 VAL H H 11 8.370 8.370 7.787 0.583 25447
3424 1 9 . 1 1 12 12 VAL N N 12 117.909 117.909 121.250 -3.341 25447
3425 1 9 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.646 0.095 25447
3426 1 9 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.992 -1.116 25447
3427 1 9 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.386 -0.074 25447
3428 1 9 . 1 1 12 12 VAL H H 12 8.294 8.294 8.155 0.139 25447
3429 1 9 . 1 1 13 13 GLU N N 13 117.918 117.918 118.327 -0.409 25447
3430 1 9 . 1 1 13 13 GLU HA H 13 3.742 3.742 3.943 -0.201 25447
3431 1 9 . 1 1 13 13 GLU CA C 13 59.307 59.307 58.479 0.828 25447
3432 1 9 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.249 0.240 25447
3433 1 9 . 1 1 13 13 GLU H H 13 7.750 7.750 8.363 -0.613 25447
3434 1 9 . 1 1 14 14 GLU N N 14 113.478 113.478 118.072 -4.594 25447
3435 1 9 . 1 1 14 14 GLU HA H 14 3.778 3.778 3.856 -0.078 25447
3436 1 9 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.568 -1.768 25447
3437 1 9 . 1 1 14 14 GLU CB C 14 29.643 29.643 29.827 -0.184 25447
3438 1 9 . 1 1 14 14 GLU H H 14 7.603 7.603 7.939 -0.336 25447
3439 1 9 . 1 1 15 15 PHE N N 15 114.193 114.193 113.694 0.499 25447
3440 1 9 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.625 0.314 25447
3441 1 9 . 1 1 15 15 PHE CA C 15 58.095 58.095 58.865 -0.770 25447
3442 1 9 . 1 1 15 15 PHE CB C 15 42.095 42.095 41.876 0.219 25447
3443 1 9 . 1 1 15 15 PHE H H 15 7.908 7.908 7.502 0.406 25447
3444 1 9 . 1 1 16 16 LEU N N 16 121.492 121.492 121.237 0.255 25447
3445 1 9 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.882 0.085 25447
3446 1 9 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.379 -0.002 25447
3447 1 9 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.656 1.077 25447
3448 1 9 . 1 1 16 16 LEU H H 16 8.015 8.015 8.166 -0.151 25447
3449 1 9 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.401 -0.018 25447
3450 1 9 . 1 1 17 17 PRO CA C 17 64.858 64.858 64.127 0.731 25447
3451 1 9 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.867 -0.038 25447
3452 1 9 . 1 1 18 18 ASP N N 18 116.508 116.508 118.238 -1.730 25447
3453 1 9 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.750 -0.182 25447
3454 1 9 . 1 1 18 18 ASP CA C 18 54.688 54.688 53.904 0.784 25447
3455 1 9 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.518 0.108 25447
3456 1 9 . 1 1 18 18 ASP H H 18 8.399 8.399 8.601 -0.202 25447
3457 1 9 . 1 1 19 19 VAL N N 19 122.135 122.135 120.841 1.294 25447
3458 1 9 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.152 -0.034 25447
3459 1 9 . 1 1 19 19 VAL CA C 19 61.293 61.293 60.900 0.393 25447
3460 1 9 . 1 1 19 19 VAL CB C 19 33.582 33.582 33.810 -0.228 25447
3461 1 9 . 1 1 19 19 VAL H H 19 7.760 7.760 7.279 0.481 25447
3462 1 9 . 1 1 20 20 ALA N N 20 129.301 129.301 130.696 -1.395 25447
3463 1 9 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.519 0.080 25447
3464 1 9 . 1 1 20 20 ALA CA C 20 50.270 50.270 50.143 0.127 25447
3465 1 9 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.275 -0.847 25447
3466 1 9 . 1 1 20 20 ALA H H 20 8.761 8.761 8.343 0.418 25447
3467 1 9 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.160 -0.083 25447
3468 1 9 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.372 0.831 25447
3469 1 9 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.779 -0.371 25447
3470 1 9 . 1 1 22 22 ALA N N 22 116.106 116.106 117.990 -1.884 25447
3471 1 9 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.130 -0.013 25447
3472 1 9 . 1 1 22 22 ALA CA C 22 53.996 53.996 54.145 -0.149 25447
3473 1 9 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.222 0.622 25447
3474 1 9 . 1 1 22 22 ALA H H 22 8.064 8.064 7.891 0.173 25447
3475 1 9 . 1 1 23 23 ASP N N 23 115.541 115.541 117.322 -1.781 25447
3476 1 9 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.659 0.018 25447
3477 1 9 . 1 1 23 23 ASP CA C 23 54.336 54.336 53.858 0.478 25447
3478 1 9 . 1 1 23 23 ASP CB C 23 41.353 41.353 40.930 0.423 25447
3479 1 9 . 1 1 23 23 ASP H H 23 8.003 8.003 8.164 -0.161 25447
3480 1 9 . 1 1 24 24 VAL N N 24 121.517 121.517 121.018 0.499 25447
3481 1 9 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.205 -0.384 25447
3482 1 9 . 1 1 24 24 VAL CA C 24 62.345 62.345 60.657 1.688 25447
3483 1 9 . 1 1 24 24 VAL CB C 24 31.733 31.733 32.923 -1.190 25447
3484 1 9 . 1 1 24 24 VAL H H 24 7.069 7.069 7.504 -0.435 25447
3485 1 9 . 1 1 25 25 ASP N N 25 129.329 129.329 127.018 2.311 25447
3486 1 9 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.809 -0.235 25447
3487 1 9 . 1 1 25 25 ASP CA C 25 54.566 54.566 53.287 1.279 25447
3488 1 9 . 1 1 25 25 ASP CB C 25 42.333 42.333 41.782 0.551 25447
3489 1 9 . 1 1 25 25 ASP H H 25 8.474 8.474 8.683 -0.209 25447
3490 1 9 . 1 1 26 26 VAL N N 26 121.920 121.920 121.356 0.564 25447
3491 1 9 . 1 1 26 26 VAL HA H 26 4.108 4.108 4.018 0.090 25447
3492 1 9 . 1 1 26 26 VAL CA C 26 64.518 64.518 63.114 1.403 25447
3493 1 9 . 1 1 26 26 VAL CB C 26 31.198 31.198 31.828 -0.630 25447
3494 1 9 . 1 1 26 26 VAL H H 26 8.591 8.591 8.620 -0.029 25447
3495 1 9 . 1 1 27 27 ASP N N 27 116.286 116.286 117.980 -1.694 25447
3496 1 9 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.681 0.464 25447
3497 1 9 . 1 1 27 27 ASP CA C 27 54.181 54.181 54.956 -0.775 25447
3498 1 9 . 1 1 27 27 ASP CB C 27 42.575 42.575 40.577 1.998 25447
3499 1 9 . 1 1 27 27 ASP H H 27 8.609 8.609 8.114 0.495 25447
3500 1 9 . 1 1 28 28 LEU N N 28 125.116 125.116 122.303 2.813 25447
3501 1 9 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.524 -0.513 25447
3502 1 9 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.235 1.852 25447
3503 1 9 . 1 1 28 28 LEU CB C 28 43.321 43.321 44.185 -0.864 25447
3504 1 9 . 1 1 28 28 LEU H H 28 7.374 7.374 7.349 0.025 25447
3505 1 9 . 1 1 29 29 ASP N N 29 125.924 125.924 124.890 1.034 25447
3506 1 9 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.689 0.145 25447
3507 1 9 . 1 1 29 29 ASP CA C 29 53.920 53.920 54.808 -0.888 25447
3508 1 9 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.157 0.222 25447
3509 1 9 . 1 1 29 29 ASP H H 29 8.699 8.699 8.548 0.151 25447
3510 1 9 . 1 1 30 30 LEU N N 30 129.975 129.975 124.706 5.269 25447
3511 1 9 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.131 -0.214 25447
3512 1 9 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.289 -0.901 25447
3513 1 9 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.456 -0.217 25447
3514 1 9 . 1 1 30 30 LEU H H 30 9.718 9.718 8.126 1.592 25447
3515 1 9 . 1 1 31 31 VAL N N 31 121.212 121.212 117.211 4.001 25447
3516 1 9 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.630 0.563 25447
3517 1 9 . 1 1 31 31 VAL CA C 31 64.433 64.433 66.500 -2.067 25447
3518 1 9 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.202 0.973 25447
3519 1 9 . 1 1 31 31 VAL H H 31 8.163 8.163 7.681 0.482 25447
3520 1 9 . 1 1 32 32 ASP N N 32 124.893 124.893 118.808 6.085 25447
3521 1 9 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.342 0.016 25447
3522 1 9 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.677 0.548 25447
3523 1 9 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.663 0.072 25447
3524 1 9 . 1 1 32 32 ASP H H 32 9.385 9.385 8.709 0.676 25447
3525 1 9 . 1 1 33 33 ASN N N 33 111.484 111.484 116.674 -5.190 25447
3526 1 9 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.562 0.158 25447
3527 1 9 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.602 0.284 25447
3528 1 9 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.004 0.002 25447
3529 1 9 . 1 1 33 33 ASN H H 33 7.396 7.396 7.628 -0.232 25447
3530 1 9 . 1 1 34 34 GLY N N 34 106.957 106.957 106.230 0.727 25447
3531 1 9 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.712 0.895 25447
3532 1 9 . 1 1 34 34 GLY H H 34 7.618 7.618 7.866 -0.248 25447
3533 1 9 . 1 1 35 35 VAL N N 35 120.424 120.424 118.330 2.094 25447
3534 1 9 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.338 0.428 25447
3535 1 9 . 1 1 35 35 VAL CA C 35 65.125 65.125 64.722 0.403 25447
3536 1 9 . 1 1 35 35 VAL CB C 35 31.879 31.879 31.802 0.077 25447
3537 1 9 . 1 1 35 35 VAL H H 35 7.792 7.792 7.908 -0.116 25447
3538 1 9 . 1 1 36 36 ILE N N 36 116.364 116.364 118.766 -2.402 25447
3539 1 9 . 1 1 36 36 ILE HA H 36 3.737 3.737 3.912 -0.175 25447
3540 1 9 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.601 -0.916 25447
3541 1 9 . 1 1 36 36 ILE CB C 36 38.807 38.807 38.163 0.643 25447
3542 1 9 . 1 1 36 36 ILE H H 36 7.331 7.331 7.750 -0.419 25447
3543 1 9 . 1 1 37 37 ASP N N 37 127.306 127.306 126.269 1.037 25447
3544 1 9 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.662 0.002 25447
3545 1 9 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.446 -0.830 25447
3546 1 9 . 1 1 37 37 ASP CB C 37 41.209 41.209 43.778 -2.569 25447
3547 1 9 . 1 1 37 37 ASP H H 37 7.874 7.874 8.060 -0.186 25447
3548 1 9 . 1 1 38 38 ALA N N 38 120.352 120.352 122.757 -2.405 25447
3549 1 9 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.154 -0.159 25447
3550 1 9 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.200 1.092 25447
3551 1 9 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.543 -0.231 25447
3552 1 9 . 1 1 38 38 ALA H H 38 8.244 8.244 8.335 -0.091 25447
3553 1 9 . 1 1 39 39 LEU N N 39 117.438 117.438 118.364 -0.926 25447
3554 1 9 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.189 0.061 25447
3555 1 9 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.057 0.298 25447
3556 1 9 . 1 1 39 39 LEU CB C 39 41.236 41.236 41.172 0.064 25447
3557 1 9 . 1 1 39 39 LEU H H 39 7.688 7.688 8.440 -0.752 25447
3558 1 9 . 1 1 40 40 GLY N N 40 112.015 112.015 107.969 4.046 25447
3559 1 9 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.277 0.822 25447
3560 1 9 . 1 1 40 40 GLY H H 40 8.732 8.732 8.342 0.390 25447
3561 1 9 . 1 1 41 41 LEU N N 41 122.983 122.983 123.316 -0.333 25447
3562 1 9 . 1 1 41 41 LEU HA H 41 3.851 3.851 3.934 -0.083 25447
3563 1 9 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.534 0.798 25447
3564 1 9 . 1 1 41 41 LEU CB C 41 41.639 41.639 41.929 -0.290 25447
3565 1 9 . 1 1 41 41 LEU H H 41 8.548 8.548 8.132 0.416 25447
3566 1 9 . 1 1 42 42 LEU N N 42 116.076 116.076 120.053 -3.977 25447
3567 1 9 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.892 0.136 25447
3568 1 9 . 1 1 42 42 LEU CA C 42 58.064 58.064 58.532 -0.468 25447
3569 1 9 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.804 -0.864 25447
3570 1 9 . 1 1 42 42 LEU H H 42 7.168 7.168 7.641 -0.473 25447
3571 1 9 . 1 1 43 43 LYS N N 43 119.831 119.831 118.907 0.924 25447
3572 1 9 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.010 0.274 25447
3573 1 9 . 1 1 43 43 LYS CA C 43 59.644 59.644 60.055 -0.411 25447
3574 1 9 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.322 0.205 25447
3575 1 9 . 1 1 43 43 LYS H H 43 7.640 7.640 8.284 -0.644 25447
3576 1 9 . 1 1 44 44 VAL N N 44 121.046 121.046 120.444 0.602 25447
3577 1 9 . 1 1 44 44 VAL HA H 44 3.949 3.949 3.971 -0.022 25447
3578 1 9 . 1 1 44 44 VAL CB C 44 31.643 31.643 32.029 -0.386 25447
3579 1 9 . 1 1 44 44 VAL H H 44 8.269 8.269 7.756 0.513 25447
3580 1 9 . 1 1 45 45 ILE N N 45 119.333 119.333 119.560 -0.227 25447
3581 1 9 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.657 -0.253 25447
3582 1 9 . 1 1 45 45 ILE CA C 45 66.148 66.148 64.063 2.085 25447
3583 1 9 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.290 0.987 25447
3584 1 9 . 1 1 45 45 ILE H H 45 8.145 8.145 7.776 0.369 25447
3585 1 9 . 1 1 46 46 ALA N N 46 121.213 121.213 123.596 -2.383 25447
3586 1 9 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.017 0.240 25447
3587 1 9 . 1 1 46 46 ALA CA C 46 55.164 55.164 55.395 -0.231 25447
3588 1 9 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.529 -0.161 25447
3589 1 9 . 1 1 46 46 ALA H H 46 7.792 7.792 8.162 -0.370 25447
3590 1 9 . 1 1 47 47 TRP N N 47 121.416 121.416 120.334 1.082 25447
3591 1 9 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.382 -0.148 25447
3592 1 9 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.918 1.752 25447
3593 1 9 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.270 -1.031 25447
3594 1 9 . 1 1 47 47 TRP H H 47 8.093 8.093 7.915 0.178 25447
3595 1 9 . 1 1 48 48 LEU N N 48 118.963 118.963 120.957 -1.994 25447
3596 1 9 . 1 1 48 48 LEU HA H 48 3.586 3.586 2.744 0.842 25447
3597 1 9 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.790 0.405 25447
3598 1 9 . 1 1 48 48 LEU CB C 48 42.251 42.251 41.229 1.022 25447
3599 1 9 . 1 1 48 48 LEU H H 48 8.693 8.693 7.416 1.277 25447
3600 1 9 . 1 1 49 49 GLU N N 49 119.131 119.131 117.626 1.505 25447
3601 1 9 . 1 1 49 49 GLU HA H 49 4.050 4.050 3.988 0.062 25447
3602 1 9 . 1 1 49 49 GLU CA C 49 59.862 59.862 58.926 0.936 25447
3603 1 9 . 1 1 49 49 GLU CB C 49 29.586 29.586 28.730 0.856 25447
3604 1 9 . 1 1 49 49 GLU H H 49 7.771 7.771 7.795 -0.024 25447
3605 1 9 . 1 1 50 50 ASP N N 50 119.941 119.941 120.324 -0.383 25447
3606 1 9 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.398 -0.161 25447
3607 1 9 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.773 0.582 25447
3608 1 9 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.950 1.433 25447
3609 1 9 . 1 1 50 50 ASP H H 50 7.697 7.697 7.620 0.077 25447
3610 1 9 . 1 1 51 51 ARG N N 51 116.911 116.911 117.594 -0.683 25447
3611 1 9 . 1 1 51 51 ARG HA H 51 3.736 3.736 4.007 -0.271 25447
3612 1 9 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.380 -2.016 25447
3613 1 9 . 1 1 51 51 ARG CB C 51 29.315 29.315 30.276 -0.961 25447
3614 1 9 . 1 1 51 51 ARG H H 51 8.881 8.881 7.802 1.079 25447
3615 1 9 . 1 1 52 52 PHE N N 52 112.328 112.328 116.351 -4.023 25447
3616 1 9 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.638 0.037 25447
3617 1 9 . 1 1 52 52 PHE CA C 52 57.413 57.413 58.021 -0.608 25447
3618 1 9 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.395 1.496 25447
3619 1 9 . 1 1 52 52 PHE H H 52 7.284 7.284 7.502 -0.218 25447
3620 1 9 . 1 1 53 53 GLY N N 53 109.826 109.826 108.849 0.977 25447
3621 1 9 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.603 1.198 25447
3622 1 9 . 1 1 53 53 GLY H H 53 7.427 7.427 8.115 -0.688 25447
3623 1 9 . 1 1 54 54 ILE N N 54 119.127 119.127 115.271 3.856 25447
3624 1 9 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.520 -0.569 25447
3625 1 9 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.294 1.391 25447
3626 1 9 . 1 1 54 54 ILE CB C 54 39.490 39.490 39.464 0.026 25447
3627 1 9 . 1 1 54 54 ILE H H 54 6.876 6.876 7.474 -0.598 25447
3628 1 9 . 1 1 55 55 ALA N N 55 129.823 129.823 125.298 4.525 25447
3629 1 9 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.514 -0.100 25447
3630 1 9 . 1 1 55 55 ALA CA C 55 51.610 51.610 50.962 0.648 25447
3631 1 9 . 1 1 55 55 ALA CB C 55 19.262 19.262 19.371 -0.109 25447
3632 1 9 . 1 1 55 55 ALA H H 55 8.499 8.499 8.569 -0.070 25447
3633 1 9 . 1 1 56 56 ALA N N 56 126.300 126.300 126.645 -0.345 25447
3634 1 9 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.089 0.180 25447
3635 1 9 . 1 1 56 56 ALA CA C 56 53.474 53.474 54.679 -1.205 25447
3636 1 9 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.786 0.458 25447
3637 1 9 . 1 1 56 56 ALA H H 56 8.641 8.641 8.785 -0.144 25447
3638 1 9 . 1 1 57 57 ASP N N 57 116.395 116.395 117.184 -0.789 25447
3639 1 9 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.363 0.116 25447
3640 1 9 . 1 1 57 57 ASP CA C 57 55.226 55.226 56.332 -1.106 25447
3641 1 9 . 1 1 57 57 ASP CB C 57 40.922 40.922 40.123 0.798 25447
3642 1 9 . 1 1 57 57 ASP H H 57 8.337 8.337 8.477 -0.140 25447
3643 1 9 . 1 1 58 58 ASP N N 58 118.557 118.557 118.674 -0.117 25447
3644 1 9 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.443 0.193 25447
3645 1 9 . 1 1 58 58 ASP CA C 58 55.144 55.144 55.896 -0.752 25447
3646 1 9 . 1 1 58 58 ASP CB C 58 41.504 41.504 41.311 0.193 25447
3647 1 9 . 1 1 58 58 ASP H H 58 8.027 8.027 7.962 0.065 25447
3648 1 9 . 1 1 59 59 VAL N N 59 118.898 118.898 118.582 0.316 25447
3649 1 9 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.196 -0.020 25447
3650 1 9 . 1 1 59 59 VAL CA C 59 62.300 62.300 61.468 0.833 25447
3651 1 9 . 1 1 59 59 VAL CB C 59 33.078 33.078 34.963 -1.885 25447
3652 1 9 . 1 1 59 59 VAL H H 59 7.716 7.716 7.488 0.228 25447
3653 1 9 . 1 1 60 60 GLU N N 60 122.888 122.888 126.282 -3.394 25447
3654 1 9 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.406 -0.122 25447
3655 1 9 . 1 1 60 60 GLU CA C 60 56.546 56.546 55.965 0.581 25447
3656 1 9 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.577 -0.795 25447
3657 1 9 . 1 1 60 60 GLU H H 60 8.367 8.367 8.414 -0.047 25447
3658 1 9 . 1 1 61 61 LEU N N 61 124.827 124.827 125.802 -0.975 25447
3659 1 9 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.542 -0.184 25447
3660 1 9 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.141 0.675 25447
3661 1 9 . 1 1 61 61 LEU CB C 61 41.937 41.937 43.099 -1.162 25447
3662 1 9 . 1 1 61 61 LEU H H 61 8.198 8.198 8.488 -0.290 25447
3663 1 9 . 1 1 62 62 SER N N 62 118.715 118.715 118.316 0.399 25447
3664 1 9 . 1 1 62 62 SER HA H 62 4.809 4.809 4.961 -0.152 25447
3665 1 9 . 1 1 62 62 SER CA C 62 55.732 55.732 55.476 0.256 25447
3666 1 9 . 1 1 62 62 SER CB C 62 64.017 64.017 64.830 -0.813 25447
3667 1 9 . 1 1 62 62 SER H H 62 8.137 8.137 8.117 0.020 25447
3668 1 9 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.197 0.056 25447
3669 1 9 . 1 1 63 63 PRO CA C 63 64.896 64.896 64.864 0.032 25447
3670 1 9 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.723 0.329 25447
3671 1 9 . 1 1 64 64 GLU N N 64 116.554 116.554 118.847 -2.293 25447
3672 1 9 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.119 -0.246 25447
3673 1 9 . 1 1 64 64 GLU CA C 64 58.719 58.719 59.043 -0.324 25447
3674 1 9 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.199 -0.518 25447
3675 1 9 . 1 1 64 64 GLU H H 64 8.316 8.316 8.496 -0.180 25447
3676 1 9 . 1 1 65 65 HIS N N 65 115.487 115.487 119.478 -3.991 25447
3677 1 9 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.282 -0.002 25447
3678 1 9 . 1 1 65 65 HIS CA C 65 57.652 57.652 58.252 -0.600 25447
3679 1 9 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.576 0.306 25447
3680 1 9 . 1 1 65 65 HIS H H 65 7.274 7.274 8.238 -0.964 25447
3681 1 9 . 1 1 66 66 PHE N N 66 116.127 116.127 116.477 -0.350 25447
3682 1 9 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.457 0.309 25447
3683 1 9 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.495 -1.713 25447
3684 1 9 . 1 1 66 66 PHE CB C 66 38.908 38.908 37.433 1.475 25447
3685 1 9 . 1 1 66 66 PHE H H 66 7.239 7.239 7.792 -0.553 25447
3686 1 9 . 1 1 67 67 ARG N N 67 112.468 112.468 120.058 -7.590 25447
3687 1 9 . 1 1 67 67 ARG HA H 67 4.085 4.085 3.950 0.135 25447
3688 1 9 . 1 1 67 67 ARG CA C 67 58.287 58.287 59.277 -0.990 25447
3689 1 9 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.284 1.476 25447
3690 1 9 . 1 1 67 67 ARG H H 67 6.628 6.628 7.948 -1.320 25447
3691 1 9 . 1 1 68 68 SER N N 68 109.305 109.305 109.725 -0.420 25447
3692 1 9 . 1 1 68 68 SER HA H 68 4.980 4.980 4.778 0.202 25447
3693 1 9 . 1 1 68 68 SER CA C 68 55.785 55.785 56.519 -0.734 25447
3694 1 9 . 1 1 68 68 SER CB C 68 67.691 67.691 67.012 0.679 25447
3695 1 9 . 1 1 68 68 SER H H 68 8.145 8.145 7.378 0.767 25447
3696 1 9 . 1 1 69 69 ILE N N 69 122.602 122.602 122.774 -0.172 25447
3697 1 9 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.817 -0.141 25447
3698 1 9 . 1 1 69 69 ILE CA C 69 66.754 66.754 63.914 2.840 25447
3699 1 9 . 1 1 69 69 ILE CB C 69 37.296 37.296 36.859 0.437 25447
3700 1 9 . 1 1 69 69 ILE H H 69 9.775 9.775 9.244 0.531 25447
3701 1 9 . 1 1 70 70 ARG N N 70 118.764 118.764 118.199 0.565 25447
3702 1 9 . 1 1 70 70 ARG HA H 70 3.955 3.955 3.999 -0.044 25447
3703 1 9 . 1 1 70 70 ARG CA C 70 60.533 60.533 59.255 1.278 25447
3704 1 9 . 1 1 70 70 ARG CB C 70 30.418 30.418 28.906 1.512 25447
3705 1 9 . 1 1 70 70 ARG H H 70 8.910 8.910 8.302 0.608 25447
3706 1 9 . 1 1 71 71 SER N N 71 117.670 117.670 115.642 2.028 25447
3707 1 9 . 1 1 71 71 SER HA H 71 4.330 4.330 4.250 0.080 25447
3708 1 9 . 1 1 71 71 SER CA C 71 62.287 62.287 61.750 0.537 25447
3709 1 9 . 1 1 71 71 SER CB C 71 63.278 63.278 63.142 0.136 25447
3710 1 9 . 1 1 71 71 SER H H 71 8.518 8.518 7.422 1.096 25447
3711 1 9 . 1 1 72 72 ILE N N 72 127.447 127.447 123.163 4.284 25447
3712 1 9 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.739 0.171 25447
3713 1 9 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.230 1.581 25447
3714 1 9 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.763 0.635 25447
3715 1 9 . 1 1 72 72 ILE H H 72 8.762 8.762 7.635 1.127 25447
3716 1 9 . 1 1 73 73 ASP N N 73 121.636 121.636 120.061 1.575 25447
3717 1 9 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.309 -0.296 25447
3718 1 9 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.267 1.881 25447
3719 1 9 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.713 2.827 25447
3720 1 9 . 1 1 73 73 ASP H H 73 8.677 8.677 8.013 0.664 25447
3721 1 9 . 1 1 74 74 ALA N N 74 118.793 118.793 121.752 -2.959 25447
3722 1 9 . 1 1 74 74 ALA HA H 74 4.044 4.044 3.997 0.047 25447
3723 1 9 . 1 1 74 74 ALA CA C 74 55.321 55.321 55.150 0.171 25447
3724 1 9 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.491 -0.546 25447
3725 1 9 . 1 1 74 74 ALA H H 74 8.005 8.005 8.031 -0.026 25447
3726 1 9 . 1 1 75 75 PHE N N 75 121.235 121.235 120.080 1.155 25447
3727 1 9 . 1 1 75 75 PHE HA H 75 4.038 4.038 4.020 0.018 25447
3728 1 9 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.838 -0.823 25447
3729 1 9 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.334 -0.497 25447
3730 1 9 . 1 1 75 75 PHE H H 75 8.353 8.353 8.363 -0.010 25447
3731 1 9 . 1 1 76 76 VAL N N 76 120.866 120.866 118.702 2.164 25447
3732 1 9 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.388 -0.445 25447
3733 1 9 . 1 1 76 76 VAL CA C 76 66.901 66.901 67.057 -0.156 25447
3734 1 9 . 1 1 76 76 VAL CB C 76 31.247 31.247 31.229 0.018 25447
3735 1 9 . 1 1 76 76 VAL H H 76 8.544 8.544 7.861 0.683 25447
3736 1 9 . 1 1 77 77 VAL N N 77 121.408 121.408 119.584 1.824 25447
3737 1 9 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.772 -0.277 25447
3738 1 9 . 1 1 77 77 VAL CA C 77 66.833 66.833 64.645 2.188 25447
3739 1 9 . 1 1 77 77 VAL CB C 77 31.930 31.930 30.760 1.170 25447
3740 1 9 . 1 1 77 77 VAL H H 77 8.708 8.708 8.055 0.653 25447
3741 1 9 . 1 1 78 78 GLY N N 78 106.402 106.402 107.456 -1.054 25447
3742 1 9 . 1 1 78 78 GLY CA C 78 46.840 46.840 47.136 -0.296 25447
3743 1 9 . 1 1 78 78 GLY H H 78 7.945 7.945 8.561 -0.616 25447
3744 1 9 . 1 1 79 79 ALA N N 79 121.146 121.146 122.584 -1.438 25447
3745 1 9 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.963 0.244 25447
3746 1 9 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.386 -1.457 25447
3747 1 9 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.393 0.868 25447
3748 1 9 . 1 1 79 79 ALA H H 79 7.639 7.639 7.433 0.206 25447
3749 1 9 . 1 1 80 80 THR N N 80 107.668 107.668 110.566 -2.898 25447
3750 1 9 . 1 1 80 80 THR HA H 80 4.443 4.443 4.259 0.184 25447
3751 1 9 . 1 1 80 80 THR CA C 80 61.406 61.406 63.351 -1.945 25447
3752 1 9 . 1 1 80 80 THR CB C 80 70.767 70.767 69.604 1.163 25447
3753 1 9 . 1 1 80 80 THR H H 80 7.449 7.449 7.629 -0.180 25447
3754 1 9 . 1 1 81 81 THR N N 81 119.953 119.953 116.332 3.621 25447
3755 1 9 . 1 1 81 81 THR HA H 81 4.665 4.665 4.812 -0.147 25447
3756 1 9 . 1 1 81 81 THR CA C 81 60.412 60.412 59.270 1.142 25447
3757 1 9 . 1 1 81 81 THR CB C 81 70.113 70.113 69.355 0.758 25447
3758 1 9 . 1 1 81 81 THR H H 81 7.685 7.685 7.984 -0.299 25447
3759 1 9 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.355 0.334 25447
3760 1 9 . 1 1 82 82 PRO CA C 82 61.688 61.688 62.418 -0.730 25447
3761 1 9 . 1 1 82 82 PRO CB C 82 30.969 30.969 31.140 -0.171 25447
3762 1 9 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.282 0.199 25447
3763 1 9 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.425 0.506 25447
3764 1 9 . 1 1 83 83 PRO CB C 83 32.193 32.193 32.062 0.131 25447
3765 1 9 . 1 1 84 84 VAL N N 84 120.691 120.691 122.811 -2.120 25447
3766 1 9 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.154 -0.061 25447
3767 1 9 . 1 1 84 84 VAL CA C 84 62.339 62.339 60.903 1.436 25447
3768 1 9 . 1 1 84 84 VAL CB C 84 32.851 32.851 33.240 -0.389 25447
3769 1 9 . 1 1 84 84 VAL H H 84 8.257 8.257 8.137 0.120 25447
3770 1 9 . 1 1 85 85 GLU N N 85 127.655 127.655 125.168 2.487 25447
3771 1 9 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.888 0.396 25447
3772 1 9 . 1 1 85 85 GLU CA C 85 56.754 56.754 56.599 0.155 25447
3773 1 9 . 1 1 85 85 GLU CB C 85 30.559 30.559 27.709 2.850 25447
3774 1 9 . 1 1 85 85 GLU H H 85 8.202 8.202 8.723 -0.521 25447
3775 1 9 . 1 1 86 86 ALA N N 86 126.437 126.437 120.609 5.828 25447
3776 1 9 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.098 -0.047 25447
3777 1 9 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.603 -0.455 25447
3778 1 9 . 1 1 86 86 ALA CB C 86 19.460 19.460 19.618 -0.158 25447
3779 1 9 . 1 1 86 86 ALA H H 86 8.323 8.323 7.916 0.407 25447
3780 1 9 . 1 1 87 87 LYS N N 87 121.796 121.796 120.552 1.244 25447
3781 1 9 . 1 1 87 87 LYS HA H 87 4.347 4.347 4.056 0.291 25447
3782 1 9 . 1 1 87 87 LYS CA C 87 56.297 56.297 57.928 -1.631 25447
3783 1 9 . 1 1 87 87 LYS CB C 87 33.276 33.276 32.570 0.706 25447
3784 1 9 . 1 1 87 87 LYS H H 87 8.333 8.333 8.489 -0.156 25447
3785 1 9 . 1 1 88 88 LEU N N 88 125.576 125.576 120.978 4.598 25447
3786 1 9 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.451 -0.544 25447
3787 1 9 . 1 1 88 88 LEU CA C 88 55.772 55.772 54.229 1.543 25447
3788 1 9 . 1 1 88 88 LEU CB C 88 42.472 42.472 42.306 0.166 25447
3789 1 9 . 1 1 88 88 LEU H H 88 8.444 8.444 7.667 0.777 25447
3790 1 10 . 1 1 1 1 MET N N 1 120.668 120.668 114.783 5.885 25447
3791 1 10 . 1 1 1 1 MET HA H 1 4.484 4.484 4.312 0.172 25447
3792 1 10 . 1 1 1 1 MET CA C 1 55.257 55.257 56.096 -0.839 25447
3793 1 10 . 1 1 1 1 MET CB C 1 34.517 34.517 32.124 2.393 25447
3794 1 10 . 1 1 1 1 MET H H 1 8.313 8.313 7.839 0.474 25447
3795 1 10 . 1 1 2 2 GLN N N 2 123.739 123.739 116.133 7.606 25447
3796 1 10 . 1 1 2 2 GLN HA H 2 4.030 4.030 3.809 0.221 25447
3797 1 10 . 1 1 2 2 GLN CA C 2 57.874 57.874 56.226 1.648 25447
3798 1 10 . 1 1 2 2 GLN CB C 2 29.938 29.938 26.430 3.508 25447
3799 1 10 . 1 1 2 2 GLN H H 2 9.455 9.455 7.548 1.907 25447
3800 1 10 . 1 1 3 3 HIS N N 3 119.115 119.115 113.726 5.389 25447
3801 1 10 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.151 0.965 25447
3802 1 10 . 1 1 3 3 HIS CA C 3 55.494 55.494 56.983 -1.489 25447
3803 1 10 . 1 1 3 3 HIS CB C 3 31.015 31.015 27.121 3.894 25447
3804 1 10 . 1 1 3 3 HIS H H 3 9.783 9.783 8.276 1.507 25447
3805 1 10 . 1 1 4 4 ALA N N 4 122.648 122.648 122.567 0.081 25447
3806 1 10 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.187 -0.284 25447
3807 1 10 . 1 1 4 4 ALA CA C 4 56.479 56.479 54.950 1.528 25447
3808 1 10 . 1 1 4 4 ALA CB C 4 19.194 19.194 19.131 0.062 25447
3809 1 10 . 1 1 4 4 ALA H H 4 7.551 7.551 8.395 -0.844 25447
3810 1 10 . 1 1 5 5 SER N N 5 112.599 112.599 114.720 -2.121 25447
3811 1 10 . 1 1 5 5 SER HA H 5 4.298 4.298 4.191 0.107 25447
3812 1 10 . 1 1 5 5 SER CA C 5 62.117 62.117 61.811 0.306 25447
3813 1 10 . 1 1 5 5 SER CB C 5 62.334 62.334 62.197 0.137 25447
3814 1 10 . 1 1 5 5 SER H H 5 8.736 8.736 8.412 0.324 25447
3815 1 10 . 1 1 6 6 VAL N N 6 122.866 122.866 122.367 0.499 25447
3816 1 10 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.811 0.294 25447
3817 1 10 . 1 1 6 6 VAL CA C 6 65.732 65.732 66.317 -0.585 25447
3818 1 10 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.280 1.457 25447
3819 1 10 . 1 1 6 6 VAL H H 6 7.660 7.660 7.908 -0.248 25447
3820 1 10 . 1 1 7 7 ILE N N 7 121.715 121.715 120.354 1.361 25447
3821 1 10 . 1 1 7 7 ILE HA H 7 4.224 4.224 3.812 0.412 25447
3822 1 10 . 1 1 7 7 ILE CA C 7 65.329 65.329 65.925 -0.596 25447
3823 1 10 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.552 1.141 25447
3824 1 10 . 1 1 7 7 ILE H H 7 8.519 8.519 7.578 0.941 25447
3825 1 10 . 1 1 8 8 ALA N N 8 121.373 121.373 121.549 -0.176 25447
3826 1 10 . 1 1 8 8 ALA HA H 8 3.895 3.895 3.983 -0.088 25447
3827 1 10 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.362 0.895 25447
3828 1 10 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.154 0.486 25447
3829 1 10 . 1 1 8 8 ALA H H 8 8.940 8.940 7.895 1.045 25447
3830 1 10 . 1 1 9 9 GLN N N 9 115.076 115.076 118.696 -3.620 25447
3831 1 10 . 1 1 9 9 GLN HA H 9 3.870 3.870 4.055 -0.185 25447
3832 1 10 . 1 1 9 9 GLN CA C 9 59.192 59.192 58.699 0.493 25447
3833 1 10 . 1 1 9 9 GLN CB C 9 28.138 28.138 29.029 -0.891 25447
3834 1 10 . 1 1 9 9 GLN H H 9 7.729 7.729 8.257 -0.528 25447
3835 1 10 . 1 1 10 10 PHE N N 10 120.207 120.207 120.908 -0.701 25447
3836 1 10 . 1 1 10 10 PHE HA H 10 4.085 4.085 4.299 -0.214 25447
3837 1 10 . 1 1 10 10 PHE CA C 10 60.893 60.893 60.286 0.607 25447
3838 1 10 . 1 1 10 10 PHE CB C 10 38.932 38.932 38.945 -0.013 25447
3839 1 10 . 1 1 10 10 PHE H H 10 7.301 7.301 8.725 -1.424 25447
3840 1 10 . 1 1 11 11 VAL N N 11 117.569 117.569 120.069 -2.500 25447
3841 1 10 . 1 1 11 11 VAL HA H 11 3.307 3.307 2.452 0.855 25447
3842 1 10 . 1 1 11 11 VAL CA C 11 66.508 66.508 64.973 1.535 25447
3843 1 10 . 1 1 11 11 VAL CB C 11 31.487 31.487 31.536 -0.049 25447
3844 1 10 . 1 1 11 11 VAL H H 11 8.370 8.370 8.158 0.212 25447
3845 1 10 . 1 1 12 12 VAL N N 12 117.909 117.909 119.464 -1.555 25447
3846 1 10 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.568 0.173 25447
3847 1 10 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.830 -0.954 25447
3848 1 10 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.139 0.173 25447
3849 1 10 . 1 1 12 12 VAL H H 12 8.294 8.294 7.682 0.612 25447
3850 1 10 . 1 1 13 13 GLU N N 13 117.918 117.918 119.775 -1.857 25447
3851 1 10 . 1 1 13 13 GLU HA H 13 3.742 3.742 4.002 -0.260 25447
3852 1 10 . 1 1 13 13 GLU CA C 13 59.307 59.307 59.140 0.167 25447
3853 1 10 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.348 0.141 25447
3854 1 10 . 1 1 13 13 GLU H H 13 7.750 7.750 7.710 0.040 25447
3855 1 10 . 1 1 14 14 GLU N N 14 113.478 113.478 118.331 -4.853 25447
3856 1 10 . 1 1 14 14 GLU HA H 14 3.778 3.778 4.020 -0.242 25447
3857 1 10 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.477 -1.677 25447
3858 1 10 . 1 1 14 14 GLU CB C 14 29.643 29.643 29.908 -0.265 25447
3859 1 10 . 1 1 14 14 GLU H H 14 7.603 7.603 7.541 0.062 25447
3860 1 10 . 1 1 15 15 PHE N N 15 114.193 114.193 118.178 -3.985 25447
3861 1 10 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.390 0.549 25447
3862 1 10 . 1 1 15 15 PHE CA C 15 58.095 58.095 60.418 -2.323 25447
3863 1 10 . 1 1 15 15 PHE CB C 15 42.095 42.095 40.756 1.339 25447
3864 1 10 . 1 1 15 15 PHE H H 15 7.908 7.908 7.905 0.003 25447
3865 1 10 . 1 1 16 16 LEU N N 16 121.492 121.492 120.458 1.034 25447
3866 1 10 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.722 0.245 25447
3867 1 10 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.044 0.333 25447
3868 1 10 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.112 1.621 25447
3869 1 10 . 1 1 16 16 LEU H H 16 8.015 8.015 8.425 -0.410 25447
3870 1 10 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.404 -0.021 25447
3871 1 10 . 1 1 17 17 PRO CA C 17 64.858 64.858 64.309 0.549 25447
3872 1 10 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.754 0.075 25447
3873 1 10 . 1 1 18 18 ASP N N 18 116.508 116.508 118.245 -1.737 25447
3874 1 10 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.719 -0.151 25447
3875 1 10 . 1 1 18 18 ASP CA C 18 54.688 54.688 53.995 0.693 25447
3876 1 10 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.699 -0.073 25447
3877 1 10 . 1 1 18 18 ASP H H 18 8.399 8.399 8.545 -0.146 25447
3878 1 10 . 1 1 19 19 VAL N N 19 122.135 122.135 120.092 2.043 25447
3879 1 10 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.138 -0.020 25447
3880 1 10 . 1 1 19 19 VAL CA C 19 61.293 61.293 61.058 0.235 25447
3881 1 10 . 1 1 19 19 VAL CB C 19 33.582 33.582 34.336 -0.754 25447
3882 1 10 . 1 1 19 19 VAL H H 19 7.760 7.760 7.334 0.426 25447
3883 1 10 . 1 1 20 20 ALA N N 20 129.301 129.301 129.911 -0.610 25447
3884 1 10 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.635 -0.036 25447
3885 1 10 . 1 1 20 20 ALA CA C 20 50.270 50.270 49.850 0.420 25447
3886 1 10 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.457 -1.029 25447
3887 1 10 . 1 1 20 20 ALA H H 20 8.761 8.761 8.452 0.309 25447
3888 1 10 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.130 -0.053 25447
3889 1 10 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.609 0.594 25447
3890 1 10 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.798 -0.390 25447
3891 1 10 . 1 1 22 22 ALA N N 22 116.106 116.106 118.296 -2.190 25447
3892 1 10 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.086 0.031 25447
3893 1 10 . 1 1 22 22 ALA CA C 22 53.996 53.996 53.957 0.039 25447
3894 1 10 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.250 0.594 25447
3895 1 10 . 1 1 22 22 ALA H H 22 8.064 8.064 8.262 -0.198 25447
3896 1 10 . 1 1 23 23 ASP N N 23 115.541 115.541 115.814 -0.273 25447
3897 1 10 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.609 0.068 25447
3898 1 10 . 1 1 23 23 ASP CA C 23 54.336 54.336 53.827 0.509 25447
3899 1 10 . 1 1 23 23 ASP CB C 23 41.353 41.353 40.630 0.723 25447
3900 1 10 . 1 1 23 23 ASP H H 23 8.003 8.003 8.056 -0.053 25447
3901 1 10 . 1 1 24 24 VAL N N 24 121.517 121.517 120.981 0.536 25447
3902 1 10 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.163 -0.342 25447
3903 1 10 . 1 1 24 24 VAL CA C 24 62.345 62.345 61.421 0.924 25447
3904 1 10 . 1 1 24 24 VAL CB C 24 31.733 31.733 32.965 -1.232 25447
3905 1 10 . 1 1 24 24 VAL H H 24 7.069 7.069 7.536 -0.467 25447
3906 1 10 . 1 1 25 25 ASP N N 25 129.329 129.329 126.938 2.391 25447
3907 1 10 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.730 -0.156 25447
3908 1 10 . 1 1 25 25 ASP CA C 25 54.566 54.566 53.228 1.338 25447
3909 1 10 . 1 1 25 25 ASP CB C 25 42.333 42.333 42.093 0.240 25447
3910 1 10 . 1 1 25 25 ASP H H 25 8.474 8.474 8.668 -0.194 25447
3911 1 10 . 1 1 26 26 VAL N N 26 121.920 121.920 125.694 -3.774 25447
3912 1 10 . 1 1 26 26 VAL HA H 26 4.108 4.108 3.965 0.143 25447
3913 1 10 . 1 1 26 26 VAL CA C 26 64.518 64.518 62.916 1.602 25447
3914 1 10 . 1 1 26 26 VAL CB C 26 31.198 31.198 32.144 -0.946 25447
3915 1 10 . 1 1 26 26 VAL H H 26 8.591 8.591 8.707 -0.116 25447
3916 1 10 . 1 1 27 27 ASP N N 27 116.286 116.286 118.826 -2.540 25447
3917 1 10 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.758 0.387 25447
3918 1 10 . 1 1 27 27 ASP CA C 27 54.181 54.181 54.279 -0.097 25447
3919 1 10 . 1 1 27 27 ASP CB C 27 42.575 42.575 41.383 1.192 25447
3920 1 10 . 1 1 27 27 ASP H H 27 8.609 8.609 8.106 0.503 25447
3921 1 10 . 1 1 28 28 LEU N N 28 125.116 125.116 122.412 2.704 25447
3922 1 10 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.506 -0.495 25447
3923 1 10 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.234 1.853 25447
3924 1 10 . 1 1 28 28 LEU CB C 28 43.321 43.321 44.132 -0.811 25447
3925 1 10 . 1 1 28 28 LEU H H 28 7.374 7.374 7.370 0.004 25447
3926 1 10 . 1 1 29 29 ASP N N 29 125.924 125.924 124.572 1.352 25447
3927 1 10 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.691 0.143 25447
3928 1 10 . 1 1 29 29 ASP CA C 29 53.920 53.920 54.576 -0.656 25447
3929 1 10 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.358 0.021 25447
3930 1 10 . 1 1 29 29 ASP H H 29 8.699 8.699 8.569 0.130 25447
3931 1 10 . 1 1 30 30 LEU N N 30 129.975 129.975 123.541 6.434 25447
3932 1 10 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.066 -0.149 25447
3933 1 10 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.576 -1.188 25447
3934 1 10 . 1 1 30 30 LEU CB C 30 42.239 42.239 41.834 0.405 25447
3935 1 10 . 1 1 30 30 LEU H H 30 9.718 9.718 8.024 1.694 25447
3936 1 10 . 1 1 31 31 VAL N N 31 121.212 121.212 116.463 4.749 25447
3937 1 10 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.570 0.623 25447
3938 1 10 . 1 1 31 31 VAL CA C 31 64.433 64.433 66.029 -1.597 25447
3939 1 10 . 1 1 31 31 VAL CB C 31 32.175 32.175 30.800 1.375 25447
3940 1 10 . 1 1 31 31 VAL H H 31 8.163 8.163 7.444 0.719 25447
3941 1 10 . 1 1 32 32 ASP N N 32 124.893 124.893 118.886 6.007 25447
3942 1 10 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.372 -0.014 25447
3943 1 10 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.508 0.717 25447
3944 1 10 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.118 0.617 25447
3945 1 10 . 1 1 32 32 ASP H H 32 9.385 9.385 8.498 0.887 25447
3946 1 10 . 1 1 33 33 ASN N N 33 111.484 111.484 116.259 -4.775 25447
3947 1 10 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.597 0.123 25447
3948 1 10 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.760 0.126 25447
3949 1 10 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.188 -0.182 25447
3950 1 10 . 1 1 33 33 ASN H H 33 7.396 7.396 7.449 -0.053 25447
3951 1 10 . 1 1 34 34 GLY N N 34 106.957 106.957 106.037 0.920 25447
3952 1 10 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.669 0.938 25447
3953 1 10 . 1 1 34 34 GLY H H 34 7.618 7.618 8.356 -0.738 25447
3954 1 10 . 1 1 35 35 VAL N N 35 120.424 120.424 118.638 1.786 25447
3955 1 10 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.401 0.365 25447
3956 1 10 . 1 1 35 35 VAL CA C 35 65.125 65.125 64.218 0.907 25447
3957 1 10 . 1 1 35 35 VAL CB C 35 31.879 31.879 31.594 0.285 25447
3958 1 10 . 1 1 35 35 VAL H H 35 7.792 7.792 7.338 0.454 25447
3959 1 10 . 1 1 36 36 ILE N N 36 116.364 116.364 121.290 -4.926 25447
3960 1 10 . 1 1 36 36 ILE HA H 36 3.737 3.737 3.730 0.007 25447
3961 1 10 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.958 -1.273 25447
3962 1 10 . 1 1 36 36 ILE CB C 36 38.807 38.807 36.507 2.300 25447
3963 1 10 . 1 1 36 36 ILE H H 36 7.331 7.331 7.687 -0.356 25447
3964 1 10 . 1 1 37 37 ASP N N 37 127.306 127.306 128.046 -0.740 25447
3965 1 10 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.889 -0.225 25447
3966 1 10 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.672 -1.056 25447
3967 1 10 . 1 1 37 37 ASP CB C 37 41.209 41.209 42.968 -1.759 25447
3968 1 10 . 1 1 37 37 ASP H H 37 7.874 7.874 7.715 0.159 25447
3969 1 10 . 1 1 38 38 ALA N N 38 120.352 120.352 123.483 -3.131 25447
3970 1 10 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.036 -0.041 25447
3971 1 10 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.534 0.758 25447
3972 1 10 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.687 -0.375 25447
3973 1 10 . 1 1 38 38 ALA H H 38 8.244 8.244 8.499 -0.255 25447
3974 1 10 . 1 1 39 39 LEU N N 39 117.438 117.438 119.152 -1.714 25447
3975 1 10 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.251 -0.001 25447
3976 1 10 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.493 -0.138 25447
3977 1 10 . 1 1 39 39 LEU CB C 39 41.236 41.236 40.932 0.304 25447
3978 1 10 . 1 1 39 39 LEU H H 39 7.688 7.688 8.355 -0.667 25447
3979 1 10 . 1 1 40 40 GLY N N 40 112.015 112.015 107.793 4.222 25447
3980 1 10 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.236 0.863 25447
3981 1 10 . 1 1 40 40 GLY H H 40 8.732 8.732 8.144 0.588 25447
3982 1 10 . 1 1 41 41 LEU N N 41 122.983 122.983 122.894 0.089 25447
3983 1 10 . 1 1 41 41 LEU HA H 41 3.851 3.851 3.999 -0.148 25447
3984 1 10 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.495 0.837 25447
3985 1 10 . 1 1 41 41 LEU CB C 41 41.639 41.639 41.941 -0.302 25447
3986 1 10 . 1 1 41 41 LEU H H 41 8.548 8.548 8.598 -0.050 25447
3987 1 10 . 1 1 42 42 LEU N N 42 116.076 116.076 119.954 -3.878 25447
3988 1 10 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.900 0.128 25447
3989 1 10 . 1 1 42 42 LEU CA C 42 58.064 58.064 58.512 -0.448 25447
3990 1 10 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.811 -0.871 25447
3991 1 10 . 1 1 42 42 LEU H H 42 7.168 7.168 7.610 -0.442 25447
3992 1 10 . 1 1 43 43 LYS N N 43 119.831 119.831 118.818 1.013 25447
3993 1 10 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.058 0.226 25447
3994 1 10 . 1 1 43 43 LYS CA C 43 59.644 59.644 59.971 -0.327 25447
3995 1 10 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.343 0.184 25447
3996 1 10 . 1 1 43 43 LYS H H 43 7.640 7.640 8.272 -0.632 25447
3997 1 10 . 1 1 44 44 VAL N N 44 121.046 121.046 120.414 0.632 25447
3998 1 10 . 1 1 44 44 VAL HA H 44 3.949 3.949 4.094 -0.145 25447
3999 1 10 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.721 -0.078 25447
4000 1 10 . 1 1 44 44 VAL H H 44 8.269 8.269 7.877 0.392 25447
4001 1 10 . 1 1 45 45 ILE N N 45 119.333 119.333 119.849 -0.516 25447
4002 1 10 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.674 -0.270 25447
4003 1 10 . 1 1 45 45 ILE CA C 45 66.148 66.148 64.011 2.137 25447
4004 1 10 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.299 0.978 25447
4005 1 10 . 1 1 45 45 ILE H H 45 8.145 8.145 7.777 0.368 25447
4006 1 10 . 1 1 46 46 ALA N N 46 121.213 121.213 123.522 -2.309 25447
4007 1 10 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.492 -0.235 25447
4008 1 10 . 1 1 46 46 ALA CA C 46 55.164 55.164 54.870 0.294 25447
4009 1 10 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.621 -0.253 25447
4010 1 10 . 1 1 46 46 ALA H H 46 7.792 7.792 8.010 -0.218 25447
4011 1 10 . 1 1 47 47 TRP N N 47 121.416 121.416 120.479 0.937 25447
4012 1 10 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.529 -0.295 25447
4013 1 10 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.635 2.035 25447
4014 1 10 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.569 -1.330 25447
4015 1 10 . 1 1 47 47 TRP H H 47 8.093 8.093 8.076 0.017 25447
4016 1 10 . 1 1 48 48 LEU N N 48 118.963 118.963 121.138 -2.175 25447
4017 1 10 . 1 1 48 48 LEU HA H 48 3.586 3.586 3.009 0.577 25447
4018 1 10 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.817 0.378 25447
4019 1 10 . 1 1 48 48 LEU CB C 48 42.251 42.251 41.508 0.743 25447
4020 1 10 . 1 1 48 48 LEU H H 48 8.693 8.693 7.576 1.117 25447
4021 1 10 . 1 1 49 49 GLU N N 49 119.131 119.131 117.249 1.882 25447
4022 1 10 . 1 1 49 49 GLU HA H 49 4.050 4.050 3.971 0.079 25447
4023 1 10 . 1 1 49 49 GLU CA C 49 59.862 59.862 59.031 0.831 25447
4024 1 10 . 1 1 49 49 GLU CB C 49 29.586 29.586 29.037 0.549 25447
4025 1 10 . 1 1 49 49 GLU H H 49 7.771 7.771 7.851 -0.080 25447
4026 1 10 . 1 1 50 50 ASP N N 50 119.941 119.941 121.066 -1.125 25447
4027 1 10 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.442 -0.205 25447
4028 1 10 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.337 1.018 25447
4029 1 10 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.778 1.605 25447
4030 1 10 . 1 1 50 50 ASP H H 50 7.697 7.697 7.705 -0.008 25447
4031 1 10 . 1 1 51 51 ARG N N 51 116.911 116.911 117.904 -0.993 25447
4032 1 10 . 1 1 51 51 ARG HA H 51 3.736 3.736 4.008 -0.272 25447
4033 1 10 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.424 -2.060 25447
4034 1 10 . 1 1 51 51 ARG CB C 51 29.315 29.315 30.396 -1.081 25447
4035 1 10 . 1 1 51 51 ARG H H 51 8.881 8.881 7.788 1.093 25447
4036 1 10 . 1 1 52 52 PHE N N 52 112.328 112.328 116.415 -4.087 25447
4037 1 10 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.672 0.003 25447
4038 1 10 . 1 1 52 52 PHE CA C 52 57.413 57.413 57.886 -0.473 25447
4039 1 10 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.268 1.624 25447
4040 1 10 . 1 1 52 52 PHE H H 52 7.284 7.284 7.641 -0.357 25447
4041 1 10 . 1 1 53 53 GLY N N 53 109.826 109.826 109.012 0.814 25447
4042 1 10 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.695 1.106 25447
4043 1 10 . 1 1 53 53 GLY H H 53 7.427 7.427 7.957 -0.530 25447
4044 1 10 . 1 1 54 54 ILE N N 54 119.127 119.127 114.741 4.386 25447
4045 1 10 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.499 -0.548 25447
4046 1 10 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.322 1.363 25447
4047 1 10 . 1 1 54 54 ILE CB C 54 39.490 39.490 39.632 -0.142 25447
4048 1 10 . 1 1 54 54 ILE H H 54 6.876 6.876 7.437 -0.561 25447
4049 1 10 . 1 1 55 55 ALA N N 55 129.823 129.823 123.638 6.185 25447
4050 1 10 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.641 -0.227 25447
4051 1 10 . 1 1 55 55 ALA CA C 55 51.610 51.610 50.484 1.126 25447
4052 1 10 . 1 1 55 55 ALA CB C 55 19.262 19.262 20.320 -1.058 25447
4053 1 10 . 1 1 55 55 ALA H H 55 8.499 8.499 8.274 0.225 25447
4054 1 10 . 1 1 56 56 ALA N N 56 126.300 126.300 125.293 1.007 25447
4055 1 10 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.070 0.199 25447
4056 1 10 . 1 1 56 56 ALA CA C 56 53.474 53.474 54.762 -1.288 25447
4057 1 10 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.766 0.478 25447
4058 1 10 . 1 1 56 56 ALA H H 56 8.641 8.641 8.826 -0.185 25447
4059 1 10 . 1 1 57 57 ASP N N 57 116.395 116.395 116.466 -0.071 25447
4060 1 10 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.355 0.124 25447
4061 1 10 . 1 1 57 57 ASP CA C 57 55.226 55.226 56.342 -1.115 25447
4062 1 10 . 1 1 57 57 ASP CB C 57 40.922 40.922 40.103 0.819 25447
4063 1 10 . 1 1 57 57 ASP H H 57 8.337 8.337 8.469 -0.132 25447
4064 1 10 . 1 1 58 58 ASP N N 58 118.557 118.557 119.145 -0.588 25447
4065 1 10 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.449 0.187 25447
4066 1 10 . 1 1 58 58 ASP CA C 58 55.144 55.144 56.011 -0.867 25447
4067 1 10 . 1 1 58 58 ASP CB C 58 41.504 41.504 41.341 0.163 25447
4068 1 10 . 1 1 58 58 ASP H H 58 8.027 8.027 7.845 0.182 25447
4069 1 10 . 1 1 59 59 VAL N N 59 118.898 118.898 113.194 5.704 25447
4070 1 10 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.412 -0.236 25447
4071 1 10 . 1 1 59 59 VAL CA C 59 62.300 62.300 60.106 2.194 25447
4072 1 10 . 1 1 59 59 VAL CB C 59 33.078 33.078 35.221 -2.143 25447
4073 1 10 . 1 1 59 59 VAL H H 59 7.716 7.716 7.504 0.212 25447
4074 1 10 . 1 1 60 60 GLU N N 60 122.888 122.888 122.395 0.493 25447
4075 1 10 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.588 -0.304 25447
4076 1 10 . 1 1 60 60 GLU CA C 60 56.546 56.546 55.546 1.000 25447
4077 1 10 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.694 -0.912 25447
4078 1 10 . 1 1 60 60 GLU H H 60 8.367 8.367 8.383 -0.016 25447
4079 1 10 . 1 1 61 61 LEU N N 61 124.827 124.827 125.269 -0.442 25447
4080 1 10 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.588 -0.230 25447
4081 1 10 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.177 0.639 25447
4082 1 10 . 1 1 61 61 LEU CB C 61 41.937 41.937 43.021 -1.084 25447
4083 1 10 . 1 1 61 61 LEU H H 61 8.198 8.198 8.552 -0.354 25447
4084 1 10 . 1 1 62 62 SER N N 62 118.715 118.715 119.317 -0.602 25447
4085 1 10 . 1 1 62 62 SER HA H 62 4.809 4.809 4.976 -0.167 25447
4086 1 10 . 1 1 62 62 SER CA C 62 55.732 55.732 55.180 0.552 25447
4087 1 10 . 1 1 62 62 SER CB C 62 64.017 64.017 64.546 -0.529 25447
4088 1 10 . 1 1 62 62 SER H H 62 8.137 8.137 8.317 -0.180 25447
4089 1 10 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.177 0.076 25447
4090 1 10 . 1 1 63 63 PRO CA C 63 64.896 64.896 65.201 -0.305 25447
4091 1 10 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.821 0.231 25447
4092 1 10 . 1 1 64 64 GLU N N 64 116.554 116.554 118.906 -2.352 25447
4093 1 10 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.114 -0.241 25447
4094 1 10 . 1 1 64 64 GLU CA C 64 58.719 58.719 58.970 -0.251 25447
4095 1 10 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.159 -0.478 25447
4096 1 10 . 1 1 64 64 GLU H H 64 8.316 8.316 8.515 -0.199 25447
4097 1 10 . 1 1 65 65 HIS N N 65 115.487 115.487 119.545 -4.058 25447
4098 1 10 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.214 0.066 25447
4099 1 10 . 1 1 65 65 HIS CA C 65 57.652 57.652 57.958 -0.306 25447
4100 1 10 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.590 0.292 25447
4101 1 10 . 1 1 65 65 HIS H H 65 7.274 7.274 8.034 -0.760 25447
4102 1 10 . 1 1 66 66 PHE N N 66 116.127 116.127 116.548 -0.421 25447
4103 1 10 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.368 0.398 25447
4104 1 10 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.741 -1.959 25447
4105 1 10 . 1 1 66 66 PHE CB C 66 38.908 38.908 37.592 1.316 25447
4106 1 10 . 1 1 66 66 PHE H H 66 7.239 7.239 7.693 -0.454 25447
4107 1 10 . 1 1 67 67 ARG N N 67 112.468 112.468 119.403 -6.935 25447
4108 1 10 . 1 1 67 67 ARG HA H 67 4.085 4.085 3.937 0.148 25447
4109 1 10 . 1 1 67 67 ARG CA C 67 58.287 58.287 58.964 -0.677 25447
4110 1 10 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.463 1.297 25447
4111 1 10 . 1 1 67 67 ARG H H 67 6.628 6.628 7.911 -1.283 25447
4112 1 10 . 1 1 68 68 SER N N 68 109.305 109.305 110.942 -1.637 25447
4113 1 10 . 1 1 68 68 SER HA H 68 4.980 4.980 4.652 0.328 25447
4114 1 10 . 1 1 68 68 SER CA C 68 55.785 55.785 56.481 -0.696 25447
4115 1 10 . 1 1 68 68 SER CB C 68 67.691 67.691 65.192 2.499 25447
4116 1 10 . 1 1 68 68 SER H H 68 8.145 8.145 7.596 0.549 25447
4117 1 10 . 1 1 69 69 ILE N N 69 122.602 122.602 124.952 -2.350 25447
4118 1 10 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.753 -0.077 25447
4119 1 10 . 1 1 69 69 ILE CA C 69 66.754 66.754 65.177 1.577 25447
4120 1 10 . 1 1 69 69 ILE CB C 69 37.296 37.296 37.349 -0.053 25447
4121 1 10 . 1 1 69 69 ILE H H 69 9.775 9.775 9.182 0.593 25447
4122 1 10 . 1 1 70 70 ARG N N 70 118.764 118.764 118.955 -0.191 25447
4123 1 10 . 1 1 70 70 ARG HA H 70 3.955 3.955 3.992 -0.037 25447
4124 1 10 . 1 1 70 70 ARG CA C 70 60.533 60.533 59.715 0.818 25447
4125 1 10 . 1 1 70 70 ARG CB C 70 30.418 30.418 29.218 1.200 25447
4126 1 10 . 1 1 70 70 ARG H H 70 8.910 8.910 7.924 0.986 25447
4127 1 10 . 1 1 71 71 SER N N 71 117.670 117.670 115.469 2.201 25447
4128 1 10 . 1 1 71 71 SER HA H 71 4.330 4.330 4.326 0.004 25447
4129 1 10 . 1 1 71 71 SER CA C 71 62.287 62.287 61.500 0.787 25447
4130 1 10 . 1 1 71 71 SER CB C 71 63.278 63.278 62.788 0.490 25447
4131 1 10 . 1 1 71 71 SER H H 71 8.518 8.518 7.453 1.065 25447
4132 1 10 . 1 1 72 72 ILE N N 72 127.447 127.447 124.776 2.671 25447
4133 1 10 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.885 0.025 25447
4134 1 10 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.400 1.411 25447
4135 1 10 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.704 0.694 25447
4136 1 10 . 1 1 72 72 ILE H H 72 8.762 8.762 7.857 0.905 25447
4137 1 10 . 1 1 73 73 ASP N N 73 121.636 121.636 119.901 1.735 25447
4138 1 10 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.348 -0.335 25447
4139 1 10 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.293 1.855 25447
4140 1 10 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.714 2.826 25447
4141 1 10 . 1 1 73 73 ASP H H 73 8.677 8.677 7.914 0.763 25447
4142 1 10 . 1 1 74 74 ALA N N 74 118.793 118.793 121.824 -3.031 25447
4143 1 10 . 1 1 74 74 ALA HA H 74 4.044 4.044 4.023 0.021 25447
4144 1 10 . 1 1 74 74 ALA CA C 74 55.321 55.321 55.109 0.212 25447
4145 1 10 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.522 -0.577 25447
4146 1 10 . 1 1 74 74 ALA H H 74 8.005 8.005 7.758 0.247 25447
4147 1 10 . 1 1 75 75 PHE N N 75 121.235 121.235 120.083 1.152 25447
4148 1 10 . 1 1 75 75 PHE HA H 75 4.038 4.038 3.993 0.045 25447
4149 1 10 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.917 -0.902 25447
4150 1 10 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.272 -0.435 25447
4151 1 10 . 1 1 75 75 PHE H H 75 8.353 8.353 8.542 -0.189 25447
4152 1 10 . 1 1 76 76 VAL N N 76 120.866 120.866 118.993 1.873 25447
4153 1 10 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.289 -0.346 25447
4154 1 10 . 1 1 76 76 VAL CA C 76 66.901 66.901 67.082 -0.181 25447
4155 1 10 . 1 1 76 76 VAL CB C 76 31.247 31.247 31.424 -0.177 25447
4156 1 10 . 1 1 76 76 VAL H H 76 8.544 8.544 7.911 0.633 25447
4157 1 10 . 1 1 77 77 VAL N N 77 121.408 121.408 119.829 1.579 25447
4158 1 10 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.781 -0.286 25447
4159 1 10 . 1 1 77 77 VAL CA C 77 66.833 66.833 66.150 0.684 25447
4160 1 10 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.239 0.691 25447
4161 1 10 . 1 1 77 77 VAL H H 77 8.708 8.708 8.318 0.390 25447
4162 1 10 . 1 1 78 78 GLY N N 78 106.402 106.402 107.214 -0.812 25447
4163 1 10 . 1 1 78 78 GLY CA C 78 46.840 46.840 47.145 -0.305 25447
4164 1 10 . 1 1 78 78 GLY H H 78 7.945 7.945 8.532 -0.587 25447
4165 1 10 . 1 1 79 79 ALA N N 79 121.146 121.146 122.620 -1.474 25447
4166 1 10 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.954 0.253 25447
4167 1 10 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.224 -1.296 25447
4168 1 10 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.198 1.063 25447
4169 1 10 . 1 1 79 79 ALA H H 79 7.639 7.639 7.505 0.134 25447
4170 1 10 . 1 1 80 80 THR N N 80 107.668 107.668 109.351 -1.683 25447
4171 1 10 . 1 1 80 80 THR HA H 80 4.443 4.443 4.186 0.257 25447
4172 1 10 . 1 1 80 80 THR CA C 80 61.406 61.406 63.187 -1.781 25447
4173 1 10 . 1 1 80 80 THR CB C 80 70.767 70.767 69.655 1.112 25447
4174 1 10 . 1 1 80 80 THR H H 80 7.449 7.449 7.751 -0.302 25447
4175 1 10 . 1 1 81 81 THR N N 81 119.953 119.953 116.120 3.833 25447
4176 1 10 . 1 1 81 81 THR HA H 81 4.665 4.665 4.827 -0.162 25447
4177 1 10 . 1 1 81 81 THR CA C 81 60.412 60.412 58.577 1.835 25447
4178 1 10 . 1 1 81 81 THR CB C 81 70.113 70.113 70.055 0.058 25447
4179 1 10 . 1 1 81 81 THR H H 81 7.685 7.685 8.002 -0.317 25447
4180 1 10 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.594 0.095 25447
4181 1 10 . 1 1 82 82 PRO CA C 82 61.688 61.688 62.023 -0.334 25447
4182 1 10 . 1 1 82 82 PRO CB C 82 30.969 30.969 30.618 0.351 25447
4183 1 10 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.502 -0.021 25447
4184 1 10 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.138 0.793 25447
4185 1 10 . 1 1 83 83 PRO CB C 83 32.193 32.193 33.013 -0.820 25447
4186 1 10 . 1 1 84 84 VAL N N 84 120.691 120.691 121.203 -0.512 25447
4187 1 10 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.155 -0.062 25447
4188 1 10 . 1 1 84 84 VAL CA C 84 62.339 62.339 61.616 0.723 25447
4189 1 10 . 1 1 84 84 VAL CB C 84 32.851 32.851 32.658 0.193 25447
4190 1 10 . 1 1 84 84 VAL H H 84 8.257 8.257 8.204 0.053 25447
4191 1 10 . 1 1 85 85 GLU N N 85 127.655 127.655 125.790 1.865 25447
4192 1 10 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.851 0.433 25447
4193 1 10 . 1 1 85 85 GLU CA C 85 56.754 56.754 56.441 0.313 25447
4194 1 10 . 1 1 85 85 GLU CB C 85 30.559 30.559 29.117 1.442 25447
4195 1 10 . 1 1 85 85 GLU H H 85 8.202 8.202 8.703 -0.501 25447
4196 1 10 . 1 1 86 86 ALA N N 86 126.437 126.437 123.701 2.736 25447
4197 1 10 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.322 -0.271 25447
4198 1 10 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.137 0.011 25447
4199 1 10 . 1 1 86 86 ALA CB C 86 19.460 19.460 19.718 -0.258 25447
4200 1 10 . 1 1 86 86 ALA H H 86 8.323 8.323 8.242 0.081 25447
4201 1 10 . 1 1 87 87 LYS N N 87 121.796 121.796 122.010 -0.214 25447
4202 1 10 . 1 1 87 87 LYS HA H 87 4.347 4.347 3.982 0.365 25447
4203 1 10 . 1 1 87 87 LYS CA C 87 56.297 56.297 58.647 -2.350 25447
4204 1 10 . 1 1 87 87 LYS CB C 87 33.276 33.276 32.559 0.717 25447
4205 1 10 . 1 1 87 87 LYS H H 87 8.333 8.333 8.429 -0.096 25447
4206 1 10 . 1 1 88 88 LEU N N 88 125.576 125.576 119.903 5.673 25447
4207 1 10 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.159 -0.252 25447
4208 1 10 . 1 1 88 88 LEU CA C 88 55.772 55.772 56.595 -0.823 25447
4209 1 10 . 1 1 88 88 LEU CB C 88 42.472 42.472 42.181 0.291 25447
4210 1 10 . 1 1 88 88 LEU H H 88 8.444 8.444 8.002 0.442 25447
4211 1 11 . 1 1 1 1 MET N N 1 120.668 120.668 121.188 -0.520 25447
4212 1 11 . 1 1 1 1 MET HA H 1 4.484 4.484 4.180 0.304 25447
4213 1 11 . 1 1 1 1 MET CA C 1 55.257 55.257 57.268 -2.011 25447
4214 1 11 . 1 1 1 1 MET CB C 1 34.517 34.517 33.322 1.195 25447
4215 1 11 . 1 1 1 1 MET H H 1 8.313 8.313 8.434 -0.121 25447
4216 1 11 . 1 1 2 2 GLN N N 2 123.739 123.739 114.419 9.320 25447
4217 1 11 . 1 1 2 2 GLN HA H 2 4.030 4.030 3.677 0.353 25447
4218 1 11 . 1 1 2 2 GLN CA C 2 57.874 57.874 56.280 1.594 25447
4219 1 11 . 1 1 2 2 GLN CB C 2 29.938 29.938 26.998 2.940 25447
4220 1 11 . 1 1 2 2 GLN H H 2 9.455 9.455 8.267 1.188 25447
4221 1 11 . 1 1 3 3 HIS N N 3 119.115 119.115 110.205 8.910 25447
4222 1 11 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.417 0.699 25447
4223 1 11 . 1 1 3 3 HIS CA C 3 55.494 55.494 56.217 -0.723 25447
4224 1 11 . 1 1 3 3 HIS CB C 3 31.015 31.015 27.484 3.531 25447
4225 1 11 . 1 1 3 3 HIS H H 3 9.783 9.783 8.183 1.600 25447
4226 1 11 . 1 1 4 4 ALA N N 4 122.648 122.648 122.212 0.436 25447
4227 1 11 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.134 -0.231 25447
4228 1 11 . 1 1 4 4 ALA CA C 4 56.479 56.479 55.295 1.184 25447
4229 1 11 . 1 1 4 4 ALA CB C 4 19.194 19.194 19.033 0.161 25447
4230 1 11 . 1 1 4 4 ALA H H 4 7.551 7.551 8.044 -0.493 25447
4231 1 11 . 1 1 5 5 SER N N 5 112.599 112.599 114.300 -1.701 25447
4232 1 11 . 1 1 5 5 SER HA H 5 4.298 4.298 4.250 0.048 25447
4233 1 11 . 1 1 5 5 SER CA C 5 62.117 62.117 60.922 1.195 25447
4234 1 11 . 1 1 5 5 SER CB C 5 62.334 62.334 62.325 0.009 25447
4235 1 11 . 1 1 5 5 SER H H 5 8.736 8.736 8.261 0.475 25447
4236 1 11 . 1 1 6 6 VAL N N 6 122.866 122.866 121.935 0.931 25447
4237 1 11 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.806 0.299 25447
4238 1 11 . 1 1 6 6 VAL CA C 6 65.732 65.732 66.492 -0.760 25447
4239 1 11 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.505 1.232 25447
4240 1 11 . 1 1 6 6 VAL H H 6 7.660 7.660 7.987 -0.327 25447
4241 1 11 . 1 1 7 7 ILE N N 7 121.715 121.715 120.190 1.525 25447
4242 1 11 . 1 1 7 7 ILE HA H 7 4.224 4.224 3.995 0.229 25447
4243 1 11 . 1 1 7 7 ILE CA C 7 65.329 65.329 65.899 -0.570 25447
4244 1 11 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.495 1.198 25447
4245 1 11 . 1 1 7 7 ILE H H 7 8.519 8.519 7.645 0.874 25447
4246 1 11 . 1 1 8 8 ALA N N 8 121.373 121.373 121.324 0.049 25447
4247 1 11 . 1 1 8 8 ALA HA H 8 3.895 3.895 4.021 -0.126 25447
4248 1 11 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.342 0.915 25447
4249 1 11 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.057 0.583 25447
4250 1 11 . 1 1 8 8 ALA H H 8 8.940 8.940 7.950 0.990 25447
4251 1 11 . 1 1 9 9 GLN N N 9 115.076 115.076 119.117 -4.041 25447
4252 1 11 . 1 1 9 9 GLN HA H 9 3.870 3.870 3.996 -0.126 25447
4253 1 11 . 1 1 9 9 GLN CA C 9 59.192 59.192 58.889 0.303 25447
4254 1 11 . 1 1 9 9 GLN CB C 9 28.138 28.138 28.692 -0.554 25447
4255 1 11 . 1 1 9 9 GLN H H 9 7.729 7.729 8.251 -0.522 25447
4256 1 11 . 1 1 10 10 PHE N N 10 120.207 120.207 119.513 0.694 25447
4257 1 11 . 1 1 10 10 PHE HA H 10 4.085 4.085 3.913 0.172 25447
4258 1 11 . 1 1 10 10 PHE CA C 10 60.893 60.893 61.931 -1.038 25447
4259 1 11 . 1 1 10 10 PHE CB C 10 38.932 38.932 38.700 0.232 25447
4260 1 11 . 1 1 10 10 PHE H H 10 7.301 7.301 8.248 -0.947 25447
4261 1 11 . 1 1 11 11 VAL N N 11 117.569 117.569 116.706 0.863 25447
4262 1 11 . 1 1 11 11 VAL HA H 11 3.307 3.307 4.097 -0.790 25447
4263 1 11 . 1 1 11 11 VAL CA C 11 66.508 66.508 65.922 0.586 25447
4264 1 11 . 1 1 11 11 VAL CB C 11 31.487 31.487 31.761 -0.274 25447
4265 1 11 . 1 1 11 11 VAL H H 11 8.370 8.370 7.788 0.582 25447
4266 1 11 . 1 1 12 12 VAL N N 12 117.909 117.909 120.590 -2.681 25447
4267 1 11 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.634 0.107 25447
4268 1 11 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.924 -1.048 25447
4269 1 11 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.459 -0.147 25447
4270 1 11 . 1 1 12 12 VAL H H 12 8.294 8.294 7.975 0.319 25447
4271 1 11 . 1 1 13 13 GLU N N 13 117.918 117.918 117.849 0.069 25447
4272 1 11 . 1 1 13 13 GLU HA H 13 3.742 3.742 3.991 -0.249 25447
4273 1 11 . 1 1 13 13 GLU CA C 13 59.307 59.307 58.241 1.066 25447
4274 1 11 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.172 0.317 25447
4275 1 11 . 1 1 13 13 GLU H H 13 7.750 7.750 8.378 -0.628 25447
4276 1 11 . 1 1 14 14 GLU N N 14 113.478 113.478 117.723 -4.245 25447
4277 1 11 . 1 1 14 14 GLU HA H 14 3.778 3.778 4.140 -0.362 25447
4278 1 11 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.875 -2.075 25447
4279 1 11 . 1 1 14 14 GLU CB C 14 29.643 29.643 30.199 -0.556 25447
4280 1 11 . 1 1 14 14 GLU H H 14 7.603 7.603 7.968 -0.365 25447
4281 1 11 . 1 1 15 15 PHE N N 15 114.193 114.193 114.302 -0.109 25447
4282 1 11 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.623 0.316 25447
4283 1 11 . 1 1 15 15 PHE CA C 15 58.095 58.095 58.562 -0.467 25447
4284 1 11 . 1 1 15 15 PHE CB C 15 42.095 42.095 42.385 -0.289 25447
4285 1 11 . 1 1 15 15 PHE H H 15 7.908 7.908 7.501 0.407 25447
4286 1 11 . 1 1 16 16 LEU N N 16 121.492 121.492 121.896 -0.404 25447
4287 1 11 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.821 0.146 25447
4288 1 11 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.210 0.167 25447
4289 1 11 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.392 1.341 25447
4290 1 11 . 1 1 16 16 LEU H H 16 8.015 8.015 7.926 0.089 25447
4291 1 11 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.440 -0.057 25447
4292 1 11 . 1 1 17 17 PRO CA C 17 64.858 64.858 63.809 1.049 25447
4293 1 11 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.830 -0.001 25447
4294 1 11 . 1 1 18 18 ASP N N 18 116.508 116.508 118.215 -1.707 25447
4295 1 11 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.692 -0.124 25447
4296 1 11 . 1 1 18 18 ASP CA C 18 54.688 54.688 54.046 0.642 25447
4297 1 11 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.569 0.057 25447
4298 1 11 . 1 1 18 18 ASP H H 18 8.399 8.399 8.549 -0.150 25447
4299 1 11 . 1 1 19 19 VAL N N 19 122.135 122.135 120.560 1.575 25447
4300 1 11 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.140 -0.022 25447
4301 1 11 . 1 1 19 19 VAL CA C 19 61.293 61.293 60.609 0.684 25447
4302 1 11 . 1 1 19 19 VAL CB C 19 33.582 33.582 33.134 0.448 25447
4303 1 11 . 1 1 19 19 VAL H H 19 7.760 7.760 7.218 0.542 25447
4304 1 11 . 1 1 20 20 ALA N N 20 129.301 129.301 130.814 -1.513 25447
4305 1 11 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.545 0.054 25447
4306 1 11 . 1 1 20 20 ALA CA C 20 50.270 50.270 50.202 0.068 25447
4307 1 11 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.397 -0.969 25447
4308 1 11 . 1 1 20 20 ALA H H 20 8.761 8.761 8.466 0.295 25447
4309 1 11 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.183 -0.106 25447
4310 1 11 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.532 0.671 25447
4311 1 11 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.829 -0.421 25447
4312 1 11 . 1 1 22 22 ALA N N 22 116.106 116.106 118.358 -2.252 25447
4313 1 11 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.157 -0.040 25447
4314 1 11 . 1 1 22 22 ALA CA C 22 53.996 53.996 54.039 -0.043 25447
4315 1 11 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.371 0.473 25447
4316 1 11 . 1 1 22 22 ALA H H 22 8.064 8.064 8.001 0.063 25447
4317 1 11 . 1 1 23 23 ASP N N 23 115.541 115.541 116.421 -0.880 25447
4318 1 11 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.578 0.099 25447
4319 1 11 . 1 1 23 23 ASP CA C 23 54.336 54.336 53.652 0.684 25447
4320 1 11 . 1 1 23 23 ASP CB C 23 41.353 41.353 40.431 0.922 25447
4321 1 11 . 1 1 23 23 ASP H H 23 8.003 8.003 8.109 -0.106 25447
4322 1 11 . 1 1 24 24 VAL N N 24 121.517 121.517 120.855 0.662 25447
4323 1 11 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.121 -0.300 25447
4324 1 11 . 1 1 24 24 VAL CA C 24 62.345 62.345 62.061 0.284 25447
4325 1 11 . 1 1 24 24 VAL CB C 24 31.733 31.733 33.111 -1.378 25447
4326 1 11 . 1 1 24 24 VAL H H 24 7.069 7.069 7.463 -0.394 25447
4327 1 11 . 1 1 25 25 ASP N N 25 129.329 129.329 126.249 3.080 25447
4328 1 11 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.768 -0.194 25447
4329 1 11 . 1 1 25 25 ASP CA C 25 54.566 54.566 52.807 1.759 25447
4330 1 11 . 1 1 25 25 ASP CB C 25 42.333 42.333 41.869 0.464 25447
4331 1 11 . 1 1 25 25 ASP H H 25 8.474 8.474 8.669 -0.195 25447
4332 1 11 . 1 1 26 26 VAL N N 26 121.920 121.920 121.168 0.752 25447
4333 1 11 . 1 1 26 26 VAL HA H 26 4.108 4.108 4.074 0.034 25447
4334 1 11 . 1 1 26 26 VAL CA C 26 64.518 64.518 63.456 1.062 25447
4335 1 11 . 1 1 26 26 VAL CB C 26 31.198 31.198 31.347 -0.149 25447
4336 1 11 . 1 1 26 26 VAL H H 26 8.591 8.591 8.685 -0.094 25447
4337 1 11 . 1 1 27 27 ASP N N 27 116.286 116.286 119.748 -3.462 25447
4338 1 11 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.672 0.473 25447
4339 1 11 . 1 1 27 27 ASP CA C 27 54.181 54.181 55.298 -1.117 25447
4340 1 11 . 1 1 27 27 ASP CB C 27 42.575 42.575 41.091 1.484 25447
4341 1 11 . 1 1 27 27 ASP H H 27 8.609 8.609 8.148 0.461 25447
4342 1 11 . 1 1 28 28 LEU N N 28 125.116 125.116 121.898 3.218 25447
4343 1 11 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.511 -0.500 25447
4344 1 11 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.137 1.950 25447
4345 1 11 . 1 1 28 28 LEU CB C 28 43.321 43.321 44.240 -0.919 25447
4346 1 11 . 1 1 28 28 LEU H H 28 7.374 7.374 7.431 -0.057 25447
4347 1 11 . 1 1 29 29 ASP N N 29 125.924 125.924 124.833 1.091 25447
4348 1 11 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.651 0.183 25447
4349 1 11 . 1 1 29 29 ASP CA C 29 53.920 53.920 55.035 -1.115 25447
4350 1 11 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.417 -0.038 25447
4351 1 11 . 1 1 29 29 ASP H H 29 8.699 8.699 8.629 0.070 25447
4352 1 11 . 1 1 30 30 LEU N N 30 129.975 129.975 123.406 6.569 25447
4353 1 11 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.135 -0.218 25447
4354 1 11 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.509 -1.121 25447
4355 1 11 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.455 -0.216 25447
4356 1 11 . 1 1 30 30 LEU H H 30 9.718 9.718 8.248 1.470 25447
4357 1 11 . 1 1 31 31 VAL N N 31 121.212 121.212 117.625 3.587 25447
4358 1 11 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.669 0.524 25447
4359 1 11 . 1 1 31 31 VAL CA C 31 64.433 64.433 65.772 -1.339 25447
4360 1 11 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.065 1.110 25447
4361 1 11 . 1 1 31 31 VAL H H 31 8.163 8.163 7.788 0.375 25447
4362 1 11 . 1 1 32 32 ASP N N 32 124.893 124.893 118.751 6.142 25447
4363 1 11 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.323 0.035 25447
4364 1 11 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.765 0.460 25447
4365 1 11 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.120 0.615 25447
4366 1 11 . 1 1 32 32 ASP H H 32 9.385 9.385 8.738 0.647 25447
4367 1 11 . 1 1 33 33 ASN N N 33 111.484 111.484 116.338 -4.854 25447
4368 1 11 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.600 0.120 25447
4369 1 11 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.672 0.214 25447
4370 1 11 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.056 -0.050 25447
4371 1 11 . 1 1 33 33 ASN H H 33 7.396 7.396 7.651 -0.255 25447
4372 1 11 . 1 1 34 34 GLY N N 34 106.957 106.957 105.783 1.174 25447
4373 1 11 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.803 0.804 25447
4374 1 11 . 1 1 34 34 GLY H H 34 7.618 7.618 7.962 -0.344 25447
4375 1 11 . 1 1 35 35 VAL N N 35 120.424 120.424 118.568 1.856 25447
4376 1 11 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.638 0.128 25447
4377 1 11 . 1 1 35 35 VAL CA C 35 65.125 65.125 65.018 0.107 25447
4378 1 11 . 1 1 35 35 VAL CB C 35 31.879 31.879 32.173 -0.294 25447
4379 1 11 . 1 1 35 35 VAL H H 35 7.792 7.792 7.879 -0.087 25447
4380 1 11 . 1 1 36 36 ILE N N 36 116.364 116.364 119.631 -3.267 25447
4381 1 11 . 1 1 36 36 ILE HA H 36 3.737 3.737 3.976 -0.239 25447
4382 1 11 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.255 -0.570 25447
4383 1 11 . 1 1 36 36 ILE CB C 36 38.807 38.807 38.101 0.706 25447
4384 1 11 . 1 1 36 36 ILE H H 36 7.331 7.331 7.899 -0.568 25447
4385 1 11 . 1 1 37 37 ASP N N 37 127.306 127.306 127.323 -0.017 25447
4386 1 11 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.715 -0.051 25447
4387 1 11 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.849 -1.233 25447
4388 1 11 . 1 1 37 37 ASP CB C 37 41.209 41.209 42.655 -1.446 25447
4389 1 11 . 1 1 37 37 ASP H H 37 7.874 7.874 8.118 -0.244 25447
4390 1 11 . 1 1 38 38 ALA N N 38 120.352 120.352 122.602 -2.250 25447
4391 1 11 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.056 -0.061 25447
4392 1 11 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.388 0.904 25447
4393 1 11 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.615 -0.303 25447
4394 1 11 . 1 1 38 38 ALA H H 38 8.244 8.244 8.313 -0.069 25447
4395 1 11 . 1 1 39 39 LEU N N 39 117.438 117.438 119.350 -1.912 25447
4396 1 11 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.211 0.039 25447
4397 1 11 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.608 -0.253 25447
4398 1 11 . 1 1 39 39 LEU CB C 39 41.236 41.236 41.027 0.209 25447
4399 1 11 . 1 1 39 39 LEU H H 39 7.688 7.688 8.334 -0.646 25447
4400 1 11 . 1 1 40 40 GLY N N 40 112.015 112.015 107.295 4.720 25447
4401 1 11 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.202 0.897 25447
4402 1 11 . 1 1 40 40 GLY H H 40 8.732 8.732 8.265 0.467 25447
4403 1 11 . 1 1 41 41 LEU N N 41 122.983 122.983 123.259 -0.276 25447
4404 1 11 . 1 1 41 41 LEU HA H 41 3.851 3.851 4.052 -0.201 25447
4405 1 11 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.555 0.777 25447
4406 1 11 . 1 1 41 41 LEU CB C 41 41.639 41.639 41.888 -0.249 25447
4407 1 11 . 1 1 41 41 LEU H H 41 8.548 8.548 8.139 0.409 25447
4408 1 11 . 1 1 42 42 LEU N N 42 116.076 116.076 120.038 -3.962 25447
4409 1 11 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.873 0.155 25447
4410 1 11 . 1 1 42 42 LEU CA C 42 58.064 58.064 58.510 -0.446 25447
4411 1 11 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.783 -0.843 25447
4412 1 11 . 1 1 42 42 LEU H H 42 7.168 7.168 7.645 -0.477 25447
4413 1 11 . 1 1 43 43 LYS N N 43 119.831 119.831 118.906 0.925 25447
4414 1 11 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.031 0.253 25447
4415 1 11 . 1 1 43 43 LYS CA C 43 59.644 59.644 60.008 -0.364 25447
4416 1 11 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.330 0.197 25447
4417 1 11 . 1 1 43 43 LYS H H 43 7.640 7.640 8.274 -0.634 25447
4418 1 11 . 1 1 44 44 VAL N N 44 121.046 121.046 120.435 0.611 25447
4419 1 11 . 1 1 44 44 VAL HA H 44 3.949 3.949 3.972 -0.023 25447
4420 1 11 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.646 -0.003 25447
4421 1 11 . 1 1 44 44 VAL H H 44 8.269 8.269 7.801 0.468 25447
4422 1 11 . 1 1 45 45 ILE N N 45 119.333 119.333 120.014 -0.681 25447
4423 1 11 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.572 -0.168 25447
4424 1 11 . 1 1 45 45 ILE CA C 45 66.148 66.148 63.769 2.379 25447
4425 1 11 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.181 1.096 25447
4426 1 11 . 1 1 45 45 ILE H H 45 8.145 8.145 7.726 0.419 25447
4427 1 11 . 1 1 46 46 ALA N N 46 121.213 121.213 123.174 -1.961 25447
4428 1 11 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.024 0.233 25447
4429 1 11 . 1 1 46 46 ALA CA C 46 55.164 55.164 55.338 -0.174 25447
4430 1 11 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.534 -0.166 25447
4431 1 11 . 1 1 46 46 ALA H H 46 7.792 7.792 7.989 -0.197 25447
4432 1 11 . 1 1 47 47 TRP N N 47 121.416 121.416 120.210 1.206 25447
4433 1 11 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.465 -0.231 25447
4434 1 11 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.690 1.980 25447
4435 1 11 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.392 -1.153 25447
4436 1 11 . 1 1 47 47 TRP H H 47 8.093 8.093 7.971 0.122 25447
4437 1 11 . 1 1 48 48 LEU N N 48 118.963 118.963 120.877 -1.914 25447
4438 1 11 . 1 1 48 48 LEU HA H 48 3.586 3.586 2.736 0.850 25447
4439 1 11 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.622 0.573 25447
4440 1 11 . 1 1 48 48 LEU CB C 48 42.251 42.251 41.053 1.198 25447
4441 1 11 . 1 1 48 48 LEU H H 48 8.693 8.693 7.310 1.383 25447
4442 1 11 . 1 1 49 49 GLU N N 49 119.131 119.131 117.024 2.107 25447
4443 1 11 . 1 1 49 49 GLU HA H 49 4.050 4.050 3.904 0.146 25447
4444 1 11 . 1 1 49 49 GLU CA C 49 59.862 59.862 59.101 0.761 25447
4445 1 11 . 1 1 49 49 GLU CB C 49 29.586 29.586 28.954 0.632 25447
4446 1 11 . 1 1 49 49 GLU H H 49 7.771 7.771 7.571 0.200 25447
4447 1 11 . 1 1 50 50 ASP N N 50 119.941 119.941 120.313 -0.372 25447
4448 1 11 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.430 -0.193 25447
4449 1 11 . 1 1 50 50 ASP CA C 50 57.355 57.355 57.065 0.290 25447
4450 1 11 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.930 1.453 25447
4451 1 11 . 1 1 50 50 ASP H H 50 7.697 7.697 7.660 0.037 25447
4452 1 11 . 1 1 51 51 ARG N N 51 116.911 116.911 119.812 -2.901 25447
4453 1 11 . 1 1 51 51 ARG HA H 51 3.736 3.736 4.157 -0.421 25447
4454 1 11 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.684 -2.320 25447
4455 1 11 . 1 1 51 51 ARG CB C 51 29.315 29.315 30.030 -0.715 25447
4456 1 11 . 1 1 51 51 ARG H H 51 8.881 8.881 8.104 0.777 25447
4457 1 11 . 1 1 52 52 PHE N N 52 112.328 112.328 116.485 -4.157 25447
4458 1 11 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.633 0.042 25447
4459 1 11 . 1 1 52 52 PHE CA C 52 57.413 57.413 57.950 -0.537 25447
4460 1 11 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.128 1.764 25447
4461 1 11 . 1 1 52 52 PHE H H 52 7.284 7.284 7.759 -0.475 25447
4462 1 11 . 1 1 53 53 GLY N N 53 109.826 109.826 108.606 1.220 25447
4463 1 11 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.510 1.291 25447
4464 1 11 . 1 1 53 53 GLY H H 53 7.427 7.427 7.693 -0.266 25447
4465 1 11 . 1 1 54 54 ILE N N 54 119.127 119.127 114.510 4.617 25447
4466 1 11 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.531 -0.580 25447
4467 1 11 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.126 1.559 25447
4468 1 11 . 1 1 54 54 ILE CB C 54 39.490 39.490 40.033 -0.543 25447
4469 1 11 . 1 1 54 54 ILE H H 54 6.876 6.876 7.721 -0.845 25447
4470 1 11 . 1 1 55 55 ALA N N 55 129.823 129.823 124.542 5.281 25447
4471 1 11 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.612 -0.198 25447
4472 1 11 . 1 1 55 55 ALA CA C 55 51.610 51.610 50.343 1.267 25447
4473 1 11 . 1 1 55 55 ALA CB C 55 19.262 19.262 20.827 -1.565 25447
4474 1 11 . 1 1 55 55 ALA H H 55 8.499 8.499 8.378 0.121 25447
4475 1 11 . 1 1 56 56 ALA N N 56 126.300 126.300 125.735 0.565 25447
4476 1 11 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.145 0.124 25447
4477 1 11 . 1 1 56 56 ALA CA C 56 53.474 53.474 54.413 -0.939 25447
4478 1 11 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.505 0.739 25447
4479 1 11 . 1 1 56 56 ALA H H 56 8.641 8.641 8.760 -0.119 25447
4480 1 11 . 1 1 57 57 ASP N N 57 116.395 116.395 116.602 -0.207 25447
4481 1 11 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.384 0.095 25447
4482 1 11 . 1 1 57 57 ASP CA C 57 55.226 55.226 56.295 -1.069 25447
4483 1 11 . 1 1 57 57 ASP CB C 57 40.922 40.922 40.200 0.722 25447
4484 1 11 . 1 1 57 57 ASP H H 57 8.337 8.337 8.507 -0.170 25447
4485 1 11 . 1 1 58 58 ASP N N 58 118.557 118.557 118.835 -0.278 25447
4486 1 11 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.485 0.151 25447
4487 1 11 . 1 1 58 58 ASP CA C 58 55.144 55.144 55.808 -0.664 25447
4488 1 11 . 1 1 58 58 ASP CB C 58 41.504 41.504 41.375 0.129 25447
4489 1 11 . 1 1 58 58 ASP H H 58 8.027 8.027 7.896 0.131 25447
4490 1 11 . 1 1 59 59 VAL N N 59 118.898 118.898 118.657 0.241 25447
4491 1 11 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.236 -0.060 25447
4492 1 11 . 1 1 59 59 VAL CA C 59 62.300 62.300 61.442 0.858 25447
4493 1 11 . 1 1 59 59 VAL CB C 59 33.078 33.078 34.469 -1.391 25447
4494 1 11 . 1 1 59 59 VAL H H 59 7.716 7.716 7.144 0.572 25447
4495 1 11 . 1 1 60 60 GLU N N 60 122.888 122.888 125.572 -2.684 25447
4496 1 11 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.497 -0.213 25447
4497 1 11 . 1 1 60 60 GLU CA C 60 56.546 56.546 55.416 1.130 25447
4498 1 11 . 1 1 60 60 GLU CB C 60 29.782 29.782 31.208 -1.426 25447
4499 1 11 . 1 1 60 60 GLU H H 60 8.367 8.367 8.401 -0.034 25447
4500 1 11 . 1 1 61 61 LEU N N 61 124.827 124.827 124.851 -0.024 25447
4501 1 11 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.377 -0.019 25447
4502 1 11 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.168 0.648 25447
4503 1 11 . 1 1 61 61 LEU CB C 61 41.937 41.937 42.654 -0.717 25447
4504 1 11 . 1 1 61 61 LEU H H 61 8.198 8.198 8.445 -0.247 25447
4505 1 11 . 1 1 62 62 SER N N 62 118.715 118.715 117.457 1.258 25447
4506 1 11 . 1 1 62 62 SER HA H 62 4.809 4.809 4.918 -0.109 25447
4507 1 11 . 1 1 62 62 SER CA C 62 55.732 55.732 55.085 0.647 25447
4508 1 11 . 1 1 62 62 SER CB C 62 64.017 64.017 64.609 -0.592 25447
4509 1 11 . 1 1 62 62 SER H H 62 8.137 8.137 8.171 -0.034 25447
4510 1 11 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.186 0.067 25447
4511 1 11 . 1 1 63 63 PRO CA C 63 64.896 64.896 65.339 -0.443 25447
4512 1 11 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.810 0.242 25447
4513 1 11 . 1 1 64 64 GLU N N 64 116.554 116.554 118.700 -2.146 25447
4514 1 11 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.193 -0.320 25447
4515 1 11 . 1 1 64 64 GLU CA C 64 58.719 58.719 58.791 -0.072 25447
4516 1 11 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.288 -0.607 25447
4517 1 11 . 1 1 64 64 GLU H H 64 8.316 8.316 8.971 -0.655 25447
4518 1 11 . 1 1 65 65 HIS N N 65 115.487 115.487 118.956 -3.469 25447
4519 1 11 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.182 0.098 25447
4520 1 11 . 1 1 65 65 HIS CA C 65 57.652 57.652 57.955 -0.303 25447
4521 1 11 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.328 0.554 25447
4522 1 11 . 1 1 65 65 HIS H H 65 7.274 7.274 8.571 -1.297 25447
4523 1 11 . 1 1 66 66 PHE N N 66 116.127 116.127 116.791 -0.664 25447
4524 1 11 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.701 0.065 25447
4525 1 11 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.339 -1.557 25447
4526 1 11 . 1 1 66 66 PHE CB C 66 38.908 38.908 37.887 1.021 25447
4527 1 11 . 1 1 66 66 PHE H H 66 7.239 7.239 7.735 -0.496 25447
4528 1 11 . 1 1 67 67 ARG N N 67 112.468 112.468 119.743 -7.275 25447
4529 1 11 . 1 1 67 67 ARG HA H 67 4.085 4.085 3.992 0.093 25447
4530 1 11 . 1 1 67 67 ARG CA C 67 58.287 58.287 59.106 -0.819 25447
4531 1 11 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.518 1.242 25447
4532 1 11 . 1 1 67 67 ARG H H 67 6.628 6.628 7.861 -1.233 25447
4533 1 11 . 1 1 68 68 SER N N 68 109.305 109.305 109.501 -0.196 25447
4534 1 11 . 1 1 68 68 SER HA H 68 4.980 4.980 4.791 0.189 25447
4535 1 11 . 1 1 68 68 SER CA C 68 55.785 55.785 57.042 -1.257 25447
4536 1 11 . 1 1 68 68 SER CB C 68 67.691 67.691 66.109 1.581 25447
4537 1 11 . 1 1 68 68 SER H H 68 8.145 8.145 7.301 0.844 25447
4538 1 11 . 1 1 69 69 ILE N N 69 122.602 122.602 123.582 -0.980 25447
4539 1 11 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.745 -0.069 25447
4540 1 11 . 1 1 69 69 ILE CA C 69 66.754 66.754 66.025 0.729 25447
4541 1 11 . 1 1 69 69 ILE CB C 69 37.296 37.296 37.664 -0.368 25447
4542 1 11 . 1 1 69 69 ILE H H 69 9.775 9.775 9.141 0.634 25447
4543 1 11 . 1 1 70 70 ARG N N 70 118.764 118.764 118.707 0.057 25447
4544 1 11 . 1 1 70 70 ARG HA H 70 3.955 3.955 3.926 0.029 25447
4545 1 11 . 1 1 70 70 ARG CA C 70 60.533 60.533 59.360 1.173 25447
4546 1 11 . 1 1 70 70 ARG CB C 70 30.418 30.418 29.202 1.216 25447
4547 1 11 . 1 1 70 70 ARG H H 70 8.910 8.910 8.391 0.519 25447
4548 1 11 . 1 1 71 71 SER N N 71 117.670 117.670 115.918 1.752 25447
4549 1 11 . 1 1 71 71 SER HA H 71 4.330 4.330 4.216 0.114 25447
4550 1 11 . 1 1 71 71 SER CA C 71 62.287 62.287 60.899 1.388 25447
4551 1 11 . 1 1 71 71 SER CB C 71 63.278 63.278 62.499 0.779 25447
4552 1 11 . 1 1 71 71 SER H H 71 8.518 8.518 7.621 0.897 25447
4553 1 11 . 1 1 72 72 ILE N N 72 127.447 127.447 123.001 4.446 25447
4554 1 11 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.164 0.746 25447
4555 1 11 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.746 1.065 25447
4556 1 11 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.467 0.931 25447
4557 1 11 . 1 1 72 72 ILE H H 72 8.762 8.762 7.775 0.987 25447
4558 1 11 . 1 1 73 73 ASP N N 73 121.636 121.636 120.039 1.597 25447
4559 1 11 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.282 -0.269 25447
4560 1 11 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.309 1.839 25447
4561 1 11 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.622 2.918 25447
4562 1 11 . 1 1 73 73 ASP H H 73 8.677 8.677 7.891 0.786 25447
4563 1 11 . 1 1 74 74 ALA N N 74 118.793 118.793 121.923 -3.130 25447
4564 1 11 . 1 1 74 74 ALA HA H 74 4.044 4.044 3.975 0.069 25447
4565 1 11 . 1 1 74 74 ALA CA C 74 55.321 55.321 55.150 0.171 25447
4566 1 11 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.523 -0.578 25447
4567 1 11 . 1 1 74 74 ALA H H 74 8.005 8.005 7.879 0.126 25447
4568 1 11 . 1 1 75 75 PHE N N 75 121.235 121.235 120.103 1.132 25447
4569 1 11 . 1 1 75 75 PHE HA H 75 4.038 4.038 4.055 -0.017 25447
4570 1 11 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.936 -0.921 25447
4571 1 11 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.454 -0.617 25447
4572 1 11 . 1 1 75 75 PHE H H 75 8.353 8.353 8.614 -0.261 25447
4573 1 11 . 1 1 76 76 VAL N N 76 120.866 120.866 119.265 1.601 25447
4574 1 11 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.349 -0.406 25447
4575 1 11 . 1 1 76 76 VAL CA C 76 66.901 66.901 66.854 0.047 25447
4576 1 11 . 1 1 76 76 VAL CB C 76 31.247 31.247 31.180 0.067 25447
4577 1 11 . 1 1 76 76 VAL H H 76 8.544 8.544 8.310 0.234 25447
4578 1 11 . 1 1 77 77 VAL N N 77 121.408 121.408 119.503 1.905 25447
4579 1 11 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.758 -0.263 25447
4580 1 11 . 1 1 77 77 VAL CA C 77 66.833 66.833 66.835 -0.002 25447
4581 1 11 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.736 0.194 25447
4582 1 11 . 1 1 77 77 VAL H H 77 8.708 8.708 8.324 0.384 25447
4583 1 11 . 1 1 78 78 GLY N N 78 106.402 106.402 106.335 0.067 25447
4584 1 11 . 1 1 78 78 GLY CA C 78 46.840 46.840 46.730 0.110 25447
4585 1 11 . 1 1 78 78 GLY H H 78 7.945 7.945 8.488 -0.543 25447
4586 1 11 . 1 1 79 79 ALA N N 79 121.146 121.146 122.601 -1.455 25447
4587 1 11 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.892 0.315 25447
4588 1 11 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.103 -1.174 25447
4589 1 11 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.384 0.877 25447
4590 1 11 . 1 1 79 79 ALA H H 79 7.639 7.639 7.676 -0.037 25447
4591 1 11 . 1 1 80 80 THR N N 80 107.668 107.668 108.915 -1.247 25447
4592 1 11 . 1 1 80 80 THR HA H 80 4.443 4.443 4.186 0.257 25447
4593 1 11 . 1 1 80 80 THR CA C 80 61.406 61.406 63.408 -2.002 25447
4594 1 11 . 1 1 80 80 THR CB C 80 70.767 70.767 69.626 1.141 25447
4595 1 11 . 1 1 80 80 THR H H 80 7.449 7.449 7.562 -0.113 25447
4596 1 11 . 1 1 81 81 THR N N 81 119.953 119.953 116.073 3.880 25447
4597 1 11 . 1 1 81 81 THR HA H 81 4.665 4.665 4.798 -0.133 25447
4598 1 11 . 1 1 81 81 THR CA C 81 60.412 60.412 58.613 1.799 25447
4599 1 11 . 1 1 81 81 THR CB C 81 70.113 70.113 70.117 -0.004 25447
4600 1 11 . 1 1 81 81 THR H H 81 7.685 7.685 7.585 0.100 25447
4601 1 11 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.508 0.181 25447
4602 1 11 . 1 1 82 82 PRO CA C 82 61.688 61.688 62.524 -0.836 25447
4603 1 11 . 1 1 82 82 PRO CB C 82 30.969 30.969 30.697 0.272 25447
4604 1 11 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.346 0.135 25447
4605 1 11 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.720 0.211 25447
4606 1 11 . 1 1 83 83 PRO CB C 83 32.193 32.193 32.526 -0.333 25447
4607 1 11 . 1 1 84 84 VAL N N 84 120.691 120.691 122.446 -1.755 25447
4608 1 11 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.106 -0.013 25447
4609 1 11 . 1 1 84 84 VAL CA C 84 62.339 62.339 62.107 0.232 25447
4610 1 11 . 1 1 84 84 VAL CB C 84 32.851 32.851 32.962 -0.111 25447
4611 1 11 . 1 1 84 84 VAL H H 84 8.257 8.257 8.064 0.193 25447
4612 1 11 . 1 1 85 85 GLU N N 85 127.655 127.655 122.866 4.789 25447
4613 1 11 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.806 0.478 25447
4614 1 11 . 1 1 85 85 GLU CA C 85 56.754 56.754 56.389 0.365 25447
4615 1 11 . 1 1 85 85 GLU CB C 85 30.559 30.559 28.181 2.378 25447
4616 1 11 . 1 1 85 85 GLU H H 85 8.202 8.202 8.693 -0.491 25447
4617 1 11 . 1 1 86 86 ALA N N 86 126.437 126.437 122.121 4.316 25447
4618 1 11 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.102 -0.051 25447
4619 1 11 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.711 -0.563 25447
4620 1 11 . 1 1 86 86 ALA CB C 86 19.460 19.460 19.789 -0.329 25447
4621 1 11 . 1 1 86 86 ALA H H 86 8.323 8.323 8.246 0.077 25447
4622 1 11 . 1 1 87 87 LYS N N 87 121.796 121.796 121.357 0.439 25447
4623 1 11 . 1 1 87 87 LYS HA H 87 4.347 4.347 4.018 0.329 25447
4624 1 11 . 1 1 87 87 LYS CA C 87 56.297 56.297 58.165 -1.868 25447
4625 1 11 . 1 1 87 87 LYS CB C 87 33.276 33.276 32.418 0.858 25447
4626 1 11 . 1 1 87 87 LYS H H 87 8.333 8.333 8.434 -0.101 25447
4627 1 11 . 1 1 88 88 LEU N N 88 125.576 125.576 120.461 5.115 25447
4628 1 11 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.362 -0.455 25447
4629 1 11 . 1 1 88 88 LEU CA C 88 55.772 55.772 54.417 1.355 25447
4630 1 11 . 1 1 88 88 LEU CB C 88 42.472 42.472 42.375 0.097 25447
4631 1 11 . 1 1 88 88 LEU H H 88 8.444 8.444 7.745 0.699 25447
4632 1 12 . 1 1 1 1 MET N N 1 120.668 120.668 114.646 6.022 25447
4633 1 12 . 1 1 1 1 MET HA H 1 4.484 4.484 4.345 0.140 25447
4634 1 12 . 1 1 1 1 MET CA C 1 55.257 55.257 56.903 -1.646 25447
4635 1 12 . 1 1 1 1 MET CB C 1 34.517 34.517 33.178 1.339 25447
4636 1 12 . 1 1 1 1 MET H H 1 8.313 8.313 7.745 0.568 25447
4637 1 12 . 1 1 2 2 GLN N N 2 123.739 123.739 113.773 9.966 25447
4638 1 12 . 1 1 2 2 GLN HA H 2 4.030 4.030 3.667 0.363 25447
4639 1 12 . 1 1 2 2 GLN CA C 2 57.874 57.874 56.274 1.600 25447
4640 1 12 . 1 1 2 2 GLN CB C 2 29.938 29.938 26.970 2.968 25447
4641 1 12 . 1 1 2 2 GLN H H 2 9.455 9.455 7.588 1.867 25447
4642 1 12 . 1 1 3 3 HIS N N 3 119.115 119.115 109.545 9.570 25447
4643 1 12 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.382 0.734 25447
4644 1 12 . 1 1 3 3 HIS CA C 3 55.494 55.494 56.340 -0.846 25447
4645 1 12 . 1 1 3 3 HIS CB C 3 31.015 31.015 27.242 3.772 25447
4646 1 12 . 1 1 3 3 HIS H H 3 9.783 9.783 8.159 1.624 25447
4647 1 12 . 1 1 4 4 ALA N N 4 122.648 122.648 122.966 -0.318 25447
4648 1 12 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.148 -0.245 25447
4649 1 12 . 1 1 4 4 ALA CA C 4 56.479 56.479 55.389 1.090 25447
4650 1 12 . 1 1 4 4 ALA CB C 4 19.194 19.194 19.242 -0.048 25447
4651 1 12 . 1 1 4 4 ALA H H 4 7.551 7.551 8.116 -0.565 25447
4652 1 12 . 1 1 5 5 SER N N 5 112.599 112.599 114.146 -1.547 25447
4653 1 12 . 1 1 5 5 SER HA H 5 4.298 4.298 4.249 0.049 25447
4654 1 12 . 1 1 5 5 SER CA C 5 62.117 62.117 61.158 0.959 25447
4655 1 12 . 1 1 5 5 SER CB C 5 62.334 62.334 61.906 0.428 25447
4656 1 12 . 1 1 5 5 SER H H 5 8.736 8.736 8.398 0.338 25447
4657 1 12 . 1 1 6 6 VAL N N 6 122.866 122.866 123.973 -1.107 25447
4658 1 12 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.833 0.272 25447
4659 1 12 . 1 1 6 6 VAL CA C 6 65.732 65.732 65.832 -0.099 25447
4660 1 12 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.634 1.103 25447
4661 1 12 . 1 1 6 6 VAL H H 6 7.660 7.660 7.792 -0.132 25447
4662 1 12 . 1 1 7 7 ILE N N 7 121.715 121.715 120.173 1.542 25447
4663 1 12 . 1 1 7 7 ILE HA H 7 4.224 4.224 4.118 0.106 25447
4664 1 12 . 1 1 7 7 ILE CA C 7 65.329 65.329 66.029 -0.701 25447
4665 1 12 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.560 1.133 25447
4666 1 12 . 1 1 7 7 ILE H H 7 8.519 8.519 7.713 0.806 25447
4667 1 12 . 1 1 8 8 ALA N N 8 121.373 121.373 121.377 -0.004 25447
4668 1 12 . 1 1 8 8 ALA HA H 8 3.895 3.895 4.010 -0.115 25447
4669 1 12 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.300 0.957 25447
4670 1 12 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.000 0.640 25447
4671 1 12 . 1 1 8 8 ALA H H 8 8.940 8.940 7.894 1.046 25447
4672 1 12 . 1 1 9 9 GLN N N 9 115.076 115.076 119.250 -4.174 25447
4673 1 12 . 1 1 9 9 GLN HA H 9 3.870 3.870 3.897 -0.027 25447
4674 1 12 . 1 1 9 9 GLN CA C 9 59.192 59.192 58.959 0.233 25447
4675 1 12 . 1 1 9 9 GLN CB C 9 28.138 28.138 28.576 -0.438 25447
4676 1 12 . 1 1 9 9 GLN H H 9 7.729 7.729 7.881 -0.152 25447
4677 1 12 . 1 1 10 10 PHE N N 10 120.207 120.207 118.118 2.089 25447
4678 1 12 . 1 1 10 10 PHE HA H 10 4.085 4.085 3.847 0.238 25447
4679 1 12 . 1 1 10 10 PHE CA C 10 60.893 60.893 61.356 -0.463 25447
4680 1 12 . 1 1 10 10 PHE CB C 10 38.932 38.932 37.724 1.208 25447
4681 1 12 . 1 1 10 10 PHE H H 10 7.301 7.301 7.787 -0.486 25447
4682 1 12 . 1 1 11 11 VAL N N 11 117.569 117.569 119.387 -1.818 25447
4683 1 12 . 1 1 11 11 VAL HA H 11 3.307 3.307 3.760 -0.453 25447
4684 1 12 . 1 1 11 11 VAL CA C 11 66.508 66.508 66.763 -0.255 25447
4685 1 12 . 1 1 11 11 VAL CB C 11 31.487 31.487 31.763 -0.276 25447
4686 1 12 . 1 1 11 11 VAL H H 11 8.370 8.370 7.618 0.752 25447
4687 1 12 . 1 1 12 12 VAL N N 12 117.909 117.909 116.154 1.755 25447
4688 1 12 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.668 0.073 25447
4689 1 12 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.756 -0.880 25447
4690 1 12 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.629 -0.317 25447
4691 1 12 . 1 1 12 12 VAL H H 12 8.294 8.294 7.592 0.702 25447
4692 1 12 . 1 1 13 13 GLU N N 13 117.918 117.918 118.767 -0.849 25447
4693 1 12 . 1 1 13 13 GLU HA H 13 3.742 3.742 3.903 -0.161 25447
4694 1 12 . 1 1 13 13 GLU CA C 13 59.307 59.307 58.636 0.671 25447
4695 1 12 . 1 1 13 13 GLU CB C 13 29.489 29.489 28.909 0.581 25447
4696 1 12 . 1 1 13 13 GLU H H 13 7.750 7.750 8.054 -0.304 25447
4697 1 12 . 1 1 14 14 GLU N N 14 113.478 113.478 117.602 -4.124 25447
4698 1 12 . 1 1 14 14 GLU HA H 14 3.778 3.778 4.136 -0.358 25447
4699 1 12 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.861 -2.061 25447
4700 1 12 . 1 1 14 14 GLU CB C 14 29.643 29.643 30.201 -0.558 25447
4701 1 12 . 1 1 14 14 GLU H H 14 7.603 7.603 7.901 -0.298 25447
4702 1 12 . 1 1 15 15 PHE N N 15 114.193 114.193 114.246 -0.053 25447
4703 1 12 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.631 0.308 25447
4704 1 12 . 1 1 15 15 PHE CA C 15 58.095 58.095 58.581 -0.486 25447
4705 1 12 . 1 1 15 15 PHE CB C 15 42.095 42.095 42.366 -0.271 25447
4706 1 12 . 1 1 15 15 PHE H H 15 7.908 7.908 7.591 0.317 25447
4707 1 12 . 1 1 16 16 LEU N N 16 121.492 121.492 122.118 -0.626 25447
4708 1 12 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.840 0.127 25447
4709 1 12 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.273 0.104 25447
4710 1 12 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.601 1.132 25447
4711 1 12 . 1 1 16 16 LEU H H 16 8.015 8.015 8.203 -0.188 25447
4712 1 12 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.377 0.006 25447
4713 1 12 . 1 1 17 17 PRO CA C 17 64.858 64.858 63.970 0.888 25447
4714 1 12 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.819 0.010 25447
4715 1 12 . 1 1 18 18 ASP N N 18 116.508 116.508 118.162 -1.654 25447
4716 1 12 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.725 -0.157 25447
4717 1 12 . 1 1 18 18 ASP CA C 18 54.688 54.688 53.844 0.844 25447
4718 1 12 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.340 0.286 25447
4719 1 12 . 1 1 18 18 ASP H H 18 8.399 8.399 8.545 -0.146 25447
4720 1 12 . 1 1 19 19 VAL N N 19 122.135 122.135 120.525 1.610 25447
4721 1 12 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.089 0.029 25447
4722 1 12 . 1 1 19 19 VAL CA C 19 61.293 61.293 61.321 -0.028 25447
4723 1 12 . 1 1 19 19 VAL CB C 19 33.582 33.582 33.923 -0.341 25447
4724 1 12 . 1 1 19 19 VAL H H 19 7.760 7.760 7.202 0.558 25447
4725 1 12 . 1 1 20 20 ALA N N 20 129.301 129.301 130.504 -1.203 25447
4726 1 12 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.601 -0.002 25447
4727 1 12 . 1 1 20 20 ALA CA C 20 50.270 50.270 49.912 0.358 25447
4728 1 12 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.432 -1.004 25447
4729 1 12 . 1 1 20 20 ALA H H 20 8.761 8.761 8.488 0.273 25447
4730 1 12 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.164 -0.087 25447
4731 1 12 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.555 0.648 25447
4732 1 12 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.811 -0.403 25447
4733 1 12 . 1 1 22 22 ALA N N 22 116.106 116.106 118.508 -2.402 25447
4734 1 12 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.152 -0.035 25447
4735 1 12 . 1 1 22 22 ALA CA C 22 53.996 53.996 54.087 -0.092 25447
4736 1 12 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.412 0.432 25447
4737 1 12 . 1 1 22 22 ALA H H 22 8.064 8.064 7.994 0.070 25447
4738 1 12 . 1 1 23 23 ASP N N 23 115.541 115.541 116.379 -0.838 25447
4739 1 12 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.578 0.099 25447
4740 1 12 . 1 1 23 23 ASP CA C 23 54.336 54.336 53.815 0.521 25447
4741 1 12 . 1 1 23 23 ASP CB C 23 41.353 41.353 40.395 0.959 25447
4742 1 12 . 1 1 23 23 ASP H H 23 8.003 8.003 8.089 -0.086 25447
4743 1 12 . 1 1 24 24 VAL N N 24 121.517 121.517 120.589 0.928 25447
4744 1 12 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.148 -0.327 25447
4745 1 12 . 1 1 24 24 VAL CA C 24 62.345 62.345 61.423 0.922 25447
4746 1 12 . 1 1 24 24 VAL CB C 24 31.733 31.733 33.249 -1.516 25447
4747 1 12 . 1 1 24 24 VAL H H 24 7.069 7.069 7.456 -0.387 25447
4748 1 12 . 1 1 25 25 ASP N N 25 129.329 129.329 126.038 3.291 25447
4749 1 12 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.764 -0.190 25447
4750 1 12 . 1 1 25 25 ASP CA C 25 54.566 54.566 53.049 1.517 25447
4751 1 12 . 1 1 25 25 ASP CB C 25 42.333 42.333 41.661 0.672 25447
4752 1 12 . 1 1 25 25 ASP H H 25 8.474 8.474 8.656 -0.182 25447
4753 1 12 . 1 1 26 26 VAL N N 26 121.920 121.920 121.262 0.658 25447
4754 1 12 . 1 1 26 26 VAL HA H 26 4.108 4.108 4.095 0.013 25447
4755 1 12 . 1 1 26 26 VAL CA C 26 64.518 64.518 63.125 1.393 25447
4756 1 12 . 1 1 26 26 VAL CB C 26 31.198 31.198 31.696 -0.498 25447
4757 1 12 . 1 1 26 26 VAL H H 26 8.591 8.591 8.608 -0.017 25447
4758 1 12 . 1 1 27 27 ASP N N 27 116.286 116.286 119.104 -2.818 25447
4759 1 12 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.627 0.518 25447
4760 1 12 . 1 1 27 27 ASP CA C 27 54.181 54.181 55.341 -1.160 25447
4761 1 12 . 1 1 27 27 ASP CB C 27 42.575 42.575 41.203 1.372 25447
4762 1 12 . 1 1 27 27 ASP H H 27 8.609 8.609 8.201 0.408 25447
4763 1 12 . 1 1 28 28 LEU N N 28 125.116 125.116 122.277 2.839 25447
4764 1 12 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.513 -0.502 25447
4765 1 12 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.266 1.821 25447
4766 1 12 . 1 1 28 28 LEU CB C 28 43.321 43.321 44.007 -0.686 25447
4767 1 12 . 1 1 28 28 LEU H H 28 7.374 7.374 7.364 0.010 25447
4768 1 12 . 1 1 29 29 ASP N N 29 125.924 125.924 125.171 0.753 25447
4769 1 12 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.644 0.190 25447
4770 1 12 . 1 1 29 29 ASP CA C 29 53.920 53.920 54.891 -0.971 25447
4771 1 12 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.357 0.022 25447
4772 1 12 . 1 1 29 29 ASP H H 29 8.699 8.699 8.563 0.136 25447
4773 1 12 . 1 1 30 30 LEU N N 30 129.975 129.975 125.168 4.807 25447
4774 1 12 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.164 -0.247 25447
4775 1 12 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.236 -0.848 25447
4776 1 12 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.579 -0.340 25447
4777 1 12 . 1 1 30 30 LEU H H 30 9.718 9.718 8.452 1.266 25447
4778 1 12 . 1 1 31 31 VAL N N 31 121.212 121.212 117.585 3.627 25447
4779 1 12 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.619 0.574 25447
4780 1 12 . 1 1 31 31 VAL CA C 31 64.433 64.433 66.538 -2.105 25447
4781 1 12 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.688 0.487 25447
4782 1 12 . 1 1 31 31 VAL H H 31 8.163 8.163 7.647 0.516 25447
4783 1 12 . 1 1 32 32 ASP N N 32 124.893 124.893 118.913 5.980 25447
4784 1 12 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.342 0.016 25447
4785 1 12 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.615 0.610 25447
4786 1 12 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.619 0.116 25447
4787 1 12 . 1 1 32 32 ASP H H 32 9.385 9.385 8.709 0.676 25447
4788 1 12 . 1 1 33 33 ASN N N 33 111.484 111.484 116.674 -5.190 25447
4789 1 12 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.555 0.165 25447
4790 1 12 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.940 -0.054 25447
4791 1 12 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.219 -0.213 25447
4792 1 12 . 1 1 33 33 ASN H H 33 7.396 7.396 7.660 -0.264 25447
4793 1 12 . 1 1 34 34 GLY N N 34 106.957 106.957 105.908 1.049 25447
4794 1 12 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.755 0.852 25447
4795 1 12 . 1 1 34 34 GLY H H 34 7.618 7.618 7.857 -0.239 25447
4796 1 12 . 1 1 35 35 VAL N N 35 120.424 120.424 118.181 2.243 25447
4797 1 12 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.582 0.184 25447
4798 1 12 . 1 1 35 35 VAL CA C 35 65.125 65.125 65.239 -0.114 25447
4799 1 12 . 1 1 35 35 VAL CB C 35 31.879 31.879 32.027 -0.148 25447
4800 1 12 . 1 1 35 35 VAL H H 35 7.792 7.792 7.908 -0.116 25447
4801 1 12 . 1 1 36 36 ILE N N 36 116.364 116.364 119.755 -3.391 25447
4802 1 12 . 1 1 36 36 ILE HA H 36 3.737 3.737 3.971 -0.234 25447
4803 1 12 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.783 -1.098 25447
4804 1 12 . 1 1 36 36 ILE CB C 36 38.807 38.807 37.665 1.142 25447
4805 1 12 . 1 1 36 36 ILE H H 36 7.331 7.331 7.913 -0.582 25447
4806 1 12 . 1 1 37 37 ASP N N 37 127.306 127.306 127.868 -0.562 25447
4807 1 12 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.731 -0.067 25447
4808 1 12 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.963 -1.347 25447
4809 1 12 . 1 1 37 37 ASP CB C 37 41.209 41.209 42.514 -1.304 25447
4810 1 12 . 1 1 37 37 ASP H H 37 7.874 7.874 7.993 -0.119 25447
4811 1 12 . 1 1 38 38 ALA N N 38 120.352 120.352 122.917 -2.565 25447
4812 1 12 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.093 -0.098 25447
4813 1 12 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.271 1.021 25447
4814 1 12 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.584 -0.272 25447
4815 1 12 . 1 1 38 38 ALA H H 38 8.244 8.244 8.299 -0.055 25447
4816 1 12 . 1 1 39 39 LEU N N 39 117.438 117.438 118.409 -0.971 25447
4817 1 12 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.158 0.092 25447
4818 1 12 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.026 0.329 25447
4819 1 12 . 1 1 39 39 LEU CB C 39 41.236 41.236 41.136 0.100 25447
4820 1 12 . 1 1 39 39 LEU H H 39 7.688 7.688 8.411 -0.723 25447
4821 1 12 . 1 1 40 40 GLY N N 40 112.015 112.015 107.854 4.161 25447
4822 1 12 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.159 0.940 25447
4823 1 12 . 1 1 40 40 GLY H H 40 8.732 8.732 8.278 0.454 25447
4824 1 12 . 1 1 41 41 LEU N N 41 122.983 122.983 123.264 -0.281 25447
4825 1 12 . 1 1 41 41 LEU HA H 41 3.851 3.851 3.971 -0.120 25447
4826 1 12 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.590 0.742 25447
4827 1 12 . 1 1 41 41 LEU CB C 41 41.639 41.639 41.952 -0.313 25447
4828 1 12 . 1 1 41 41 LEU H H 41 8.548 8.548 8.092 0.456 25447
4829 1 12 . 1 1 42 42 LEU N N 42 116.076 116.076 119.986 -3.910 25447
4830 1 12 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.875 0.153 25447
4831 1 12 . 1 1 42 42 LEU CA C 42 58.064 58.064 58.481 -0.417 25447
4832 1 12 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.786 -0.846 25447
4833 1 12 . 1 1 42 42 LEU H H 42 7.168 7.168 7.633 -0.465 25447
4834 1 12 . 1 1 43 43 LYS N N 43 119.831 119.831 118.970 0.861 25447
4835 1 12 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.026 0.258 25447
4836 1 12 . 1 1 43 43 LYS CA C 43 59.644 59.644 59.948 -0.304 25447
4837 1 12 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.300 0.227 25447
4838 1 12 . 1 1 43 43 LYS H H 43 7.640 7.640 8.303 -0.663 25447
4839 1 12 . 1 1 44 44 VAL N N 44 121.046 121.046 120.618 0.428 25447
4840 1 12 . 1 1 44 44 VAL HA H 44 3.949 3.949 4.001 -0.052 25447
4841 1 12 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.395 0.248 25447
4842 1 12 . 1 1 44 44 VAL H H 44 8.269 8.269 7.895 0.374 25447
4843 1 12 . 1 1 45 45 ILE N N 45 119.333 119.333 119.549 -0.216 25447
4844 1 12 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.619 -0.215 25447
4845 1 12 . 1 1 45 45 ILE CA C 45 66.148 66.148 62.513 3.635 25447
4846 1 12 . 1 1 45 45 ILE CB C 45 38.277 38.277 35.796 2.481 25447
4847 1 12 . 1 1 45 45 ILE H H 45 8.145 8.145 7.613 0.532 25447
4848 1 12 . 1 1 46 46 ALA N N 46 121.213 121.213 123.160 -1.947 25447
4849 1 12 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.118 0.139 25447
4850 1 12 . 1 1 46 46 ALA CA C 46 55.164 55.164 55.074 0.090 25447
4851 1 12 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.518 -0.150 25447
4852 1 12 . 1 1 46 46 ALA H H 46 7.792 7.792 7.896 -0.104 25447
4853 1 12 . 1 1 47 47 TRP N N 47 121.416 121.416 119.889 1.527 25447
4854 1 12 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.431 -0.197 25447
4855 1 12 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.510 2.160 25447
4856 1 12 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.466 -1.227 25447
4857 1 12 . 1 1 47 47 TRP H H 47 8.093 8.093 7.900 0.193 25447
4858 1 12 . 1 1 48 48 LEU N N 48 118.963 118.963 120.816 -1.853 25447
4859 1 12 . 1 1 48 48 LEU HA H 48 3.586 3.586 2.789 0.797 25447
4860 1 12 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.337 0.858 25447
4861 1 12 . 1 1 48 48 LEU CB C 48 42.251 42.251 40.674 1.577 25447
4862 1 12 . 1 1 48 48 LEU H H 48 8.693 8.693 7.211 1.482 25447
4863 1 12 . 1 1 49 49 GLU N N 49 119.131 119.131 117.866 1.265 25447
4864 1 12 . 1 1 49 49 GLU HA H 49 4.050 4.050 4.010 0.040 25447
4865 1 12 . 1 1 49 49 GLU CA C 49 59.862 59.862 59.057 0.805 25447
4866 1 12 . 1 1 49 49 GLU CB C 49 29.586 29.586 28.640 0.946 25447
4867 1 12 . 1 1 49 49 GLU H H 49 7.771 7.771 7.695 0.076 25447
4868 1 12 . 1 1 50 50 ASP N N 50 119.941 119.941 120.285 -0.344 25447
4869 1 12 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.441 -0.204 25447
4870 1 12 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.390 0.965 25447
4871 1 12 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.755 1.628 25447
4872 1 12 . 1 1 50 50 ASP H H 50 7.697 7.697 7.555 0.142 25447
4873 1 12 . 1 1 51 51 ARG N N 51 116.911 116.911 118.155 -1.244 25447
4874 1 12 . 1 1 51 51 ARG HA H 51 3.736 3.736 4.055 -0.319 25447
4875 1 12 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.221 -1.857 25447
4876 1 12 . 1 1 51 51 ARG CB C 51 29.315 29.315 30.192 -0.877 25447
4877 1 12 . 1 1 51 51 ARG H H 51 8.881 8.881 8.014 0.867 25447
4878 1 12 . 1 1 52 52 PHE N N 52 112.328 112.328 116.454 -4.126 25447
4879 1 12 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.672 0.003 25447
4880 1 12 . 1 1 52 52 PHE CA C 52 57.413 57.413 58.336 -0.923 25447
4881 1 12 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.565 1.327 25447
4882 1 12 . 1 1 52 52 PHE H H 52 7.284 7.284 7.608 -0.324 25447
4883 1 12 . 1 1 53 53 GLY N N 53 109.826 109.826 108.757 1.069 25447
4884 1 12 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.629 1.172 25447
4885 1 12 . 1 1 53 53 GLY H H 53 7.427 7.427 7.854 -0.427 25447
4886 1 12 . 1 1 54 54 ILE N N 54 119.127 119.127 115.283 3.844 25447
4887 1 12 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.504 -0.553 25447
4888 1 12 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.637 1.048 25447
4889 1 12 . 1 1 54 54 ILE CB C 54 39.490 39.490 39.720 -0.230 25447
4890 1 12 . 1 1 54 54 ILE H H 54 6.876 6.876 7.651 -0.775 25447
4891 1 12 . 1 1 55 55 ALA N N 55 129.823 129.823 125.700 4.123 25447
4892 1 12 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.532 -0.118 25447
4893 1 12 . 1 1 55 55 ALA CA C 55 51.610 51.610 51.056 0.554 25447
4894 1 12 . 1 1 55 55 ALA CB C 55 19.262 19.262 20.282 -1.020 25447
4895 1 12 . 1 1 55 55 ALA H H 55 8.499 8.499 8.128 0.371 25447
4896 1 12 . 1 1 56 56 ALA N N 56 126.300 126.300 122.673 3.627 25447
4897 1 12 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.185 0.084 25447
4898 1 12 . 1 1 56 56 ALA CA C 56 53.474 53.474 53.379 0.095 25447
4899 1 12 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.895 0.349 25447
4900 1 12 . 1 1 56 56 ALA H H 56 8.641 8.641 8.342 0.299 25447
4901 1 12 . 1 1 57 57 ASP N N 57 116.395 116.395 116.693 -0.298 25447
4902 1 12 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.414 0.065 25447
4903 1 12 . 1 1 57 57 ASP CA C 57 55.226 55.226 54.388 0.839 25447
4904 1 12 . 1 1 57 57 ASP CB C 57 40.922 40.922 39.660 1.262 25447
4905 1 12 . 1 1 57 57 ASP H H 57 8.337 8.337 8.058 0.279 25447
4906 1 12 . 1 1 58 58 ASP N N 58 118.557 118.557 115.176 3.381 25447
4907 1 12 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.261 0.375 25447
4908 1 12 . 1 1 58 58 ASP CA C 58 55.144 55.144 54.985 0.159 25447
4909 1 12 . 1 1 58 58 ASP CB C 58 41.504 41.504 39.745 1.759 25447
4910 1 12 . 1 1 58 58 ASP H H 58 8.027 8.027 8.516 -0.489 25447
4911 1 12 . 1 1 59 59 VAL N N 59 118.898 118.898 118.415 0.483 25447
4912 1 12 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.234 -0.058 25447
4913 1 12 . 1 1 59 59 VAL CA C 59 62.300 62.300 61.492 0.808 25447
4914 1 12 . 1 1 59 59 VAL CB C 59 33.078 33.078 34.173 -1.095 25447
4915 1 12 . 1 1 59 59 VAL H H 59 7.716 7.716 7.372 0.344 25447
4916 1 12 . 1 1 60 60 GLU N N 60 122.888 122.888 126.538 -3.650 25447
4917 1 12 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.559 -0.275 25447
4918 1 12 . 1 1 60 60 GLU CA C 60 56.546 56.546 55.641 0.905 25447
4919 1 12 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.877 -1.095 25447
4920 1 12 . 1 1 60 60 GLU H H 60 8.367 8.367 8.423 -0.056 25447
4921 1 12 . 1 1 61 61 LEU N N 61 124.827 124.827 124.660 0.167 25447
4922 1 12 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.522 -0.164 25447
4923 1 12 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.290 0.526 25447
4924 1 12 . 1 1 61 61 LEU CB C 61 41.937 41.937 42.631 -0.694 25447
4925 1 12 . 1 1 61 61 LEU H H 61 8.198 8.198 8.398 -0.200 25447
4926 1 12 . 1 1 62 62 SER N N 62 118.715 118.715 118.243 0.472 25447
4927 1 12 . 1 1 62 62 SER HA H 62 4.809 4.809 4.911 -0.102 25447
4928 1 12 . 1 1 62 62 SER CA C 62 55.732 55.732 55.908 -0.176 25447
4929 1 12 . 1 1 62 62 SER CB C 62 64.017 64.017 64.789 -0.772 25447
4930 1 12 . 1 1 62 62 SER H H 62 8.137 8.137 8.201 -0.064 25447
4931 1 12 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.211 0.042 25447
4932 1 12 . 1 1 63 63 PRO CA C 63 64.896 64.896 65.222 -0.326 25447
4933 1 12 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.689 0.363 25447
4934 1 12 . 1 1 64 64 GLU N N 64 116.554 116.554 119.725 -3.171 25447
4935 1 12 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.130 -0.257 25447
4936 1 12 . 1 1 64 64 GLU CA C 64 58.719 58.719 58.967 -0.248 25447
4937 1 12 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.635 -0.954 25447
4938 1 12 . 1 1 64 64 GLU H H 64 8.316 8.316 8.547 -0.231 25447
4939 1 12 . 1 1 65 65 HIS N N 65 115.487 115.487 118.758 -3.271 25447
4940 1 12 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.273 0.007 25447
4941 1 12 . 1 1 65 65 HIS CA C 65 57.652 57.652 58.180 -0.528 25447
4942 1 12 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.393 0.489 25447
4943 1 12 . 1 1 65 65 HIS H H 65 7.274 7.274 8.625 -1.351 25447
4944 1 12 . 1 1 66 66 PHE N N 66 116.127 116.127 116.844 -0.717 25447
4945 1 12 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.764 0.002 25447
4946 1 12 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.042 -1.260 25447
4947 1 12 . 1 1 66 66 PHE CB C 66 38.908 38.908 37.791 1.117 25447
4948 1 12 . 1 1 66 66 PHE H H 66 7.239 7.239 7.858 -0.619 25447
4949 1 12 . 1 1 67 67 ARG N N 67 112.468 112.468 119.551 -7.083 25447
4950 1 12 . 1 1 67 67 ARG HA H 67 4.085 4.085 3.997 0.088 25447
4951 1 12 . 1 1 67 67 ARG CA C 67 58.287 58.287 59.275 -0.988 25447
4952 1 12 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.441 1.319 25447
4953 1 12 . 1 1 67 67 ARG H H 67 6.628 6.628 7.881 -1.254 25447
4954 1 12 . 1 1 68 68 SER N N 68 109.305 109.305 110.299 -0.994 25447
4955 1 12 . 1 1 68 68 SER HA H 68 4.980 4.980 4.801 0.179 25447
4956 1 12 . 1 1 68 68 SER CA C 68 55.785 55.785 56.908 -1.123 25447
4957 1 12 . 1 1 68 68 SER CB C 68 67.691 67.691 66.059 1.631 25447
4958 1 12 . 1 1 68 68 SER H H 68 8.145 8.145 7.397 0.748 25447
4959 1 12 . 1 1 69 69 ILE N N 69 122.602 122.602 122.463 0.139 25447
4960 1 12 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.757 -0.081 25447
4961 1 12 . 1 1 69 69 ILE CA C 69 66.754 66.754 65.608 1.146 25447
4962 1 12 . 1 1 69 69 ILE CB C 69 37.296 37.296 37.569 -0.273 25447
4963 1 12 . 1 1 69 69 ILE H H 69 9.775 9.775 9.079 0.696 25447
4964 1 12 . 1 1 70 70 ARG N N 70 118.764 118.764 118.732 0.032 25447
4965 1 12 . 1 1 70 70 ARG HA H 70 3.955 3.955 3.927 0.028 25447
4966 1 12 . 1 1 70 70 ARG CA C 70 60.533 60.533 59.797 0.736 25447
4967 1 12 . 1 1 70 70 ARG CB C 70 30.418 30.418 29.536 0.882 25447
4968 1 12 . 1 1 70 70 ARG H H 70 8.910 8.910 8.384 0.526 25447
4969 1 12 . 1 1 71 71 SER N N 71 117.670 117.670 114.869 2.801 25447
4970 1 12 . 1 1 71 71 SER HA H 71 4.330 4.330 4.084 0.246 25447
4971 1 12 . 1 1 71 71 SER CA C 71 62.287 62.287 61.606 0.681 25447
4972 1 12 . 1 1 71 71 SER CB C 71 63.278 63.278 62.877 0.401 25447
4973 1 12 . 1 1 71 71 SER H H 71 8.518 8.518 7.474 1.044 25447
4974 1 12 . 1 1 72 72 ILE N N 72 127.447 127.447 122.750 4.697 25447
4975 1 12 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.299 0.611 25447
4976 1 12 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.711 1.100 25447
4977 1 12 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.697 0.701 25447
4978 1 12 . 1 1 72 72 ILE H H 72 8.762 8.762 7.579 1.183 25447
4979 1 12 . 1 1 73 73 ASP N N 73 121.636 121.636 119.812 1.824 25447
4980 1 12 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.320 -0.307 25447
4981 1 12 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.158 1.990 25447
4982 1 12 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.701 2.839 25447
4983 1 12 . 1 1 73 73 ASP H H 73 8.677 8.677 7.894 0.783 25447
4984 1 12 . 1 1 74 74 ALA N N 74 118.793 118.793 122.035 -3.242 25447
4985 1 12 . 1 1 74 74 ALA HA H 74 4.044 4.044 3.952 0.092 25447
4986 1 12 . 1 1 74 74 ALA CA C 74 55.321 55.321 55.148 0.173 25447
4987 1 12 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.459 -0.514 25447
4988 1 12 . 1 1 74 74 ALA H H 74 8.005 8.005 7.882 0.123 25447
4989 1 12 . 1 1 75 75 PHE N N 75 121.235 121.235 120.357 0.878 25447
4990 1 12 . 1 1 75 75 PHE HA H 75 4.038 4.038 4.016 0.022 25447
4991 1 12 . 1 1 75 75 PHE CA C 75 61.015 61.015 62.181 -1.165 25447
4992 1 12 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.232 -0.395 25447
4993 1 12 . 1 1 75 75 PHE H H 75 8.353 8.353 8.505 -0.152 25447
4994 1 12 . 1 1 76 76 VAL N N 76 120.866 120.866 118.936 1.930 25447
4995 1 12 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.325 -0.382 25447
4996 1 12 . 1 1 76 76 VAL CA C 76 66.901 66.901 67.347 -0.446 25447
4997 1 12 . 1 1 76 76 VAL CB C 76 31.247 31.247 31.427 -0.180 25447
4998 1 12 . 1 1 76 76 VAL H H 76 8.544 8.544 7.771 0.773 25447
4999 1 12 . 1 1 77 77 VAL N N 77 121.408 121.408 120.228 1.180 25447
5000 1 12 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.738 -0.243 25447
5001 1 12 . 1 1 77 77 VAL CA C 77 66.833 66.833 66.360 0.473 25447
5002 1 12 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.190 0.740 25447
5003 1 12 . 1 1 77 77 VAL H H 77 8.708 8.708 8.135 0.573 25447
5004 1 12 . 1 1 78 78 GLY N N 78 106.402 106.402 107.186 -0.784 25447
5005 1 12 . 1 1 78 78 GLY CA C 78 46.840 46.840 47.124 -0.284 25447
5006 1 12 . 1 1 78 78 GLY H H 78 7.945 7.945 8.539 -0.594 25447
5007 1 12 . 1 1 79 79 ALA N N 79 121.146 121.146 122.491 -1.345 25447
5008 1 12 . 1 1 79 79 ALA HA H 79 4.207 4.207 4.038 0.169 25447
5009 1 12 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.289 -1.360 25447
5010 1 12 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.423 0.838 25447
5011 1 12 . 1 1 79 79 ALA H H 79 7.639 7.639 7.392 0.247 25447
5012 1 12 . 1 1 80 80 THR N N 80 107.668 107.668 110.560 -2.892 25447
5013 1 12 . 1 1 80 80 THR HA H 80 4.443 4.443 4.248 0.195 25447
5014 1 12 . 1 1 80 80 THR CA C 80 61.406 61.406 63.360 -1.954 25447
5015 1 12 . 1 1 80 80 THR CB C 80 70.767 70.767 69.817 0.950 25447
5016 1 12 . 1 1 80 80 THR H H 80 7.449 7.449 7.825 -0.376 25447
5017 1 12 . 1 1 81 81 THR N N 81 119.953 119.953 116.163 3.790 25447
5018 1 12 . 1 1 81 81 THR HA H 81 4.665 4.665 4.823 -0.158 25447
5019 1 12 . 1 1 81 81 THR CA C 81 60.412 60.412 58.760 1.652 25447
5020 1 12 . 1 1 81 81 THR CB C 81 70.113 70.113 69.965 0.148 25447
5021 1 12 . 1 1 81 81 THR H H 81 7.685 7.685 7.950 -0.265 25447
5022 1 12 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.327 0.362 25447
5023 1 12 . 1 1 82 82 PRO CA C 82 61.688 61.688 62.333 -0.645 25447
5024 1 12 . 1 1 82 82 PRO CB C 82 30.969 30.969 31.196 -0.227 25447
5025 1 12 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.296 0.185 25447
5026 1 12 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.799 0.132 25447
5027 1 12 . 1 1 83 83 PRO CB C 83 32.193 32.193 32.195 -0.002 25447
5028 1 12 . 1 1 84 84 VAL N N 84 120.691 120.691 122.475 -1.784 25447
5029 1 12 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.127 -0.034 25447
5030 1 12 . 1 1 84 84 VAL CA C 84 62.339 62.339 61.845 0.494 25447
5031 1 12 . 1 1 84 84 VAL CB C 84 32.851 32.851 32.792 0.059 25447
5032 1 12 . 1 1 84 84 VAL H H 84 8.257 8.257 8.090 0.167 25447
5033 1 12 . 1 1 85 85 GLU N N 85 127.655 127.655 123.658 3.997 25447
5034 1 12 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.885 0.399 25447
5035 1 12 . 1 1 85 85 GLU CA C 85 56.754 56.754 56.328 0.426 25447
5036 1 12 . 1 1 85 85 GLU CB C 85 30.559 30.559 27.701 2.858 25447
5037 1 12 . 1 1 85 85 GLU H H 85 8.202 8.202 8.781 -0.579 25447
5038 1 12 . 1 1 86 86 ALA N N 86 126.437 126.437 120.596 5.841 25447
5039 1 12 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.085 -0.034 25447
5040 1 12 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.658 -0.510 25447
5041 1 12 . 1 1 86 86 ALA CB C 86 19.460 19.460 19.560 -0.100 25447
5042 1 12 . 1 1 86 86 ALA H H 86 8.323 8.323 7.877 0.446 25447
5043 1 12 . 1 1 87 87 LYS N N 87 121.796 121.796 120.686 1.110 25447
5044 1 12 . 1 1 87 87 LYS HA H 87 4.347 4.347 4.054 0.293 25447
5045 1 12 . 1 1 87 87 LYS CA C 87 56.297 56.297 57.828 -1.531 25447
5046 1 12 . 1 1 87 87 LYS CB C 87 33.276 33.276 32.541 0.735 25447
5047 1 12 . 1 1 87 87 LYS H H 87 8.333 8.333 8.448 -0.115 25447
5048 1 12 . 1 1 88 88 LEU N N 88 125.576 125.576 120.934 4.642 25447
5049 1 12 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.429 -0.522 25447
5050 1 12 . 1 1 88 88 LEU CA C 88 55.772 55.772 54.569 1.204 25447
5051 1 12 . 1 1 88 88 LEU CB C 88 42.472 42.472 42.267 0.205 25447
5052 1 12 . 1 1 88 88 LEU H H 88 8.444 8.444 7.619 0.825 25447
5053 1 13 . 1 1 1 1 MET N N 1 120.668 120.668 114.418 6.250 25447
5054 1 13 . 1 1 1 1 MET HA H 1 4.484 4.484 4.201 0.283 25447
5055 1 13 . 1 1 1 1 MET CA C 1 55.257 55.257 56.871 -1.614 25447
5056 1 13 . 1 1 1 1 MET CB C 1 34.517 34.517 32.980 1.537 25447
5057 1 13 . 1 1 1 1 MET H H 1 8.313 8.313 7.807 0.506 25447
5058 1 13 . 1 1 2 2 GLN N N 2 123.739 123.739 116.515 7.224 25447
5059 1 13 . 1 1 2 2 GLN HA H 2 4.030 4.030 3.819 0.211 25447
5060 1 13 . 1 1 2 2 GLN CA C 2 57.874 57.874 56.422 1.452 25447
5061 1 13 . 1 1 2 2 GLN CB C 2 29.938 29.938 27.053 2.885 25447
5062 1 13 . 1 1 2 2 GLN H H 2 9.455 9.455 7.627 1.828 25447
5063 1 13 . 1 1 3 3 HIS N N 3 119.115 119.115 114.643 4.472 25447
5064 1 13 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.344 0.772 25447
5065 1 13 . 1 1 3 3 HIS CA C 3 55.494 55.494 56.267 -0.772 25447
5066 1 13 . 1 1 3 3 HIS CB C 3 31.015 31.015 27.486 3.529 25447
5067 1 13 . 1 1 3 3 HIS H H 3 9.783 9.783 8.294 1.489 25447
5068 1 13 . 1 1 4 4 ALA N N 4 122.648 122.648 122.361 0.287 25447
5069 1 13 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.098 -0.195 25447
5070 1 13 . 1 1 4 4 ALA CA C 4 56.479 56.479 54.934 1.545 25447
5071 1 13 . 1 1 4 4 ALA CB C 4 19.194 19.194 19.167 0.027 25447
5072 1 13 . 1 1 4 4 ALA H H 4 7.551 7.551 7.938 -0.387 25447
5073 1 13 . 1 1 5 5 SER N N 5 112.599 112.599 112.878 -0.279 25447
5074 1 13 . 1 1 5 5 SER HA H 5 4.298 4.298 4.212 0.086 25447
5075 1 13 . 1 1 5 5 SER CA C 5 62.117 62.117 61.159 0.958 25447
5076 1 13 . 1 1 5 5 SER CB C 5 62.334 62.334 62.787 -0.453 25447
5077 1 13 . 1 1 5 5 SER H H 5 8.736 8.736 8.191 0.545 25447
5078 1 13 . 1 1 6 6 VAL N N 6 122.866 122.866 121.445 1.421 25447
5079 1 13 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.719 0.386 25447
5080 1 13 . 1 1 6 6 VAL CA C 6 65.732 65.732 66.325 -0.593 25447
5081 1 13 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.632 1.105 25447
5082 1 13 . 1 1 6 6 VAL H H 6 7.660 7.660 7.523 0.137 25447
5083 1 13 . 1 1 7 7 ILE N N 7 121.715 121.715 120.155 1.560 25447
5084 1 13 . 1 1 7 7 ILE HA H 7 4.224 4.224 4.053 0.171 25447
5085 1 13 . 1 1 7 7 ILE CA C 7 65.329 65.329 65.924 -0.595 25447
5086 1 13 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.554 1.139 25447
5087 1 13 . 1 1 7 7 ILE H H 7 8.519 8.519 7.592 0.927 25447
5088 1 13 . 1 1 8 8 ALA N N 8 121.373 121.373 121.289 0.084 25447
5089 1 13 . 1 1 8 8 ALA HA H 8 3.895 3.895 4.021 -0.126 25447
5090 1 13 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.306 0.951 25447
5091 1 13 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.029 0.611 25447
5092 1 13 . 1 1 8 8 ALA H H 8 8.940 8.940 8.558 0.382 25447
5093 1 13 . 1 1 9 9 GLN N N 9 115.076 115.076 119.353 -4.277 25447
5094 1 13 . 1 1 9 9 GLN HA H 9 3.870 3.870 3.905 -0.035 25447
5095 1 13 . 1 1 9 9 GLN CA C 9 59.192 59.192 59.039 0.153 25447
5096 1 13 . 1 1 9 9 GLN CB C 9 28.138 28.138 28.568 -0.430 25447
5097 1 13 . 1 1 9 9 GLN H H 9 7.729 7.729 8.169 -0.440 25447
5098 1 13 . 1 1 10 10 PHE N N 10 120.207 120.207 118.126 2.081 25447
5099 1 13 . 1 1 10 10 PHE HA H 10 4.085 4.085 3.838 0.247 25447
5100 1 13 . 1 1 10 10 PHE CA C 10 60.893 60.893 61.637 -0.744 25447
5101 1 13 . 1 1 10 10 PHE CB C 10 38.932 38.932 38.235 0.697 25447
5102 1 13 . 1 1 10 10 PHE H H 10 7.301 7.301 7.804 -0.503 25447
5103 1 13 . 1 1 11 11 VAL N N 11 117.569 117.569 116.928 0.641 25447
5104 1 13 . 1 1 11 11 VAL HA H 11 3.307 3.307 4.060 -0.753 25447
5105 1 13 . 1 1 11 11 VAL CA C 11 66.508 66.508 65.668 0.840 25447
5106 1 13 . 1 1 11 11 VAL CB C 11 31.487 31.487 31.765 -0.278 25447
5107 1 13 . 1 1 11 11 VAL H H 11 8.370 8.370 7.755 0.615 25447
5108 1 13 . 1 1 12 12 VAL N N 12 117.909 117.909 120.600 -2.691 25447
5109 1 13 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.624 0.117 25447
5110 1 13 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.963 -1.087 25447
5111 1 13 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.486 -0.174 25447
5112 1 13 . 1 1 12 12 VAL H H 12 8.294 8.294 8.239 0.055 25447
5113 1 13 . 1 1 13 13 GLU N N 13 117.918 117.918 117.770 0.148 25447
5114 1 13 . 1 1 13 13 GLU HA H 13 3.742 3.742 4.000 -0.258 25447
5115 1 13 . 1 1 13 13 GLU CA C 13 59.307 59.307 58.155 1.152 25447
5116 1 13 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.161 0.328 25447
5117 1 13 . 1 1 13 13 GLU H H 13 7.750 7.750 8.028 -0.278 25447
5118 1 13 . 1 1 14 14 GLU N N 14 113.478 113.478 118.071 -4.593 25447
5119 1 13 . 1 1 14 14 GLU HA H 14 3.778 3.778 4.144 -0.366 25447
5120 1 13 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.739 -1.939 25447
5121 1 13 . 1 1 14 14 GLU CB C 14 29.643 29.643 30.018 -0.375 25447
5122 1 13 . 1 1 14 14 GLU H H 14 7.603 7.603 8.053 -0.450 25447
5123 1 13 . 1 1 15 15 PHE N N 15 114.193 114.193 114.732 -0.539 25447
5124 1 13 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.616 0.323 25447
5125 1 13 . 1 1 15 15 PHE CA C 15 58.095 58.095 58.250 -0.155 25447
5126 1 13 . 1 1 15 15 PHE CB C 15 42.095 42.095 42.147 -0.052 25447
5127 1 13 . 1 1 15 15 PHE H H 15 7.908 7.908 7.490 0.418 25447
5128 1 13 . 1 1 16 16 LEU N N 16 121.492 121.492 122.333 -0.841 25447
5129 1 13 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.828 0.139 25447
5130 1 13 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.339 0.038 25447
5131 1 13 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.447 1.286 25447
5132 1 13 . 1 1 16 16 LEU H H 16 8.015 8.015 7.969 0.046 25447
5133 1 13 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.399 -0.016 25447
5134 1 13 . 1 1 17 17 PRO CA C 17 64.858 64.858 63.932 0.926 25447
5135 1 13 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.834 -0.005 25447
5136 1 13 . 1 1 18 18 ASP N N 18 116.508 116.508 117.542 -1.034 25447
5137 1 13 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.558 0.010 25447
5138 1 13 . 1 1 18 18 ASP CA C 18 54.688 54.688 53.147 1.542 25447
5139 1 13 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.064 0.562 25447
5140 1 13 . 1 1 18 18 ASP H H 18 8.399 8.399 8.514 -0.115 25447
5141 1 13 . 1 1 19 19 VAL N N 19 122.135 122.135 120.660 1.475 25447
5142 1 13 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.146 -0.028 25447
5143 1 13 . 1 1 19 19 VAL CA C 19 61.293 61.293 61.293 -0.000 25447
5144 1 13 . 1 1 19 19 VAL CB C 19 33.582 33.582 33.599 -0.017 25447
5145 1 13 . 1 1 19 19 VAL H H 19 7.760 7.760 7.219 0.541 25447
5146 1 13 . 1 1 20 20 ALA N N 20 129.301 129.301 130.569 -1.268 25447
5147 1 13 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.578 0.021 25447
5148 1 13 . 1 1 20 20 ALA CA C 20 50.270 50.270 50.033 0.237 25447
5149 1 13 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.404 -0.976 25447
5150 1 13 . 1 1 20 20 ALA H H 20 8.761 8.761 8.467 0.294 25447
5151 1 13 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.134 -0.057 25447
5152 1 13 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.529 0.674 25447
5153 1 13 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.709 -0.301 25447
5154 1 13 . 1 1 22 22 ALA N N 22 116.106 116.106 117.256 -1.150 25447
5155 1 13 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.109 0.008 25447
5156 1 13 . 1 1 22 22 ALA CA C 22 53.996 53.996 53.999 -0.003 25447
5157 1 13 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.066 0.778 25447
5158 1 13 . 1 1 22 22 ALA H H 22 8.064 8.064 8.329 -0.266 25447
5159 1 13 . 1 1 23 23 ASP N N 23 115.541 115.541 117.215 -1.674 25447
5160 1 13 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.719 -0.042 25447
5161 1 13 . 1 1 23 23 ASP CA C 23 54.336 54.336 54.668 -0.332 25447
5162 1 13 . 1 1 23 23 ASP CB C 23 41.353 41.353 40.795 0.558 25447
5163 1 13 . 1 1 23 23 ASP H H 23 8.003 8.003 8.042 -0.039 25447
5164 1 13 . 1 1 24 24 VAL N N 24 121.517 121.517 120.595 0.922 25447
5165 1 13 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.122 -0.301 25447
5166 1 13 . 1 1 24 24 VAL CA C 24 62.345 62.345 61.762 0.583 25447
5167 1 13 . 1 1 24 24 VAL CB C 24 31.733 31.733 32.816 -1.083 25447
5168 1 13 . 1 1 24 24 VAL H H 24 7.069 7.069 7.474 -0.405 25447
5169 1 13 . 1 1 25 25 ASP N N 25 129.329 129.329 127.116 2.213 25447
5170 1 13 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.739 -0.165 25447
5171 1 13 . 1 1 25 25 ASP CA C 25 54.566 54.566 53.040 1.526 25447
5172 1 13 . 1 1 25 25 ASP CB C 25 42.333 42.333 41.977 0.356 25447
5173 1 13 . 1 1 25 25 ASP H H 25 8.474 8.474 8.678 -0.204 25447
5174 1 13 . 1 1 26 26 VAL N N 26 121.920 121.920 126.274 -4.354 25447
5175 1 13 . 1 1 26 26 VAL HA H 26 4.108 4.108 3.929 0.178 25447
5176 1 13 . 1 1 26 26 VAL CA C 26 64.518 64.518 63.153 1.365 25447
5177 1 13 . 1 1 26 26 VAL CB C 26 31.198 31.198 31.832 -0.634 25447
5178 1 13 . 1 1 26 26 VAL H H 26 8.591 8.591 8.764 -0.173 25447
5179 1 13 . 1 1 27 27 ASP N N 27 116.286 116.286 119.658 -3.372 25447
5180 1 13 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.683 0.462 25447
5181 1 13 . 1 1 27 27 ASP CA C 27 54.181 54.181 54.569 -0.388 25447
5182 1 13 . 1 1 27 27 ASP CB C 27 42.575 42.575 41.139 1.436 25447
5183 1 13 . 1 1 27 27 ASP H H 27 8.609 8.609 8.078 0.531 25447
5184 1 13 . 1 1 28 28 LEU N N 28 125.116 125.116 122.258 2.858 25447
5185 1 13 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.505 -0.494 25447
5186 1 13 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.198 1.889 25447
5187 1 13 . 1 1 28 28 LEU CB C 28 43.321 43.321 44.066 -0.745 25447
5188 1 13 . 1 1 28 28 LEU H H 28 7.374 7.374 7.458 -0.084 25447
5189 1 13 . 1 1 29 29 ASP N N 29 125.924 125.924 125.037 0.887 25447
5190 1 13 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.621 0.213 25447
5191 1 13 . 1 1 29 29 ASP CA C 29 53.920 53.920 55.143 -1.223 25447
5192 1 13 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.299 0.080 25447
5193 1 13 . 1 1 29 29 ASP H H 29 8.699 8.699 8.696 0.003 25447
5194 1 13 . 1 1 30 30 LEU N N 30 129.975 129.975 125.383 4.592 25447
5195 1 13 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.180 -0.263 25447
5196 1 13 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.183 -0.795 25447
5197 1 13 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.513 -0.274 25447
5198 1 13 . 1 1 30 30 LEU H H 30 9.718 9.718 8.277 1.441 25447
5199 1 13 . 1 1 31 31 VAL N N 31 121.212 121.212 117.574 3.638 25447
5200 1 13 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.660 0.533 25447
5201 1 13 . 1 1 31 31 VAL CA C 31 64.433 64.433 66.303 -1.870 25447
5202 1 13 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.372 0.803 25447
5203 1 13 . 1 1 31 31 VAL H H 31 8.163 8.163 7.420 0.743 25447
5204 1 13 . 1 1 32 32 ASP N N 32 124.893 124.893 118.890 6.003 25447
5205 1 13 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.353 0.005 25447
5206 1 13 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.786 0.439 25447
5207 1 13 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.066 0.669 25447
5208 1 13 . 1 1 32 32 ASP H H 32 9.385 9.385 8.721 0.664 25447
5209 1 13 . 1 1 33 33 ASN N N 33 111.484 111.484 116.569 -5.085 25447
5210 1 13 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.566 0.154 25447
5211 1 13 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.705 0.181 25447
5212 1 13 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.319 -0.312 25447
5213 1 13 . 1 1 33 33 ASN H H 33 7.396 7.396 7.672 -0.276 25447
5214 1 13 . 1 1 34 34 GLY N N 34 106.957 106.957 106.726 0.231 25447
5215 1 13 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.677 0.930 25447
5216 1 13 . 1 1 34 34 GLY H H 34 7.618 7.618 7.929 -0.311 25447
5217 1 13 . 1 1 35 35 VAL N N 35 120.424 120.424 119.122 1.302 25447
5218 1 13 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.766 -0.000 25447
5219 1 13 . 1 1 35 35 VAL CA C 35 65.125 65.125 65.044 0.081 25447
5220 1 13 . 1 1 35 35 VAL CB C 35 31.879 31.879 31.996 -0.117 25447
5221 1 13 . 1 1 35 35 VAL H H 35 7.792 7.792 7.816 -0.024 25447
5222 1 13 . 1 1 36 36 ILE N N 36 116.364 116.364 117.975 -1.611 25447
5223 1 13 . 1 1 36 36 ILE HA H 36 3.737 3.737 4.003 -0.266 25447
5224 1 13 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.417 -0.732 25447
5225 1 13 . 1 1 36 36 ILE CB C 36 38.807 38.807 38.416 0.391 25447
5226 1 13 . 1 1 36 36 ILE H H 36 7.331 7.331 7.842 -0.511 25447
5227 1 13 . 1 1 37 37 ASP N N 37 127.306 127.306 125.896 1.410 25447
5228 1 13 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.641 0.023 25447
5229 1 13 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.550 -0.934 25447
5230 1 13 . 1 1 37 37 ASP CB C 37 41.209 41.209 43.817 -2.608 25447
5231 1 13 . 1 1 37 37 ASP H H 37 7.874 7.874 7.999 -0.125 25447
5232 1 13 . 1 1 38 38 ALA N N 38 120.352 120.352 122.879 -2.527 25447
5233 1 13 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.132 -0.137 25447
5234 1 13 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.252 1.040 25447
5235 1 13 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.514 -0.202 25447
5236 1 13 . 1 1 38 38 ALA H H 38 8.244 8.244 8.306 -0.062 25447
5237 1 13 . 1 1 39 39 LEU N N 39 117.438 117.438 118.259 -0.821 25447
5238 1 13 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.171 0.079 25447
5239 1 13 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.053 0.302 25447
5240 1 13 . 1 1 39 39 LEU CB C 39 41.236 41.236 41.147 0.089 25447
5241 1 13 . 1 1 39 39 LEU H H 39 7.688 7.688 8.377 -0.689 25447
5242 1 13 . 1 1 40 40 GLY N N 40 112.015 112.015 107.835 4.180 25447
5243 1 13 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.169 0.930 25447
5244 1 13 . 1 1 40 40 GLY H H 40 8.732 8.732 8.268 0.464 25447
5245 1 13 . 1 1 41 41 LEU N N 41 122.983 122.983 123.770 -0.787 25447
5246 1 13 . 1 1 41 41 LEU HA H 41 3.851 3.851 3.985 -0.134 25447
5247 1 13 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.217 1.115 25447
5248 1 13 . 1 1 41 41 LEU CB C 41 41.639 41.639 41.144 0.495 25447
5249 1 13 . 1 1 41 41 LEU H H 41 8.548 8.548 8.362 0.186 25447
5250 1 13 . 1 1 42 42 LEU N N 42 116.076 116.076 120.434 -4.358 25447
5251 1 13 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.839 0.189 25447
5252 1 13 . 1 1 42 42 LEU CA C 42 58.064 58.064 58.513 -0.449 25447
5253 1 13 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.840 -0.900 25447
5254 1 13 . 1 1 42 42 LEU H H 42 7.168 7.168 7.664 -0.496 25447
5255 1 13 . 1 1 43 43 LYS N N 43 119.831 119.831 118.852 0.979 25447
5256 1 13 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.019 0.265 25447
5257 1 13 . 1 1 43 43 LYS CA C 43 59.644 59.644 59.941 -0.296 25447
5258 1 13 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.305 0.222 25447
5259 1 13 . 1 1 43 43 LYS H H 43 7.640 7.640 8.202 -0.562 25447
5260 1 13 . 1 1 44 44 VAL N N 44 121.046 121.046 120.661 0.385 25447
5261 1 13 . 1 1 44 44 VAL HA H 44 3.949 3.949 4.104 -0.155 25447
5262 1 13 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.635 0.008 25447
5263 1 13 . 1 1 44 44 VAL H H 44 8.269 8.269 7.899 0.370 25447
5264 1 13 . 1 1 45 45 ILE N N 45 119.333 119.333 119.704 -0.371 25447
5265 1 13 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.658 -0.254 25447
5266 1 13 . 1 1 45 45 ILE CA C 45 66.148 66.148 64.177 1.971 25447
5267 1 13 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.220 1.057 25447
5268 1 13 . 1 1 45 45 ILE H H 45 8.145 8.145 7.846 0.299 25447
5269 1 13 . 1 1 46 46 ALA N N 46 121.213 121.213 123.782 -2.569 25447
5270 1 13 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.454 -0.197 25447
5271 1 13 . 1 1 46 46 ALA CA C 46 55.164 55.164 54.851 0.313 25447
5272 1 13 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.555 -0.187 25447
5273 1 13 . 1 1 46 46 ALA H H 46 7.792 7.792 8.033 -0.241 25447
5274 1 13 . 1 1 47 47 TRP N N 47 121.416 121.416 119.915 1.501 25447
5275 1 13 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.514 -0.280 25447
5276 1 13 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.611 2.059 25447
5277 1 13 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.527 -1.288 25447
5278 1 13 . 1 1 47 47 TRP H H 47 8.093 8.093 7.943 0.150 25447
5279 1 13 . 1 1 48 48 LEU N N 48 118.963 118.963 121.263 -2.300 25447
5280 1 13 . 1 1 48 48 LEU HA H 48 3.586 3.586 2.917 0.669 25447
5281 1 13 . 1 1 48 48 LEU CA C 48 58.195 58.195 56.977 1.218 25447
5282 1 13 . 1 1 48 48 LEU CB C 48 42.251 42.251 40.618 1.633 25447
5283 1 13 . 1 1 48 48 LEU H H 48 8.693 8.693 7.417 1.276 25447
5284 1 13 . 1 1 49 49 GLU N N 49 119.131 119.131 117.639 1.492 25447
5285 1 13 . 1 1 49 49 GLU HA H 49 4.050 4.050 3.958 0.092 25447
5286 1 13 . 1 1 49 49 GLU CA C 49 59.862 59.862 59.165 0.697 25447
5287 1 13 . 1 1 49 49 GLU CB C 49 29.586 29.586 29.036 0.550 25447
5288 1 13 . 1 1 49 49 GLU H H 49 7.771 7.771 7.792 -0.021 25447
5289 1 13 . 1 1 50 50 ASP N N 50 119.941 119.941 121.014 -1.073 25447
5290 1 13 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.432 -0.195 25447
5291 1 13 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.651 0.704 25447
5292 1 13 . 1 1 50 50 ASP CB C 50 42.383 42.383 41.023 1.359 25447
5293 1 13 . 1 1 50 50 ASP H H 50 7.697 7.697 7.625 0.072 25447
5294 1 13 . 1 1 51 51 ARG N N 51 116.911 116.911 118.055 -1.144 25447
5295 1 13 . 1 1 51 51 ARG HA H 51 3.736 3.736 4.188 -0.452 25447
5296 1 13 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.392 -2.028 25447
5297 1 13 . 1 1 51 51 ARG CB C 51 29.315 29.315 29.833 -0.518 25447
5298 1 13 . 1 1 51 51 ARG H H 51 8.881 8.881 8.072 0.809 25447
5299 1 13 . 1 1 52 52 PHE N N 52 112.328 112.328 118.799 -6.471 25447
5300 1 13 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.501 0.174 25447
5301 1 13 . 1 1 52 52 PHE CA C 52 57.413 57.413 59.092 -1.679 25447
5302 1 13 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.438 1.454 25447
5303 1 13 . 1 1 52 52 PHE H H 52 7.284 7.284 7.762 -0.478 25447
5304 1 13 . 1 1 53 53 GLY N N 53 109.826 109.826 107.981 1.845 25447
5305 1 13 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.463 1.338 25447
5306 1 13 . 1 1 53 53 GLY H H 53 7.427 7.427 7.776 -0.349 25447
5307 1 13 . 1 1 54 54 ILE N N 54 119.127 119.127 115.034 4.093 25447
5308 1 13 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.534 -0.583 25447
5309 1 13 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.087 1.598 25447
5310 1 13 . 1 1 54 54 ILE CB C 54 39.490 39.490 39.953 -0.463 25447
5311 1 13 . 1 1 54 54 ILE H H 54 6.876 6.876 7.493 -0.617 25447
5312 1 13 . 1 1 55 55 ALA N N 55 129.823 129.823 123.312 6.511 25447
5313 1 13 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.573 -0.159 25447
5314 1 13 . 1 1 55 55 ALA CA C 55 51.610 51.610 50.620 0.990 25447
5315 1 13 . 1 1 55 55 ALA CB C 55 19.262 19.262 20.041 -0.779 25447
5316 1 13 . 1 1 55 55 ALA H H 55 8.499 8.499 8.450 0.049 25447
5317 1 13 . 1 1 56 56 ALA N N 56 126.300 126.300 125.745 0.555 25447
5318 1 13 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.100 0.169 25447
5319 1 13 . 1 1 56 56 ALA CA C 56 53.474 53.474 54.650 -1.176 25447
5320 1 13 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.804 0.440 25447
5321 1 13 . 1 1 56 56 ALA H H 56 8.641 8.641 8.545 0.096 25447
5322 1 13 . 1 1 57 57 ASP N N 57 116.395 116.395 118.128 -1.733 25447
5323 1 13 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.314 0.165 25447
5324 1 13 . 1 1 57 57 ASP CA C 57 55.226 55.226 56.629 -1.403 25447
5325 1 13 . 1 1 57 57 ASP CB C 57 40.922 40.922 40.193 0.729 25447
5326 1 13 . 1 1 57 57 ASP H H 57 8.337 8.337 8.536 -0.199 25447
5327 1 13 . 1 1 58 58 ASP N N 58 118.557 118.557 118.132 0.425 25447
5328 1 13 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.476 0.160 25447
5329 1 13 . 1 1 58 58 ASP CA C 58 55.144 55.144 55.843 -0.699 25447
5330 1 13 . 1 1 58 58 ASP CB C 58 41.504 41.504 41.351 0.153 25447
5331 1 13 . 1 1 58 58 ASP H H 58 8.027 8.027 7.923 0.104 25447
5332 1 13 . 1 1 59 59 VAL N N 59 118.898 118.898 118.694 0.204 25447
5333 1 13 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.252 -0.076 25447
5334 1 13 . 1 1 59 59 VAL CA C 59 62.300 62.300 60.949 1.351 25447
5335 1 13 . 1 1 59 59 VAL CB C 59 33.078 33.078 34.314 -1.236 25447
5336 1 13 . 1 1 59 59 VAL H H 59 7.716 7.716 7.610 0.106 25447
5337 1 13 . 1 1 60 60 GLU N N 60 122.888 122.888 125.944 -3.056 25447
5338 1 13 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.374 -0.090 25447
5339 1 13 . 1 1 60 60 GLU CA C 60 56.546 56.546 55.952 0.594 25447
5340 1 13 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.410 -0.628 25447
5341 1 13 . 1 1 60 60 GLU H H 60 8.367 8.367 8.384 -0.017 25447
5342 1 13 . 1 1 61 61 LEU N N 61 124.827 124.827 125.817 -0.990 25447
5343 1 13 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.488 -0.130 25447
5344 1 13 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.063 0.753 25447
5345 1 13 . 1 1 61 61 LEU CB C 61 41.937 41.937 43.107 -1.170 25447
5346 1 13 . 1 1 61 61 LEU H H 61 8.198 8.198 8.454 -0.256 25447
5347 1 13 . 1 1 62 62 SER N N 62 118.715 118.715 118.974 -0.259 25447
5348 1 13 . 1 1 62 62 SER HA H 62 4.809 4.809 4.928 -0.119 25447
5349 1 13 . 1 1 62 62 SER CA C 62 55.732 55.732 55.725 0.007 25447
5350 1 13 . 1 1 62 62 SER CB C 62 64.017 64.017 64.966 -0.949 25447
5351 1 13 . 1 1 62 62 SER H H 62 8.137 8.137 8.234 -0.097 25447
5352 1 13 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.281 -0.028 25447
5353 1 13 . 1 1 63 63 PRO CA C 63 64.896 64.896 64.863 0.033 25447
5354 1 13 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.906 0.146 25447
5355 1 13 . 1 1 64 64 GLU N N 64 116.554 116.554 119.494 -2.940 25447
5356 1 13 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.121 -0.248 25447
5357 1 13 . 1 1 64 64 GLU CA C 64 58.719 58.719 58.990 -0.271 25447
5358 1 13 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.175 -0.494 25447
5359 1 13 . 1 1 64 64 GLU H H 64 8.316 8.316 8.450 -0.134 25447
5360 1 13 . 1 1 65 65 HIS N N 65 115.487 115.487 119.924 -4.437 25447
5361 1 13 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.271 0.009 25447
5362 1 13 . 1 1 65 65 HIS CA C 65 57.652 57.652 58.210 -0.558 25447
5363 1 13 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.470 0.412 25447
5364 1 13 . 1 1 65 65 HIS H H 65 7.274 7.274 7.938 -0.664 25447
5365 1 13 . 1 1 66 66 PHE N N 66 116.127 116.127 116.701 -0.574 25447
5366 1 13 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.504 0.262 25447
5367 1 13 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.995 -2.213 25447
5368 1 13 . 1 1 66 66 PHE CB C 66 38.908 38.908 37.591 1.317 25447
5369 1 13 . 1 1 66 66 PHE H H 66 7.239 7.239 7.725 -0.486 25447
5370 1 13 . 1 1 67 67 ARG N N 67 112.468 112.468 119.228 -6.760 25447
5371 1 13 . 1 1 67 67 ARG HA H 67 4.085 4.085 3.990 0.095 25447
5372 1 13 . 1 1 67 67 ARG CA C 67 58.287 58.287 59.015 -0.728 25447
5373 1 13 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.292 1.468 25447
5374 1 13 . 1 1 67 67 ARG H H 67 6.628 6.628 7.760 -1.132 25447
5375 1 13 . 1 1 68 68 SER N N 68 109.305 109.305 111.313 -2.008 25447
5376 1 13 . 1 1 68 68 SER HA H 68 4.980 4.980 4.857 0.123 25447
5377 1 13 . 1 1 68 68 SER CA C 68 55.785 55.785 56.400 -0.615 25447
5378 1 13 . 1 1 68 68 SER CB C 68 67.691 67.691 66.744 0.947 25447
5379 1 13 . 1 1 68 68 SER H H 68 8.145 8.145 7.252 0.893 25447
5380 1 13 . 1 1 69 69 ILE N N 69 122.602 122.602 122.536 0.066 25447
5381 1 13 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.812 -0.136 25447
5382 1 13 . 1 1 69 69 ILE CA C 69 66.754 66.754 64.954 1.800 25447
5383 1 13 . 1 1 69 69 ILE CB C 69 37.296 37.296 37.552 -0.256 25447
5384 1 13 . 1 1 69 69 ILE H H 69 9.775 9.775 9.145 0.630 25447
5385 1 13 . 1 1 70 70 ARG N N 70 118.764 118.764 119.308 -0.544 25447
5386 1 13 . 1 1 70 70 ARG HA H 70 3.955 3.955 3.966 -0.011 25447
5387 1 13 . 1 1 70 70 ARG CA C 70 60.533 60.533 59.783 0.750 25447
5388 1 13 . 1 1 70 70 ARG CB C 70 30.418 30.418 29.627 0.791 25447
5389 1 13 . 1 1 70 70 ARG H H 70 8.910 8.910 8.421 0.489 25447
5390 1 13 . 1 1 71 71 SER N N 71 117.670 117.670 114.342 3.328 25447
5391 1 13 . 1 1 71 71 SER HA H 71 4.330 4.330 4.194 0.136 25447
5392 1 13 . 1 1 71 71 SER CA C 71 62.287 62.287 61.437 0.850 25447
5393 1 13 . 1 1 71 71 SER CB C 71 63.278 63.278 62.666 0.612 25447
5394 1 13 . 1 1 71 71 SER H H 71 8.518 8.518 7.452 1.066 25447
5395 1 13 . 1 1 72 72 ILE N N 72 127.447 127.447 122.515 4.932 25447
5396 1 13 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.678 0.232 25447
5397 1 13 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.045 1.766 25447
5398 1 13 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.539 0.858 25447
5399 1 13 . 1 1 72 72 ILE H H 72 8.762 8.762 7.476 1.286 25447
5400 1 13 . 1 1 73 73 ASP N N 73 121.636 121.636 120.181 1.455 25447
5401 1 13 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.350 -0.337 25447
5402 1 13 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.396 1.752 25447
5403 1 13 . 1 1 73 73 ASP CB C 73 43.540 43.540 39.749 3.791 25447
5404 1 13 . 1 1 73 73 ASP H H 73 8.677 8.677 8.449 0.228 25447
5405 1 13 . 1 1 74 74 ALA N N 74 118.793 118.793 122.988 -4.195 25447
5406 1 13 . 1 1 74 74 ALA HA H 74 4.044 4.044 4.043 0.001 25447
5407 1 13 . 1 1 74 74 ALA CA C 74 55.321 55.321 55.163 0.157 25447
5408 1 13 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.680 -0.735 25447
5409 1 13 . 1 1 74 74 ALA H H 74 8.005 8.005 7.636 0.369 25447
5410 1 13 . 1 1 75 75 PHE N N 75 121.235 121.235 119.570 1.665 25447
5411 1 13 . 1 1 75 75 PHE HA H 75 4.038 4.038 4.068 -0.030 25447
5412 1 13 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.538 -0.523 25447
5413 1 13 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.448 -0.611 25447
5414 1 13 . 1 1 75 75 PHE H H 75 8.353 8.353 8.142 0.211 25447
5415 1 13 . 1 1 76 76 VAL N N 76 120.866 120.866 118.309 2.557 25447
5416 1 13 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.336 -0.393 25447
5417 1 13 . 1 1 76 76 VAL CA C 76 66.901 66.901 66.795 0.106 25447
5418 1 13 . 1 1 76 76 VAL CB C 76 31.247 31.247 31.157 0.090 25447
5419 1 13 . 1 1 76 76 VAL H H 76 8.544 8.544 8.440 0.104 25447
5420 1 13 . 1 1 77 77 VAL N N 77 121.408 121.408 120.953 0.455 25447
5421 1 13 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.683 -0.188 25447
5422 1 13 . 1 1 77 77 VAL CA C 77 66.833 66.833 66.708 0.125 25447
5423 1 13 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.669 0.261 25447
5424 1 13 . 1 1 77 77 VAL H H 77 8.708 8.708 8.304 0.404 25447
5425 1 13 . 1 1 78 78 GLY N N 78 106.402 106.402 105.597 0.805 25447
5426 1 13 . 1 1 78 78 GLY CA C 78 46.840 46.840 46.426 0.414 25447
5427 1 13 . 1 1 78 78 GLY H H 78 7.945 7.945 8.050 -0.105 25447
5428 1 13 . 1 1 79 79 ALA N N 79 121.146 121.146 121.809 -0.663 25447
5429 1 13 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.957 0.250 25447
5430 1 13 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.190 -1.261 25447
5431 1 13 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.673 0.588 25447
5432 1 13 . 1 1 79 79 ALA H H 79 7.639 7.639 7.190 0.449 25447
5433 1 13 . 1 1 80 80 THR N N 80 107.668 107.668 107.293 0.375 25447
5434 1 13 . 1 1 80 80 THR HA H 80 4.443 4.443 4.465 -0.022 25447
5435 1 13 . 1 1 80 80 THR CA C 80 61.406 61.406 62.322 -0.916 25447
5436 1 13 . 1 1 80 80 THR CB C 80 70.767 70.767 70.907 -0.140 25447
5437 1 13 . 1 1 80 80 THR H H 80 7.449 7.449 7.791 -0.342 25447
5438 1 13 . 1 1 81 81 THR N N 81 119.953 119.953 118.125 1.828 25447
5439 1 13 . 1 1 81 81 THR HA H 81 4.665 4.665 4.871 -0.206 25447
5440 1 13 . 1 1 81 81 THR CA C 81 60.412 60.412 59.272 1.140 25447
5441 1 13 . 1 1 81 81 THR CB C 81 70.113 70.113 69.477 0.636 25447
5442 1 13 . 1 1 81 81 THR H H 81 7.685 7.685 8.159 -0.474 25447
5443 1 13 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.454 0.235 25447
5444 1 13 . 1 1 82 82 PRO CA C 82 61.688 61.688 61.726 -0.038 25447
5445 1 13 . 1 1 82 82 PRO CB C 82 30.969 30.969 30.928 0.041 25447
5446 1 13 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.466 0.015 25447
5447 1 13 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.465 0.466 25447
5448 1 13 . 1 1 83 83 PRO CB C 83 32.193 32.193 32.335 -0.142 25447
5449 1 13 . 1 1 84 84 VAL N N 84 120.691 120.691 121.085 -0.394 25447
5450 1 13 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.156 -0.063 25447
5451 1 13 . 1 1 84 84 VAL CA C 84 62.339 62.339 61.473 0.866 25447
5452 1 13 . 1 1 84 84 VAL CB C 84 32.851 32.851 33.146 -0.295 25447
5453 1 13 . 1 1 84 84 VAL H H 84 8.257 8.257 8.142 0.115 25447
5454 1 13 . 1 1 85 85 GLU N N 85 127.655 127.655 122.819 4.836 25447
5455 1 13 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.902 0.382 25447
5456 1 13 . 1 1 85 85 GLU CA C 85 56.754 56.754 56.379 0.376 25447
5457 1 13 . 1 1 85 85 GLU CB C 85 30.559 30.559 27.626 2.933 25447
5458 1 13 . 1 1 85 85 GLU H H 85 8.202 8.202 8.771 -0.569 25447
5459 1 13 . 1 1 86 86 ALA N N 86 126.437 126.437 120.527 5.910 25447
5460 1 13 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.104 -0.053 25447
5461 1 13 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.706 -0.558 25447
5462 1 13 . 1 1 86 86 ALA CB C 86 19.460 19.460 19.717 -0.257 25447
5463 1 13 . 1 1 86 86 ALA H H 86 8.323 8.323 8.032 0.291 25447
5464 1 13 . 1 1 87 87 LYS N N 87 121.796 121.796 122.214 -0.418 25447
5465 1 13 . 1 1 87 87 LYS HA H 87 4.347 4.347 4.205 0.142 25447
5466 1 13 . 1 1 87 87 LYS CA C 87 56.297 56.297 56.431 -0.134 25447
5467 1 13 . 1 1 87 87 LYS CB C 87 33.276 33.276 32.840 0.437 25447
5468 1 13 . 1 1 87 87 LYS H H 87 8.333 8.333 8.346 -0.013 25447
5469 1 13 . 1 1 88 88 LEU N N 88 125.576 125.576 120.015 5.561 25447
5470 1 13 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.066 -0.159 25447
5471 1 13 . 1 1 88 88 LEU CA C 88 55.772 55.772 55.160 0.612 25447
5472 1 13 . 1 1 88 88 LEU CB C 88 42.472 42.472 40.295 2.177 25447
5473 1 13 . 1 1 88 88 LEU H H 88 8.444 8.444 8.602 -0.158 25447
5474 1 14 . 1 1 1 1 MET N N 1 120.668 120.668 116.082 4.586 25447
5475 1 14 . 1 1 1 1 MET HA H 1 4.484 4.484 4.588 -0.104 25447
5476 1 14 . 1 1 1 1 MET CA C 1 55.257 55.257 55.364 -0.107 25447
5477 1 14 . 1 1 1 1 MET CB C 1 34.517 34.517 32.952 1.565 25447
5478 1 14 . 1 1 1 1 MET H H 1 8.313 8.313 7.643 0.670 25447
5479 1 14 . 1 1 2 2 GLN N N 2 123.739 123.739 116.643 7.096 25447
5480 1 14 . 1 1 2 2 GLN HA H 2 4.030 4.030 4.292 -0.262 25447
5481 1 14 . 1 1 2 2 GLN CA C 2 57.874 57.874 56.900 0.974 25447
5482 1 14 . 1 1 2 2 GLN CB C 2 29.938 29.938 30.030 -0.092 25447
5483 1 14 . 1 1 2 2 GLN H H 2 9.455 9.455 8.463 0.992 25447
5484 1 14 . 1 1 3 3 HIS N N 3 119.115 119.115 117.904 1.211 25447
5485 1 14 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.911 0.205 25447
5486 1 14 . 1 1 3 3 HIS CA C 3 55.494 55.494 55.200 0.294 25447
5487 1 14 . 1 1 3 3 HIS CB C 3 31.015 31.015 30.300 0.715 25447
5488 1 14 . 1 1 3 3 HIS H H 3 9.783 9.783 8.450 1.333 25447
5489 1 14 . 1 1 4 4 ALA N N 4 122.648 122.648 124.370 -1.722 25447
5490 1 14 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.068 -0.165 25447
5491 1 14 . 1 1 4 4 ALA CA C 4 56.479 56.479 55.714 0.765 25447
5492 1 14 . 1 1 4 4 ALA CB C 4 19.194 19.194 18.257 0.937 25447
5493 1 14 . 1 1 4 4 ALA H H 4 7.551 7.551 7.857 -0.306 25447
5494 1 14 . 1 1 5 5 SER N N 5 112.599 112.599 113.466 -0.867 25447
5495 1 14 . 1 1 5 5 SER HA H 5 4.298 4.298 4.192 0.105 25447
5496 1 14 . 1 1 5 5 SER CA C 5 62.117 62.117 61.773 0.344 25447
5497 1 14 . 1 1 5 5 SER CB C 5 62.334 62.334 62.792 -0.458 25447
5498 1 14 . 1 1 5 5 SER H H 5 8.736 8.736 8.435 0.301 25447
5499 1 14 . 1 1 6 6 VAL N N 6 122.866 122.866 122.577 0.289 25447
5500 1 14 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.809 0.296 25447
5501 1 14 . 1 1 6 6 VAL CA C 6 65.732 65.732 66.471 -0.739 25447
5502 1 14 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.659 1.078 25447
5503 1 14 . 1 1 6 6 VAL H H 6 7.660 7.660 7.488 0.172 25447
5504 1 14 . 1 1 7 7 ILE N N 7 121.715 121.715 120.006 1.709 25447
5505 1 14 . 1 1 7 7 ILE HA H 7 4.224 4.224 4.189 0.035 25447
5506 1 14 . 1 1 7 7 ILE CA C 7 65.329 65.329 65.840 -0.510 25447
5507 1 14 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.538 1.155 25447
5508 1 14 . 1 1 7 7 ILE H H 7 8.519 8.519 8.031 0.488 25447
5509 1 14 . 1 1 8 8 ALA N N 8 121.373 121.373 121.700 -0.327 25447
5510 1 14 . 1 1 8 8 ALA HA H 8 3.895 3.895 4.030 -0.135 25447
5511 1 14 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.391 0.866 25447
5512 1 14 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.050 0.590 25447
5513 1 14 . 1 1 8 8 ALA H H 8 8.940 8.940 7.960 0.980 25447
5514 1 14 . 1 1 9 9 GLN N N 9 115.076 115.076 118.482 -3.406 25447
5515 1 14 . 1 1 9 9 GLN HA H 9 3.870 3.870 3.936 -0.066 25447
5516 1 14 . 1 1 9 9 GLN CA C 9 59.192 59.192 58.906 0.286 25447
5517 1 14 . 1 1 9 9 GLN CB C 9 28.138 28.138 28.664 -0.526 25447
5518 1 14 . 1 1 9 9 GLN H H 9 7.729 7.729 7.807 -0.078 25447
5519 1 14 . 1 1 10 10 PHE N N 10 120.207 120.207 120.031 0.176 25447
5520 1 14 . 1 1 10 10 PHE HA H 10 4.085 4.085 3.907 0.178 25447
5521 1 14 . 1 1 10 10 PHE CA C 10 60.893 60.893 61.946 -1.053 25447
5522 1 14 . 1 1 10 10 PHE CB C 10 38.932 38.932 38.083 0.849 25447
5523 1 14 . 1 1 10 10 PHE H H 10 7.301 7.301 7.923 -0.622 25447
5524 1 14 . 1 1 11 11 VAL N N 11 117.569 117.569 120.519 -2.950 25447
5525 1 14 . 1 1 11 11 VAL HA H 11 3.307 3.307 3.934 -0.627 25447
5526 1 14 . 1 1 11 11 VAL CA C 11 66.508 66.508 65.992 0.516 25447
5527 1 14 . 1 1 11 11 VAL CB C 11 31.487 31.487 31.959 -0.472 25447
5528 1 14 . 1 1 11 11 VAL H H 11 8.370 8.370 7.836 0.534 25447
5529 1 14 . 1 1 12 12 VAL N N 12 117.909 117.909 119.729 -1.820 25447
5530 1 14 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.534 0.207 25447
5531 1 14 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.673 -0.797 25447
5532 1 14 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.763 -0.451 25447
5533 1 14 . 1 1 12 12 VAL H H 12 8.294 8.294 7.660 0.634 25447
5534 1 14 . 1 1 13 13 GLU N N 13 117.918 117.918 118.212 -0.294 25447
5535 1 14 . 1 1 13 13 GLU HA H 13 3.742 3.742 3.974 -0.232 25447
5536 1 14 . 1 1 13 13 GLU CA C 13 59.307 59.307 58.410 0.897 25447
5537 1 14 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.169 0.320 25447
5538 1 14 . 1 1 13 13 GLU H H 13 7.750 7.750 8.134 -0.384 25447
5539 1 14 . 1 1 14 14 GLU N N 14 113.478 113.478 117.961 -4.483 25447
5540 1 14 . 1 1 14 14 GLU HA H 14 3.778 3.778 4.124 -0.346 25447
5541 1 14 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.761 -1.961 25447
5542 1 14 . 1 1 14 14 GLU CB C 14 29.643 29.643 30.246 -0.603 25447
5543 1 14 . 1 1 14 14 GLU H H 14 7.603 7.603 8.191 -0.588 25447
5544 1 14 . 1 1 15 15 PHE N N 15 114.193 114.193 115.189 -0.996 25447
5545 1 14 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.583 0.356 25447
5546 1 14 . 1 1 15 15 PHE CA C 15 58.095 58.095 58.413 -0.317 25447
5547 1 14 . 1 1 15 15 PHE CB C 15 42.095 42.095 42.266 -0.171 25447
5548 1 14 . 1 1 15 15 PHE H H 15 7.908 7.908 7.554 0.354 25447
5549 1 14 . 1 1 16 16 LEU N N 16 121.492 121.492 121.864 -0.372 25447
5550 1 14 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.810 0.157 25447
5551 1 14 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.217 0.160 25447
5552 1 14 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.355 1.379 25447
5553 1 14 . 1 1 16 16 LEU H H 16 8.015 8.015 7.997 0.018 25447
5554 1 14 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.431 -0.048 25447
5555 1 14 . 1 1 17 17 PRO CA C 17 64.858 64.858 63.841 1.017 25447
5556 1 14 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.840 -0.011 25447
5557 1 14 . 1 1 18 18 ASP N N 18 116.508 116.508 118.176 -1.668 25447
5558 1 14 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.682 -0.114 25447
5559 1 14 . 1 1 18 18 ASP CA C 18 54.688 54.688 54.139 0.549 25447
5560 1 14 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.588 0.038 25447
5561 1 14 . 1 1 18 18 ASP H H 18 8.399 8.399 8.562 -0.163 25447
5562 1 14 . 1 1 19 19 VAL N N 19 122.135 122.135 120.585 1.550 25447
5563 1 14 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.155 -0.037 25447
5564 1 14 . 1 1 19 19 VAL CA C 19 61.293 61.293 60.285 1.008 25447
5565 1 14 . 1 1 19 19 VAL CB C 19 33.582 33.582 33.107 0.475 25447
5566 1 14 . 1 1 19 19 VAL H H 19 7.760 7.760 7.264 0.496 25447
5567 1 14 . 1 1 20 20 ALA N N 20 129.301 129.301 130.828 -1.527 25447
5568 1 14 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.505 0.094 25447
5569 1 14 . 1 1 20 20 ALA CA C 20 50.270 50.270 50.285 -0.014 25447
5570 1 14 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.297 -0.869 25447
5571 1 14 . 1 1 20 20 ALA H H 20 8.761 8.761 8.392 0.369 25447
5572 1 14 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.155 -0.078 25447
5573 1 14 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.450 0.754 25447
5574 1 14 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.778 -0.370 25447
5575 1 14 . 1 1 22 22 ALA N N 22 116.106 116.106 117.744 -1.638 25447
5576 1 14 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.133 -0.016 25447
5577 1 14 . 1 1 22 22 ALA CA C 22 53.996 53.996 54.113 -0.117 25447
5578 1 14 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.205 0.639 25447
5579 1 14 . 1 1 22 22 ALA H H 22 8.064 8.064 7.915 0.149 25447
5580 1 14 . 1 1 23 23 ASP N N 23 115.541 115.541 117.831 -2.290 25447
5581 1 14 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.638 0.039 25447
5582 1 14 . 1 1 23 23 ASP CA C 23 54.336 54.336 54.032 0.304 25447
5583 1 14 . 1 1 23 23 ASP CB C 23 41.353 41.353 41.111 0.242 25447
5584 1 14 . 1 1 23 23 ASP H H 23 8.003 8.003 8.203 -0.200 25447
5585 1 14 . 1 1 24 24 VAL N N 24 121.517 121.517 120.741 0.776 25447
5586 1 14 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.182 -0.361 25447
5587 1 14 . 1 1 24 24 VAL CA C 24 62.345 62.345 61.567 0.778 25447
5588 1 14 . 1 1 24 24 VAL CB C 24 31.733 31.733 33.491 -1.758 25447
5589 1 14 . 1 1 24 24 VAL H H 24 7.069 7.069 7.449 -0.380 25447
5590 1 14 . 1 1 25 25 ASP N N 25 129.329 129.329 126.804 2.525 25447
5591 1 14 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.822 -0.248 25447
5592 1 14 . 1 1 25 25 ASP CA C 25 54.566 54.566 53.670 0.896 25447
5593 1 14 . 1 1 25 25 ASP CB C 25 42.333 42.333 41.645 0.688 25447
5594 1 14 . 1 1 25 25 ASP H H 25 8.474 8.474 8.694 -0.220 25447
5595 1 14 . 1 1 26 26 VAL N N 26 121.920 121.920 118.712 3.208 25447
5596 1 14 . 1 1 26 26 VAL HA H 26 4.108 4.108 3.953 0.155 25447
5597 1 14 . 1 1 26 26 VAL CA C 26 64.518 64.518 63.799 0.719 25447
5598 1 14 . 1 1 26 26 VAL CB C 26 31.198 31.198 32.221 -1.023 25447
5599 1 14 . 1 1 26 26 VAL H H 26 8.591 8.591 8.356 0.235 25447
5600 1 14 . 1 1 27 27 ASP N N 27 116.286 116.286 118.282 -1.996 25447
5601 1 14 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.642 0.503 25447
5602 1 14 . 1 1 27 27 ASP CA C 27 54.181 54.181 54.357 -0.176 25447
5603 1 14 . 1 1 27 27 ASP CB C 27 42.575 42.575 40.734 1.841 25447
5604 1 14 . 1 1 27 27 ASP H H 27 8.609 8.609 7.955 0.654 25447
5605 1 14 . 1 1 28 28 LEU N N 28 125.116 125.116 121.771 3.345 25447
5606 1 14 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.500 -0.489 25447
5607 1 14 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.388 1.699 25447
5608 1 14 . 1 1 28 28 LEU CB C 28 43.321 43.321 43.896 -0.575 25447
5609 1 14 . 1 1 28 28 LEU H H 28 7.374 7.374 7.348 0.026 25447
5610 1 14 . 1 1 29 29 ASP N N 29 125.924 125.924 124.575 1.349 25447
5611 1 14 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.583 0.251 25447
5612 1 14 . 1 1 29 29 ASP CA C 29 53.920 53.920 55.222 -1.302 25447
5613 1 14 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.315 0.064 25447
5614 1 14 . 1 1 29 29 ASP H H 29 8.699 8.699 8.683 0.016 25447
5615 1 14 . 1 1 30 30 LEU N N 30 129.975 129.975 124.409 5.566 25447
5616 1 14 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.235 -0.318 25447
5617 1 14 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.285 -0.897 25447
5618 1 14 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.512 -0.273 25447
5619 1 14 . 1 1 30 30 LEU H H 30 9.718 9.718 8.262 1.456 25447
5620 1 14 . 1 1 31 31 VAL N N 31 121.212 121.212 115.255 5.957 25447
5621 1 14 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.755 0.438 25447
5622 1 14 . 1 1 31 31 VAL CA C 31 64.433 64.433 65.299 -0.866 25447
5623 1 14 . 1 1 31 31 VAL CB C 31 32.175 32.175 30.723 1.452 25447
5624 1 14 . 1 1 31 31 VAL H H 31 8.163 8.163 7.515 0.648 25447
5625 1 14 . 1 1 32 32 ASP N N 32 124.893 124.893 119.496 5.397 25447
5626 1 14 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.336 0.022 25447
5627 1 14 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.725 0.500 25447
5628 1 14 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.004 0.731 25447
5629 1 14 . 1 1 32 32 ASP H H 32 9.385 9.385 8.743 0.642 25447
5630 1 14 . 1 1 33 33 ASN N N 33 111.484 111.484 116.375 -4.891 25447
5631 1 14 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.593 0.127 25447
5632 1 14 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.657 0.229 25447
5633 1 14 . 1 1 33 33 ASN CB C 33 39.006 39.006 38.957 0.049 25447
5634 1 14 . 1 1 33 33 ASN H H 33 7.396 7.396 7.586 -0.190 25447
5635 1 14 . 1 1 34 34 GLY N N 34 106.957 106.957 105.773 1.184 25447
5636 1 14 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.770 0.837 25447
5637 1 14 . 1 1 34 34 GLY H H 34 7.618 7.618 7.957 -0.339 25447
5638 1 14 . 1 1 35 35 VAL N N 35 120.424 120.424 118.693 1.731 25447
5639 1 14 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.549 0.217 25447
5640 1 14 . 1 1 35 35 VAL CA C 35 65.125 65.125 64.676 0.449 25447
5641 1 14 . 1 1 35 35 VAL CB C 35 31.879 31.879 32.052 -0.173 25447
5642 1 14 . 1 1 35 35 VAL H H 35 7.792 7.792 7.745 0.047 25447
5643 1 14 . 1 1 36 36 ILE N N 36 116.364 116.364 120.244 -3.880 25447
5644 1 14 . 1 1 36 36 ILE HA H 36 3.737 3.737 3.869 -0.132 25447
5645 1 14 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.942 -1.257 25447
5646 1 14 . 1 1 36 36 ILE CB C 36 38.807 38.807 37.192 1.615 25447
5647 1 14 . 1 1 36 36 ILE H H 36 7.331 7.331 7.984 -0.653 25447
5648 1 14 . 1 1 37 37 ASP N N 37 127.306 127.306 127.977 -0.671 25447
5649 1 14 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.812 -0.148 25447
5650 1 14 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.920 -1.304 25447
5651 1 14 . 1 1 37 37 ASP CB C 37 41.209 41.209 42.568 -1.359 25447
5652 1 14 . 1 1 37 37 ASP H H 37 7.874 7.874 7.879 -0.005 25447
5653 1 14 . 1 1 38 38 ALA N N 38 120.352 120.352 122.572 -2.220 25447
5654 1 14 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.088 -0.093 25447
5655 1 14 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.316 0.976 25447
5656 1 14 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.617 -0.305 25447
5657 1 14 . 1 1 38 38 ALA H H 38 8.244 8.244 8.309 -0.065 25447
5658 1 14 . 1 1 39 39 LEU N N 39 117.438 117.438 119.450 -2.012 25447
5659 1 14 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.232 0.018 25447
5660 1 14 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.484 -0.130 25447
5661 1 14 . 1 1 39 39 LEU CB C 39 41.236 41.236 40.977 0.259 25447
5662 1 14 . 1 1 39 39 LEU H H 39 7.688 7.688 8.350 -0.662 25447
5663 1 14 . 1 1 40 40 GLY N N 40 112.015 112.015 107.229 4.786 25447
5664 1 14 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.201 0.898 25447
5665 1 14 . 1 1 40 40 GLY H H 40 8.732 8.732 8.306 0.426 25447
5666 1 14 . 1 1 41 41 LEU N N 41 122.983 122.983 123.341 -0.358 25447
5667 1 14 . 1 1 41 41 LEU HA H 41 3.851 3.851 4.073 -0.222 25447
5668 1 14 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.620 0.712 25447
5669 1 14 . 1 1 41 41 LEU CB C 41 41.639 41.639 41.945 -0.306 25447
5670 1 14 . 1 1 41 41 LEU H H 41 8.548 8.548 7.990 0.558 25447
5671 1 14 . 1 1 42 42 LEU N N 42 116.076 116.076 119.936 -3.860 25447
5672 1 14 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.882 0.146 25447
5673 1 14 . 1 1 42 42 LEU CA C 42 58.064 58.064 58.531 -0.466 25447
5674 1 14 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.813 -0.874 25447
5675 1 14 . 1 1 42 42 LEU H H 42 7.168 7.168 7.632 -0.464 25447
5676 1 14 . 1 1 43 43 LYS N N 43 119.831 119.831 119.075 0.756 25447
5677 1 14 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.063 0.221 25447
5678 1 14 . 1 1 43 43 LYS CA C 43 59.644 59.644 59.868 -0.224 25447
5679 1 14 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.322 0.206 25447
5680 1 14 . 1 1 43 43 LYS H H 43 7.640 7.640 8.306 -0.666 25447
5681 1 14 . 1 1 44 44 VAL N N 44 121.046 121.046 120.180 0.866 25447
5682 1 14 . 1 1 44 44 VAL HA H 44 3.949 3.949 4.056 -0.107 25447
5683 1 14 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.616 0.028 25447
5684 1 14 . 1 1 44 44 VAL H H 44 8.269 8.269 7.890 0.379 25447
5685 1 14 . 1 1 45 45 ILE N N 45 119.333 119.333 119.712 -0.379 25447
5686 1 14 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.596 -0.192 25447
5687 1 14 . 1 1 45 45 ILE CA C 45 66.148 66.148 64.680 1.468 25447
5688 1 14 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.156 1.121 25447
5689 1 14 . 1 1 45 45 ILE H H 45 8.145 8.145 7.781 0.364 25447
5690 1 14 . 1 1 46 46 ALA N N 46 121.213 121.213 123.385 -2.172 25447
5691 1 14 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.099 0.158 25447
5692 1 14 . 1 1 46 46 ALA CA C 46 55.164 55.164 55.173 -0.009 25447
5693 1 14 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.393 -0.025 25447
5694 1 14 . 1 1 46 46 ALA H H 46 7.792 7.792 8.052 -0.260 25447
5695 1 14 . 1 1 47 47 TRP N N 47 121.416 121.416 120.030 1.386 25447
5696 1 14 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.445 -0.211 25447
5697 1 14 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.505 2.165 25447
5698 1 14 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.398 -1.159 25447
5699 1 14 . 1 1 47 47 TRP H H 47 8.093 8.093 7.987 0.106 25447
5700 1 14 . 1 1 48 48 LEU N N 48 118.963 118.963 121.111 -2.148 25447
5701 1 14 . 1 1 48 48 LEU HA H 48 3.586 3.586 2.772 0.814 25447
5702 1 14 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.584 0.611 25447
5703 1 14 . 1 1 48 48 LEU CB C 48 42.251 42.251 41.139 1.112 25447
5704 1 14 . 1 1 48 48 LEU H H 48 8.693 8.693 7.336 1.357 25447
5705 1 14 . 1 1 49 49 GLU N N 49 119.131 119.131 117.374 1.757 25447
5706 1 14 . 1 1 49 49 GLU HA H 49 4.050 4.050 3.975 0.075 25447
5707 1 14 . 1 1 49 49 GLU CA C 49 59.862 59.862 58.916 0.946 25447
5708 1 14 . 1 1 49 49 GLU CB C 49 29.586 29.586 28.728 0.858 25447
5709 1 14 . 1 1 49 49 GLU H H 49 7.771 7.771 7.779 -0.008 25447
5710 1 14 . 1 1 50 50 ASP N N 50 119.941 119.941 120.407 -0.466 25447
5711 1 14 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.415 -0.178 25447
5712 1 14 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.472 0.883 25447
5713 1 14 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.758 1.625 25447
5714 1 14 . 1 1 50 50 ASP H H 50 7.697 7.697 7.571 0.126 25447
5715 1 14 . 1 1 51 51 ARG N N 51 116.911 116.911 117.928 -1.017 25447
5716 1 14 . 1 1 51 51 ARG HA H 51 3.736 3.736 4.006 -0.270 25447
5717 1 14 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.359 -1.995 25447
5718 1 14 . 1 1 51 51 ARG CB C 51 29.315 29.315 30.224 -0.909 25447
5719 1 14 . 1 1 51 51 ARG H H 51 8.881 8.881 7.746 1.135 25447
5720 1 14 . 1 1 52 52 PHE N N 52 112.328 112.328 116.534 -4.206 25447
5721 1 14 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.613 0.062 25447
5722 1 14 . 1 1 52 52 PHE CA C 52 57.413 57.413 58.014 -0.601 25447
5723 1 14 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.332 1.560 25447
5724 1 14 . 1 1 52 52 PHE H H 52 7.284 7.284 7.524 -0.240 25447
5725 1 14 . 1 1 53 53 GLY N N 53 109.826 109.826 108.736 1.090 25447
5726 1 14 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.585 1.216 25447
5727 1 14 . 1 1 53 53 GLY H H 53 7.427 7.427 7.874 -0.447 25447
5728 1 14 . 1 1 54 54 ILE N N 54 119.127 119.127 115.310 3.817 25447
5729 1 14 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.510 -0.559 25447
5730 1 14 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.319 1.366 25447
5731 1 14 . 1 1 54 54 ILE CB C 54 39.490 39.490 39.694 -0.204 25447
5732 1 14 . 1 1 54 54 ILE H H 54 6.876 6.876 7.542 -0.666 25447
5733 1 14 . 1 1 55 55 ALA N N 55 129.823 129.823 124.583 5.240 25447
5734 1 14 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.615 -0.201 25447
5735 1 14 . 1 1 55 55 ALA CA C 55 51.610 51.610 50.348 1.262 25447
5736 1 14 . 1 1 55 55 ALA CB C 55 19.262 19.262 20.379 -1.117 25447
5737 1 14 . 1 1 55 55 ALA H H 55 8.499 8.499 8.484 0.015 25447
5738 1 14 . 1 1 56 56 ALA N N 56 126.300 126.300 126.750 -0.450 25447
5739 1 14 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.034 0.235 25447
5740 1 14 . 1 1 56 56 ALA CA C 56 53.474 53.474 54.279 -0.805 25447
5741 1 14 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.472 0.772 25447
5742 1 14 . 1 1 56 56 ALA H H 56 8.641 8.641 8.866 -0.225 25447
5743 1 14 . 1 1 57 57 ASP N N 57 116.395 116.395 117.962 -1.567 25447
5744 1 14 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.352 0.127 25447
5745 1 14 . 1 1 57 57 ASP CA C 57 55.226 55.226 56.330 -1.104 25447
5746 1 14 . 1 1 57 57 ASP CB C 57 40.922 40.922 40.450 0.472 25447
5747 1 14 . 1 1 57 57 ASP H H 57 8.337 8.337 8.543 -0.206 25447
5748 1 14 . 1 1 58 58 ASP N N 58 118.557 118.557 118.024 0.533 25447
5749 1 14 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.403 0.233 25447
5750 1 14 . 1 1 58 58 ASP CA C 58 55.144 55.144 55.424 -0.280 25447
5751 1 14 . 1 1 58 58 ASP CB C 58 41.504 41.504 40.941 0.563 25447
5752 1 14 . 1 1 58 58 ASP H H 58 8.027 8.027 7.907 0.120 25447
5753 1 14 . 1 1 59 59 VAL N N 59 118.898 118.898 119.182 -0.284 25447
5754 1 14 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.245 -0.069 25447
5755 1 14 . 1 1 59 59 VAL CA C 59 62.300 62.300 60.945 1.355 25447
5756 1 14 . 1 1 59 59 VAL CB C 59 33.078 33.078 34.948 -1.870 25447
5757 1 14 . 1 1 59 59 VAL H H 59 7.716 7.716 7.490 0.226 25447
5758 1 14 . 1 1 60 60 GLU N N 60 122.888 122.888 125.431 -2.543 25447
5759 1 14 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.401 -0.117 25447
5760 1 14 . 1 1 60 60 GLU CA C 60 56.546 56.546 56.137 0.409 25447
5761 1 14 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.544 -0.762 25447
5762 1 14 . 1 1 60 60 GLU H H 60 8.367 8.367 8.354 0.013 25447
5763 1 14 . 1 1 61 61 LEU N N 61 124.827 124.827 122.947 1.880 25447
5764 1 14 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.407 -0.049 25447
5765 1 14 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.657 0.159 25447
5766 1 14 . 1 1 61 61 LEU CB C 61 41.937 41.937 42.790 -0.853 25447
5767 1 14 . 1 1 61 61 LEU H H 61 8.198 8.198 8.317 -0.119 25447
5768 1 14 . 1 1 62 62 SER N N 62 118.715 118.715 119.209 -0.494 25447
5769 1 14 . 1 1 62 62 SER HA H 62 4.809 4.809 5.026 -0.217 25447
5770 1 14 . 1 1 62 62 SER CA C 62 55.732 55.732 54.800 0.932 25447
5771 1 14 . 1 1 62 62 SER CB C 62 64.017 64.017 65.136 -1.119 25447
5772 1 14 . 1 1 62 62 SER H H 62 8.137 8.137 8.317 -0.180 25447
5773 1 14 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.317 -0.064 25447
5774 1 14 . 1 1 63 63 PRO CA C 63 64.896 64.896 65.289 -0.393 25447
5775 1 14 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.809 0.243 25447
5776 1 14 . 1 1 64 64 GLU N N 64 116.554 116.554 119.019 -2.465 25447
5777 1 14 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.143 -0.270 25447
5778 1 14 . 1 1 64 64 GLU CA C 64 58.719 58.719 58.806 -0.087 25447
5779 1 14 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.230 -0.549 25447
5780 1 14 . 1 1 64 64 GLU H H 64 8.316 8.316 8.479 -0.163 25447
5781 1 14 . 1 1 65 65 HIS N N 65 115.487 115.487 119.810 -4.323 25447
5782 1 14 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.147 0.133 25447
5783 1 14 . 1 1 65 65 HIS CA C 65 57.652 57.652 58.035 -0.383 25447
5784 1 14 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.380 0.502 25447
5785 1 14 . 1 1 65 65 HIS H H 65 7.274 7.274 8.302 -1.028 25447
5786 1 14 . 1 1 66 66 PHE N N 66 116.127 116.127 116.375 -0.248 25447
5787 1 14 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.693 0.073 25447
5788 1 14 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.299 -1.517 25447
5789 1 14 . 1 1 66 66 PHE CB C 66 38.908 38.908 37.848 1.060 25447
5790 1 14 . 1 1 66 66 PHE H H 66 7.239 7.239 7.723 -0.484 25447
5791 1 14 . 1 1 67 67 ARG N N 67 112.468 112.468 119.594 -7.126 25447
5792 1 14 . 1 1 67 67 ARG HA H 67 4.085 4.085 4.019 0.066 25447
5793 1 14 . 1 1 67 67 ARG CA C 67 58.287 58.287 59.151 -0.864 25447
5794 1 14 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.518 1.242 25447
5795 1 14 . 1 1 67 67 ARG H H 67 6.628 6.628 7.814 -1.186 25447
5796 1 14 . 1 1 68 68 SER N N 68 109.305 109.305 110.635 -1.330 25447
5797 1 14 . 1 1 68 68 SER HA H 68 4.980 4.980 4.826 0.154 25447
5798 1 14 . 1 1 68 68 SER CA C 68 55.785 55.785 56.881 -1.096 25447
5799 1 14 . 1 1 68 68 SER CB C 68 67.691 67.691 65.918 1.773 25447
5800 1 14 . 1 1 68 68 SER H H 68 8.145 8.145 7.377 0.768 25447
5801 1 14 . 1 1 69 69 ILE N N 69 122.602 122.602 123.425 -0.823 25447
5802 1 14 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.757 -0.081 25447
5803 1 14 . 1 1 69 69 ILE CA C 69 66.754 66.754 65.921 0.833 25447
5804 1 14 . 1 1 69 69 ILE CB C 69 37.296 37.296 37.601 -0.305 25447
5805 1 14 . 1 1 69 69 ILE H H 69 9.775 9.775 9.154 0.621 25447
5806 1 14 . 1 1 70 70 ARG N N 70 118.764 118.764 118.798 -0.034 25447
5807 1 14 . 1 1 70 70 ARG HA H 70 3.955 3.955 3.949 0.006 25447
5808 1 14 . 1 1 70 70 ARG CA C 70 60.533 60.533 59.394 1.139 25447
5809 1 14 . 1 1 70 70 ARG CB C 70 30.418 30.418 29.101 1.317 25447
5810 1 14 . 1 1 70 70 ARG H H 70 8.910 8.910 8.340 0.570 25447
5811 1 14 . 1 1 71 71 SER N N 71 117.670 117.670 115.415 2.255 25447
5812 1 14 . 1 1 71 71 SER HA H 71 4.330 4.330 4.253 0.077 25447
5813 1 14 . 1 1 71 71 SER CA C 71 62.287 62.287 61.015 1.272 25447
5814 1 14 . 1 1 71 71 SER CB C 71 63.278 63.278 62.772 0.506 25447
5815 1 14 . 1 1 71 71 SER H H 71 8.518 8.518 7.452 1.066 25447
5816 1 14 . 1 1 72 72 ILE N N 72 127.447 127.447 122.997 4.450 25447
5817 1 14 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.217 0.693 25447
5818 1 14 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.704 1.107 25447
5819 1 14 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.489 0.909 25447
5820 1 14 . 1 1 72 72 ILE H H 72 8.762 8.762 7.806 0.956 25447
5821 1 14 . 1 1 73 73 ASP N N 73 121.636 121.636 120.044 1.592 25447
5822 1 14 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.347 -0.334 25447
5823 1 14 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.466 1.682 25447
5824 1 14 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.667 2.873 25447
5825 1 14 . 1 1 73 73 ASP H H 73 8.677 8.677 7.966 0.711 25447
5826 1 14 . 1 1 74 74 ALA N N 74 118.793 118.793 121.904 -3.111 25447
5827 1 14 . 1 1 74 74 ALA HA H 74 4.044 4.044 4.077 -0.033 25447
5828 1 14 . 1 1 74 74 ALA CA C 74 55.321 55.321 54.899 0.422 25447
5829 1 14 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.360 -0.415 25447
5830 1 14 . 1 1 74 74 ALA H H 74 8.005 8.005 7.663 0.342 25447
5831 1 14 . 1 1 75 75 PHE N N 75 121.235 121.235 120.093 1.142 25447
5832 1 14 . 1 1 75 75 PHE HA H 75 4.038 4.038 4.045 -0.007 25447
5833 1 14 . 1 1 75 75 PHE CA C 75 61.015 61.015 62.029 -1.014 25447
5834 1 14 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.379 -0.542 25447
5835 1 14 . 1 1 75 75 PHE H H 75 8.353 8.353 8.420 -0.067 25447
5836 1 14 . 1 1 76 76 VAL N N 76 120.866 120.866 119.017 1.849 25447
5837 1 14 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.525 -0.582 25447
5838 1 14 . 1 1 76 76 VAL CA C 76 66.901 66.901 65.976 0.925 25447
5839 1 14 . 1 1 76 76 VAL CB C 76 31.247 31.247 30.904 0.343 25447
5840 1 14 . 1 1 76 76 VAL H H 76 8.544 8.544 8.356 0.188 25447
5841 1 14 . 1 1 77 77 VAL N N 77 121.408 121.408 119.389 2.019 25447
5842 1 14 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.691 -0.196 25447
5843 1 14 . 1 1 77 77 VAL CA C 77 66.833 66.833 66.441 0.392 25447
5844 1 14 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.051 0.879 25447
5845 1 14 . 1 1 77 77 VAL H H 77 8.708 8.708 8.393 0.315 25447
5846 1 14 . 1 1 78 78 GLY N N 78 106.402 106.402 107.148 -0.746 25447
5847 1 14 . 1 1 78 78 GLY CA C 78 46.840 46.840 47.049 -0.209 25447
5848 1 14 . 1 1 78 78 GLY H H 78 7.945 7.945 8.598 -0.653 25447
5849 1 14 . 1 1 79 79 ALA N N 79 121.146 121.146 122.429 -1.283 25447
5850 1 14 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.977 0.230 25447
5851 1 14 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.436 -1.507 25447
5852 1 14 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.316 0.945 25447
5853 1 14 . 1 1 79 79 ALA H H 79 7.639 7.639 7.513 0.126 25447
5854 1 14 . 1 1 80 80 THR N N 80 107.668 107.668 108.040 -0.372 25447
5855 1 14 . 1 1 80 80 THR HA H 80 4.443 4.443 4.184 0.259 25447
5856 1 14 . 1 1 80 80 THR CA C 80 61.406 61.406 63.446 -2.040 25447
5857 1 14 . 1 1 80 80 THR CB C 80 70.767 70.767 69.489 1.278 25447
5858 1 14 . 1 1 80 80 THR H H 80 7.449 7.449 7.495 -0.046 25447
5859 1 14 . 1 1 81 81 THR N N 81 119.953 119.953 116.663 3.290 25447
5860 1 14 . 1 1 81 81 THR HA H 81 4.665 4.665 4.813 -0.148 25447
5861 1 14 . 1 1 81 81 THR CA C 81 60.412 60.412 59.435 0.977 25447
5862 1 14 . 1 1 81 81 THR CB C 81 70.113 70.113 70.417 -0.304 25447
5863 1 14 . 1 1 81 81 THR H H 81 7.685 7.685 7.970 -0.285 25447
5864 1 14 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.434 0.255 25447
5865 1 14 . 1 1 82 82 PRO CA C 82 61.688 61.688 62.504 -0.816 25447
5866 1 14 . 1 1 82 82 PRO CB C 82 30.969 30.969 30.932 0.037 25447
5867 1 14 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.295 0.186 25447
5868 1 14 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.754 0.177 25447
5869 1 14 . 1 1 83 83 PRO CB C 83 32.193 32.193 32.300 -0.107 25447
5870 1 14 . 1 1 84 84 VAL N N 84 120.691 120.691 121.759 -1.068 25447
5871 1 14 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.153 -0.060 25447
5872 1 14 . 1 1 84 84 VAL CA C 84 62.339 62.339 61.118 1.221 25447
5873 1 14 . 1 1 84 84 VAL CB C 84 32.851 32.851 33.438 -0.587 25447
5874 1 14 . 1 1 84 84 VAL H H 84 8.257 8.257 8.038 0.219 25447
5875 1 14 . 1 1 85 85 GLU N N 85 127.655 127.655 125.468 2.187 25447
5876 1 14 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.890 0.394 25447
5877 1 14 . 1 1 85 85 GLU CA C 85 56.754 56.754 56.487 0.267 25447
5878 1 14 . 1 1 85 85 GLU CB C 85 30.559 30.559 27.588 2.971 25447
5879 1 14 . 1 1 85 85 GLU H H 85 8.202 8.202 8.718 -0.516 25447
5880 1 14 . 1 1 86 86 ALA N N 86 126.437 126.437 120.124 6.313 25447
5881 1 14 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.105 -0.054 25447
5882 1 14 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.485 -0.337 25447
5883 1 14 . 1 1 86 86 ALA CB C 86 19.460 19.460 19.631 -0.171 25447
5884 1 14 . 1 1 86 86 ALA H H 86 8.323 8.323 7.889 0.434 25447
5885 1 14 . 1 1 87 87 LYS N N 87 121.796 121.796 120.215 1.581 25447
5886 1 14 . 1 1 87 87 LYS HA H 87 4.347 4.347 4.013 0.334 25447
5887 1 14 . 1 1 87 87 LYS CA C 87 56.297 56.297 57.965 -1.668 25447
5888 1 14 . 1 1 87 87 LYS CB C 87 33.276 33.276 32.529 0.747 25447
5889 1 14 . 1 1 87 87 LYS H H 87 8.333 8.333 8.516 -0.183 25447
5890 1 14 . 1 1 88 88 LEU N N 88 125.576 125.576 120.817 4.759 25447
5891 1 14 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.456 -0.549 25447
5892 1 14 . 1 1 88 88 LEU CA C 88 55.772 55.772 54.189 1.583 25447
5893 1 14 . 1 1 88 88 LEU CB C 88 42.472 42.472 42.383 0.089 25447
5894 1 14 . 1 1 88 88 LEU H H 88 8.444 8.444 7.657 0.787 25447
5895 1 15 . 1 1 1 1 MET N N 1 120.668 120.668 120.970 -0.302 25447
5896 1 15 . 1 1 1 1 MET HA H 1 4.484 4.484 4.154 0.330 25447
5897 1 15 . 1 1 1 1 MET CA C 1 55.257 55.257 57.520 -2.263 25447
5898 1 15 . 1 1 1 1 MET CB C 1 34.517 34.517 33.138 1.379 25447
5899 1 15 . 1 1 1 1 MET H H 1 8.313 8.313 8.467 -0.154 25447
5900 1 15 . 1 1 2 2 GLN N N 2 123.739 123.739 114.103 9.636 25447
5901 1 15 . 1 1 2 2 GLN HA H 2 4.030 4.030 3.724 0.306 25447
5902 1 15 . 1 1 2 2 GLN CA C 2 57.874 57.874 56.351 1.523 25447
5903 1 15 . 1 1 2 2 GLN CB C 2 29.938 29.938 26.979 2.959 25447
5904 1 15 . 1 1 2 2 GLN H H 2 9.455 9.455 8.262 1.193 25447
5905 1 15 . 1 1 3 3 HIS N N 3 119.115 119.115 110.013 9.102 25447
5906 1 15 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.376 0.740 25447
5907 1 15 . 1 1 3 3 HIS CA C 3 55.494 55.494 56.235 -0.741 25447
5908 1 15 . 1 1 3 3 HIS CB C 3 31.015 31.015 27.650 3.365 25447
5909 1 15 . 1 1 3 3 HIS H H 3 9.783 9.783 8.136 1.647 25447
5910 1 15 . 1 1 4 4 ALA N N 4 122.648 122.648 121.851 0.797 25447
5911 1 15 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.177 -0.274 25447
5912 1 15 . 1 1 4 4 ALA CA C 4 56.479 56.479 55.415 1.064 25447
5913 1 15 . 1 1 4 4 ALA CB C 4 19.194 19.194 19.278 -0.084 25447
5914 1 15 . 1 1 4 4 ALA H H 4 7.551 7.551 8.002 -0.451 25447
5915 1 15 . 1 1 5 5 SER N N 5 112.599 112.599 115.137 -2.538 25447
5916 1 15 . 1 1 5 5 SER HA H 5 4.298 4.298 4.214 0.084 25447
5917 1 15 . 1 1 5 5 SER CA C 5 62.117 62.117 61.746 0.371 25447
5918 1 15 . 1 1 5 5 SER CB C 5 62.334 62.334 62.353 -0.019 25447
5919 1 15 . 1 1 5 5 SER H H 5 8.736 8.736 8.409 0.327 25447
5920 1 15 . 1 1 6 6 VAL N N 6 122.866 122.866 122.600 0.266 25447
5921 1 15 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.750 0.355 25447
5922 1 15 . 1 1 6 6 VAL CA C 6 65.732 65.732 66.612 -0.880 25447
5923 1 15 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.873 0.864 25447
5924 1 15 . 1 1 6 6 VAL H H 6 7.660 7.660 7.881 -0.221 25447
5925 1 15 . 1 1 7 7 ILE N N 7 121.715 121.715 119.999 1.716 25447
5926 1 15 . 1 1 7 7 ILE HA H 7 4.224 4.224 3.940 0.284 25447
5927 1 15 . 1 1 7 7 ILE CA C 7 65.329 65.329 65.767 -0.438 25447
5928 1 15 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.579 1.114 25447
5929 1 15 . 1 1 7 7 ILE H H 7 8.519 8.519 7.736 0.783 25447
5930 1 15 . 1 1 8 8 ALA N N 8 121.373 121.373 121.674 -0.301 25447
5931 1 15 . 1 1 8 8 ALA HA H 8 3.895 3.895 4.044 -0.149 25447
5932 1 15 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.421 0.836 25447
5933 1 15 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.144 0.496 25447
5934 1 15 . 1 1 8 8 ALA H H 8 8.940 8.940 7.893 1.047 25447
5935 1 15 . 1 1 9 9 GLN N N 9 115.076 115.076 118.353 -3.277 25447
5936 1 15 . 1 1 9 9 GLN HA H 9 3.870 3.870 3.990 -0.120 25447
5937 1 15 . 1 1 9 9 GLN CA C 9 59.192 59.192 58.885 0.307 25447
5938 1 15 . 1 1 9 9 GLN CB C 9 28.138 28.138 28.719 -0.581 25447
5939 1 15 . 1 1 9 9 GLN H H 9 7.729 7.729 8.216 -0.487 25447
5940 1 15 . 1 1 10 10 PHE N N 10 120.207 120.207 120.769 -0.562 25447
5941 1 15 . 1 1 10 10 PHE HA H 10 4.085 4.085 4.074 0.011 25447
5942 1 15 . 1 1 10 10 PHE CA C 10 60.893 60.893 61.876 -0.983 25447
5943 1 15 . 1 1 10 10 PHE CB C 10 38.932 38.932 39.048 -0.116 25447
5944 1 15 . 1 1 10 10 PHE H H 10 7.301 7.301 8.639 -1.338 25447
5945 1 15 . 1 1 11 11 VAL N N 11 117.569 117.569 117.922 -0.353 25447
5946 1 15 . 1 1 11 11 VAL HA H 11 3.307 3.307 4.148 -0.841 25447
5947 1 15 . 1 1 11 11 VAL CA C 11 66.508 66.508 65.026 1.482 25447
5948 1 15 . 1 1 11 11 VAL CB C 11 31.487 31.487 30.692 0.795 25447
5949 1 15 . 1 1 11 11 VAL H H 11 8.370 8.370 8.023 0.347 25447
5950 1 15 . 1 1 12 12 VAL N N 12 117.909 117.909 121.376 -3.467 25447
5951 1 15 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.694 0.047 25447
5952 1 15 . 1 1 12 12 VAL CA C 12 65.876 65.876 67.064 -1.188 25447
5953 1 15 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.347 -0.035 25447
5954 1 15 . 1 1 12 12 VAL H H 12 8.294 8.294 7.866 0.428 25447
5955 1 15 . 1 1 13 13 GLU N N 13 117.918 117.918 119.163 -1.245 25447
5956 1 15 . 1 1 13 13 GLU HA H 13 3.742 3.742 3.987 -0.245 25447
5957 1 15 . 1 1 13 13 GLU CA C 13 59.307 59.307 58.985 0.322 25447
5958 1 15 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.291 0.198 25447
5959 1 15 . 1 1 13 13 GLU H H 13 7.750 7.750 8.237 -0.487 25447
5960 1 15 . 1 1 14 14 GLU N N 14 113.478 113.478 118.385 -4.907 25447
5961 1 15 . 1 1 14 14 GLU HA H 14 3.778 3.778 3.880 -0.102 25447
5962 1 15 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.996 -2.196 25447
5963 1 15 . 1 1 14 14 GLU CB C 14 29.643 29.643 29.833 -0.190 25447
5964 1 15 . 1 1 14 14 GLU H H 14 7.603 7.603 8.132 -0.529 25447
5965 1 15 . 1 1 15 15 PHE N N 15 114.193 114.193 114.854 -0.661 25447
5966 1 15 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.688 0.251 25447
5967 1 15 . 1 1 15 15 PHE CA C 15 58.095 58.095 59.593 -1.498 25447
5968 1 15 . 1 1 15 15 PHE CB C 15 42.095 42.095 41.485 0.610 25447
5969 1 15 . 1 1 15 15 PHE H H 15 7.908 7.908 7.650 0.258 25447
5970 1 15 . 1 1 16 16 LEU N N 16 121.492 121.492 120.623 0.869 25447
5971 1 15 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.879 0.088 25447
5972 1 15 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.176 0.201 25447
5973 1 15 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.380 1.353 25447
5974 1 15 . 1 1 16 16 LEU H H 16 8.015 8.015 7.994 0.021 25447
5975 1 15 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.441 -0.058 25447
5976 1 15 . 1 1 17 17 PRO CA C 17 64.858 64.858 64.026 0.832 25447
5977 1 15 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.839 -0.010 25447
5978 1 15 . 1 1 18 18 ASP N N 18 116.508 116.508 118.168 -1.660 25447
5979 1 15 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.718 -0.150 25447
5980 1 15 . 1 1 18 18 ASP CA C 18 54.688 54.688 54.069 0.619 25447
5981 1 15 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.683 -0.057 25447
5982 1 15 . 1 1 18 18 ASP H H 18 8.399 8.399 8.596 -0.197 25447
5983 1 15 . 1 1 19 19 VAL N N 19 122.135 122.135 120.486 1.649 25447
5984 1 15 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.168 -0.050 25447
5985 1 15 . 1 1 19 19 VAL CA C 19 61.293 61.293 60.458 0.835 25447
5986 1 15 . 1 1 19 19 VAL CB C 19 33.582 33.582 33.544 0.039 25447
5987 1 15 . 1 1 19 19 VAL H H 19 7.760 7.760 7.300 0.460 25447
5988 1 15 . 1 1 20 20 ALA N N 20 129.301 129.301 130.303 -1.002 25447
5989 1 15 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.521 0.078 25447
5990 1 15 . 1 1 20 20 ALA CA C 20 50.270 50.270 50.344 -0.074 25447
5991 1 15 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.322 -0.894 25447
5992 1 15 . 1 1 20 20 ALA H H 20 8.761 8.761 8.486 0.275 25447
5993 1 15 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.179 -0.102 25447
5994 1 15 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.538 0.665 25447
5995 1 15 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.820 -0.412 25447
5996 1 15 . 1 1 22 22 ALA N N 22 116.106 116.106 118.374 -2.268 25447
5997 1 15 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.157 -0.040 25447
5998 1 15 . 1 1 22 22 ALA CA C 22 53.996 53.996 54.043 -0.047 25447
5999 1 15 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.388 0.456 25447
6000 1 15 . 1 1 22 22 ALA H H 22 8.064 8.064 8.007 0.057 25447
6001 1 15 . 1 1 23 23 ASP N N 23 115.541 115.541 116.965 -1.424 25447
6002 1 15 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.569 0.108 25447
6003 1 15 . 1 1 23 23 ASP CA C 23 54.336 54.336 53.735 0.601 25447
6004 1 15 . 1 1 23 23 ASP CB C 23 41.353 41.353 40.356 0.997 25447
6005 1 15 . 1 1 23 23 ASP H H 23 8.003 8.003 8.118 -0.115 25447
6006 1 15 . 1 1 24 24 VAL N N 24 121.517 121.517 121.046 0.471 25447
6007 1 15 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.155 -0.334 25447
6008 1 15 . 1 1 24 24 VAL CA C 24 62.345 62.345 61.588 0.757 25447
6009 1 15 . 1 1 24 24 VAL CB C 24 31.733 31.733 33.078 -1.345 25447
6010 1 15 . 1 1 24 24 VAL H H 24 7.069 7.069 7.475 -0.406 25447
6011 1 15 . 1 1 25 25 ASP N N 25 129.329 129.329 127.331 1.998 25447
6012 1 15 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.848 -0.274 25447
6013 1 15 . 1 1 25 25 ASP CA C 25 54.566 54.566 53.507 1.059 25447
6014 1 15 . 1 1 25 25 ASP CB C 25 42.333 42.333 41.705 0.628 25447
6015 1 15 . 1 1 25 25 ASP H H 25 8.474 8.474 8.730 -0.256 25447
6016 1 15 . 1 1 26 26 VAL N N 26 121.920 121.920 121.254 0.666 25447
6017 1 15 . 1 1 26 26 VAL HA H 26 4.108 4.108 4.046 0.062 25447
6018 1 15 . 1 1 26 26 VAL CA C 26 64.518 64.518 63.761 0.757 25447
6019 1 15 . 1 1 26 26 VAL CB C 26 31.198 31.198 32.248 -1.050 25447
6020 1 15 . 1 1 26 26 VAL H H 26 8.591 8.591 8.580 0.011 25447
6021 1 15 . 1 1 27 27 ASP N N 27 116.286 116.286 118.126 -1.840 25447
6022 1 15 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.648 0.497 25447
6023 1 15 . 1 1 27 27 ASP CA C 27 54.181 54.181 55.014 -0.833 25447
6024 1 15 . 1 1 27 27 ASP CB C 27 42.575 42.575 40.837 1.738 25447
6025 1 15 . 1 1 27 27 ASP H H 27 8.609 8.609 8.181 0.428 25447
6026 1 15 . 1 1 28 28 LEU N N 28 125.116 125.116 121.872 3.244 25447
6027 1 15 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.480 -0.469 25447
6028 1 15 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.275 1.812 25447
6029 1 15 . 1 1 28 28 LEU CB C 28 43.321 43.321 43.851 -0.530 25447
6030 1 15 . 1 1 28 28 LEU H H 28 7.374 7.374 7.306 0.068 25447
6031 1 15 . 1 1 29 29 ASP N N 29 125.924 125.924 123.779 2.145 25447
6032 1 15 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.603 0.231 25447
6033 1 15 . 1 1 29 29 ASP CA C 29 53.920 53.920 55.139 -1.219 25447
6034 1 15 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.333 0.047 25447
6035 1 15 . 1 1 29 29 ASP H H 29 8.699 8.699 8.632 0.067 25447
6036 1 15 . 1 1 30 30 LEU N N 30 129.975 129.975 125.037 4.938 25447
6037 1 15 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.229 -0.312 25447
6038 1 15 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.404 -1.016 25447
6039 1 15 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.580 -0.341 25447
6040 1 15 . 1 1 30 30 LEU H H 30 9.718 9.718 7.981 1.737 25447
6041 1 15 . 1 1 31 31 VAL N N 31 121.212 121.212 114.681 6.531 25447
6042 1 15 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.656 0.537 25447
6043 1 15 . 1 1 31 31 VAL CA C 31 64.433 64.433 66.303 -1.871 25447
6044 1 15 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.402 0.773 25447
6045 1 15 . 1 1 31 31 VAL H H 31 8.163 8.163 7.341 0.822 25447
6046 1 15 . 1 1 32 32 ASP N N 32 124.893 124.893 119.481 5.412 25447
6047 1 15 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.315 0.043 25447
6048 1 15 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.718 0.507 25447
6049 1 15 . 1 1 32 32 ASP CB C 32 40.735 40.735 39.990 0.745 25447
6050 1 15 . 1 1 32 32 ASP H H 32 9.385 9.385 8.711 0.674 25447
6051 1 15 . 1 1 33 33 ASN N N 33 111.484 111.484 116.163 -4.679 25447
6052 1 15 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.575 0.145 25447
6053 1 15 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.715 0.171 25447
6054 1 15 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.017 -0.011 25447
6055 1 15 . 1 1 33 33 ASN H H 33 7.396 7.396 7.547 -0.151 25447
6056 1 15 . 1 1 34 34 GLY N N 34 106.957 106.957 106.048 0.909 25447
6057 1 15 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.572 1.035 25447
6058 1 15 . 1 1 34 34 GLY H H 34 7.618 7.618 7.828 -0.210 25447
6059 1 15 . 1 1 35 35 VAL N N 35 120.424 120.424 118.535 1.889 25447
6060 1 15 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.422 0.344 25447
6061 1 15 . 1 1 35 35 VAL CA C 35 65.125 65.125 64.272 0.853 25447
6062 1 15 . 1 1 35 35 VAL CB C 35 31.879 31.879 31.872 0.007 25447
6063 1 15 . 1 1 35 35 VAL H H 35 7.792 7.792 7.419 0.373 25447
6064 1 15 . 1 1 36 36 ILE N N 36 116.364 116.364 119.803 -3.439 25447
6065 1 15 . 1 1 36 36 ILE HA H 36 3.737 3.737 3.811 -0.074 25447
6066 1 15 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.134 -0.449 25447
6067 1 15 . 1 1 36 36 ILE CB C 36 38.807 38.807 38.095 0.712 25447
6068 1 15 . 1 1 36 36 ILE H H 36 7.331 7.331 7.512 -0.181 25447
6069 1 15 . 1 1 37 37 ASP N N 37 127.306 127.306 127.274 0.032 25447
6070 1 15 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.793 -0.129 25447
6071 1 15 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.785 -1.169 25447
6072 1 15 . 1 1 37 37 ASP CB C 37 41.209 41.209 43.002 -1.793 25447
6073 1 15 . 1 1 37 37 ASP H H 37 7.874 7.874 8.257 -0.383 25447
6074 1 15 . 1 1 38 38 ALA N N 38 120.352 120.352 122.839 -2.487 25447
6075 1 15 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.093 -0.098 25447
6076 1 15 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.511 0.781 25447
6077 1 15 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.654 -0.342 25447
6078 1 15 . 1 1 38 38 ALA H H 38 8.244 8.244 8.424 -0.180 25447
6079 1 15 . 1 1 39 39 LEU N N 39 117.438 117.438 119.340 -1.902 25447
6080 1 15 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.262 -0.012 25447
6081 1 15 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.529 -0.174 25447
6082 1 15 . 1 1 39 39 LEU CB C 39 41.236 41.236 40.984 0.252 25447
6083 1 15 . 1 1 39 39 LEU H H 39 7.688 7.688 8.389 -0.701 25447
6084 1 15 . 1 1 40 40 GLY N N 40 112.015 112.015 107.558 4.457 25447
6085 1 15 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.435 0.664 25447
6086 1 15 . 1 1 40 40 GLY H H 40 8.732 8.732 8.352 0.380 25447
6087 1 15 . 1 1 41 41 LEU N N 41 122.983 122.983 123.096 -0.113 25447
6088 1 15 . 1 1 41 41 LEU HA H 41 3.851 3.851 4.187 -0.336 25447
6089 1 15 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.603 0.729 25447
6090 1 15 . 1 1 41 41 LEU CB C 41 41.639 41.639 42.032 -0.393 25447
6091 1 15 . 1 1 41 41 LEU H H 41 8.548 8.548 8.486 0.062 25447
6092 1 15 . 1 1 42 42 LEU N N 42 116.076 116.076 120.026 -3.950 25447
6093 1 15 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.898 0.130 25447
6094 1 15 . 1 1 42 42 LEU CA C 42 58.064 58.064 58.562 -0.499 25447
6095 1 15 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.812 -0.872 25447
6096 1 15 . 1 1 42 42 LEU H H 42 7.168 7.168 7.671 -0.503 25447
6097 1 15 . 1 1 43 43 LYS N N 43 119.831 119.831 119.033 0.798 25447
6098 1 15 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.031 0.253 25447
6099 1 15 . 1 1 43 43 LYS CA C 43 59.644 59.644 60.016 -0.372 25447
6100 1 15 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.295 0.232 25447
6101 1 15 . 1 1 43 43 LYS H H 43 7.640 7.640 8.330 -0.690 25447
6102 1 15 . 1 1 44 44 VAL N N 44 121.046 121.046 120.564 0.482 25447
6103 1 15 . 1 1 44 44 VAL HA H 44 3.949 3.949 4.073 -0.124 25447
6104 1 15 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.856 -0.213 25447
6105 1 15 . 1 1 44 44 VAL H H 44 8.269 8.269 7.888 0.381 25447
6106 1 15 . 1 1 45 45 ILE N N 45 119.333 119.333 119.448 -0.115 25447
6107 1 15 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.568 -0.164 25447
6108 1 15 . 1 1 45 45 ILE CA C 45 66.148 66.148 64.487 1.661 25447
6109 1 15 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.295 0.982 25447
6110 1 15 . 1 1 45 45 ILE H H 45 8.145 8.145 7.728 0.417 25447
6111 1 15 . 1 1 46 46 ALA N N 46 121.213 121.213 123.527 -2.314 25447
6112 1 15 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.455 -0.198 25447
6113 1 15 . 1 1 46 46 ALA CA C 46 55.164 55.164 54.810 0.354 25447
6114 1 15 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.613 -0.245 25447
6115 1 15 . 1 1 46 46 ALA H H 46 7.792 7.792 8.215 -0.423 25447
6116 1 15 . 1 1 47 47 TRP N N 47 121.416 121.416 120.100 1.316 25447
6117 1 15 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.483 -0.249 25447
6118 1 15 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.625 2.045 25447
6119 1 15 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.443 -1.204 25447
6120 1 15 . 1 1 47 47 TRP H H 47 8.093 8.093 8.102 -0.009 25447
6121 1 15 . 1 1 48 48 LEU N N 48 118.963 118.963 121.234 -2.271 25447
6122 1 15 . 1 1 48 48 LEU HA H 48 3.586 3.586 2.827 0.759 25447
6123 1 15 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.722 0.473 25447
6124 1 15 . 1 1 48 48 LEU CB C 48 42.251 42.251 41.227 1.024 25447
6125 1 15 . 1 1 48 48 LEU H H 48 8.693 8.693 7.310 1.383 25447
6126 1 15 . 1 1 49 49 GLU N N 49 119.131 119.131 117.013 2.118 25447
6127 1 15 . 1 1 49 49 GLU HA H 49 4.050 4.050 3.970 0.080 25447
6128 1 15 . 1 1 49 49 GLU CA C 49 59.862 59.862 59.058 0.804 25447
6129 1 15 . 1 1 49 49 GLU CB C 49 29.586 29.586 28.930 0.656 25447
6130 1 15 . 1 1 49 49 GLU H H 49 7.771 7.771 7.727 0.044 25447
6131 1 15 . 1 1 50 50 ASP N N 50 119.941 119.941 120.944 -1.003 25447
6132 1 15 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.428 -0.191 25447
6133 1 15 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.550 0.805 25447
6134 1 15 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.745 1.638 25447
6135 1 15 . 1 1 50 50 ASP H H 50 7.697 7.697 7.637 0.060 25447
6136 1 15 . 1 1 51 51 ARG N N 51 116.911 116.911 117.976 -1.065 25447
6137 1 15 . 1 1 51 51 ARG HA H 51 3.736 3.736 4.043 -0.307 25447
6138 1 15 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.362 -1.998 25447
6139 1 15 . 1 1 51 51 ARG CB C 51 29.315 29.315 30.252 -0.937 25447
6140 1 15 . 1 1 51 51 ARG H H 51 8.881 8.881 7.772 1.109 25447
6141 1 15 . 1 1 52 52 PHE N N 52 112.328 112.328 116.702 -4.374 25447
6142 1 15 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.623 0.052 25447
6143 1 15 . 1 1 52 52 PHE CA C 52 57.413 57.413 58.084 -0.671 25447
6144 1 15 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.387 1.505 25447
6145 1 15 . 1 1 52 52 PHE H H 52 7.284 7.284 7.581 -0.297 25447
6146 1 15 . 1 1 53 53 GLY N N 53 109.826 109.826 108.707 1.119 25447
6147 1 15 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.567 1.234 25447
6148 1 15 . 1 1 53 53 GLY H H 53 7.427 7.427 7.883 -0.456 25447
6149 1 15 . 1 1 54 54 ILE N N 54 119.127 119.127 115.305 3.822 25447
6150 1 15 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.527 -0.576 25447
6151 1 15 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.534 1.151 25447
6152 1 15 . 1 1 54 54 ILE CB C 54 39.490 39.490 39.815 -0.325 25447
6153 1 15 . 1 1 54 54 ILE H H 54 6.876 6.876 7.655 -0.779 25447
6154 1 15 . 1 1 55 55 ALA N N 55 129.823 129.823 123.966 5.857 25447
6155 1 15 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.543 -0.129 25447
6156 1 15 . 1 1 55 55 ALA CA C 55 51.610 51.610 50.639 0.971 25447
6157 1 15 . 1 1 55 55 ALA CB C 55 19.262 19.262 20.334 -1.072 25447
6158 1 15 . 1 1 55 55 ALA H H 55 8.499 8.499 8.113 0.386 25447
6159 1 15 . 1 1 56 56 ALA N N 56 126.300 126.300 125.380 0.920 25447
6160 1 15 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.078 0.191 25447
6161 1 15 . 1 1 56 56 ALA CA C 56 53.474 53.474 54.569 -1.095 25447
6162 1 15 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.922 0.322 25447
6163 1 15 . 1 1 56 56 ALA H H 56 8.641 8.641 8.332 0.309 25447
6164 1 15 . 1 1 57 57 ASP N N 57 116.395 116.395 118.096 -1.701 25447
6165 1 15 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.311 0.168 25447
6166 1 15 . 1 1 57 57 ASP CA C 57 55.226 55.226 56.563 -1.337 25447
6167 1 15 . 1 1 57 57 ASP CB C 57 40.922 40.922 40.321 0.601 25447
6168 1 15 . 1 1 57 57 ASP H H 57 8.337 8.337 8.358 -0.021 25447
6169 1 15 . 1 1 58 58 ASP N N 58 118.557 118.557 118.245 0.312 25447
6170 1 15 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.447 0.189 25447
6171 1 15 . 1 1 58 58 ASP CA C 58 55.144 55.144 56.088 -0.944 25447
6172 1 15 . 1 1 58 58 ASP CB C 58 41.504 41.504 41.518 -0.014 25447
6173 1 15 . 1 1 58 58 ASP H H 58 8.027 8.027 7.883 0.144 25447
6174 1 15 . 1 1 59 59 VAL N N 59 118.898 118.898 118.601 0.297 25447
6175 1 15 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.244 -0.068 25447
6176 1 15 . 1 1 59 59 VAL CA C 59 62.300 62.300 60.539 1.761 25447
6177 1 15 . 1 1 59 59 VAL CB C 59 33.078 33.078 34.333 -1.255 25447
6178 1 15 . 1 1 59 59 VAL H H 59 7.716 7.716 7.431 0.285 25447
6179 1 15 . 1 1 60 60 GLU N N 60 122.888 122.888 126.047 -3.159 25447
6180 1 15 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.394 -0.110 25447
6181 1 15 . 1 1 60 60 GLU CA C 60 56.546 56.546 56.066 0.480 25447
6182 1 15 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.590 -0.808 25447
6183 1 15 . 1 1 60 60 GLU H H 60 8.367 8.367 8.382 -0.015 25447
6184 1 15 . 1 1 61 61 LEU N N 61 124.827 124.827 124.833 -0.006 25447
6185 1 15 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.481 -0.123 25447
6186 1 15 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.207 0.609 25447
6187 1 15 . 1 1 61 61 LEU CB C 61 41.937 41.937 42.655 -0.718 25447
6188 1 15 . 1 1 61 61 LEU H H 61 8.198 8.198 8.433 -0.235 25447
6189 1 15 . 1 1 62 62 SER N N 62 118.715 118.715 118.748 -0.033 25447
6190 1 15 . 1 1 62 62 SER HA H 62 4.809 4.809 4.962 -0.153 25447
6191 1 15 . 1 1 62 62 SER CA C 62 55.732 55.732 55.182 0.550 25447
6192 1 15 . 1 1 62 62 SER CB C 62 64.017 64.017 64.669 -0.652 25447
6193 1 15 . 1 1 62 62 SER H H 62 8.137 8.137 8.218 -0.081 25447
6194 1 15 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.295 -0.042 25447
6195 1 15 . 1 1 63 63 PRO CA C 63 64.896 64.896 65.317 -0.420 25447
6196 1 15 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.785 0.267 25447
6197 1 15 . 1 1 64 64 GLU N N 64 116.554 116.554 119.083 -2.529 25447
6198 1 15 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.144 -0.271 25447
6199 1 15 . 1 1 64 64 GLU CA C 64 58.719 58.719 58.862 -0.143 25447
6200 1 15 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.248 -0.568 25447
6201 1 15 . 1 1 64 64 GLU H H 64 8.316 8.316 8.450 -0.134 25447
6202 1 15 . 1 1 65 65 HIS N N 65 115.487 115.487 119.810 -4.323 25447
6203 1 15 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.211 0.069 25447
6204 1 15 . 1 1 65 65 HIS CA C 65 57.652 57.652 58.001 -0.349 25447
6205 1 15 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.526 0.356 25447
6206 1 15 . 1 1 65 65 HIS H H 65 7.274 7.274 8.341 -1.067 25447
6207 1 15 . 1 1 66 66 PHE N N 66 116.127 116.127 116.371 -0.244 25447
6208 1 15 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.700 0.066 25447
6209 1 15 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.270 -1.488 25447
6210 1 15 . 1 1 66 66 PHE CB C 66 38.908 38.908 37.968 0.940 25447
6211 1 15 . 1 1 66 66 PHE H H 66 7.239 7.239 7.763 -0.524 25447
6212 1 15 . 1 1 67 67 ARG N N 67 112.468 112.468 119.983 -7.515 25447
6213 1 15 . 1 1 67 67 ARG HA H 67 4.085 4.085 4.016 0.069 25447
6214 1 15 . 1 1 67 67 ARG CA C 67 58.287 58.287 59.247 -0.960 25447
6215 1 15 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.502 1.258 25447
6216 1 15 . 1 1 67 67 ARG H H 67 6.628 6.628 7.888 -1.260 25447
6217 1 15 . 1 1 68 68 SER N N 68 109.305 109.305 110.238 -0.933 25447
6218 1 15 . 1 1 68 68 SER HA H 68 4.980 4.980 4.722 0.258 25447
6219 1 15 . 1 1 68 68 SER CA C 68 55.785 55.785 56.805 -1.020 25447
6220 1 15 . 1 1 68 68 SER CB C 68 67.691 67.691 66.113 1.578 25447
6221 1 15 . 1 1 68 68 SER H H 68 8.145 8.145 7.390 0.755 25447
6222 1 15 . 1 1 69 69 ILE N N 69 122.602 122.602 122.692 -0.090 25447
6223 1 15 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.779 -0.103 25447
6224 1 15 . 1 1 69 69 ILE CA C 69 66.754 66.754 63.419 3.336 25447
6225 1 15 . 1 1 69 69 ILE CB C 69 37.296 37.296 36.800 0.496 25447
6226 1 15 . 1 1 69 69 ILE H H 69 9.775 9.775 9.056 0.719 25447
6227 1 15 . 1 1 70 70 ARG N N 70 118.764 118.764 119.518 -0.754 25447
6228 1 15 . 1 1 70 70 ARG HA H 70 3.955 3.955 3.962 -0.007 25447
6229 1 15 . 1 1 70 70 ARG CA C 70 60.533 60.533 60.020 0.513 25447
6230 1 15 . 1 1 70 70 ARG CB C 70 30.418 30.418 29.601 0.817 25447
6231 1 15 . 1 1 70 70 ARG H H 70 8.910 8.910 7.861 1.049 25447
6232 1 15 . 1 1 71 71 SER N N 71 117.670 117.670 114.457 3.213 25447
6233 1 15 . 1 1 71 71 SER HA H 71 4.330 4.330 4.189 0.141 25447
6234 1 15 . 1 1 71 71 SER CA C 71 62.287 62.287 60.818 1.469 25447
6235 1 15 . 1 1 71 71 SER CB C 71 63.278 63.278 62.530 0.748 25447
6236 1 15 . 1 1 71 71 SER H H 71 8.518 8.518 7.400 1.118 25447
6237 1 15 . 1 1 72 72 ILE N N 72 127.447 127.447 122.993 4.454 25447
6238 1 15 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.311 0.599 25447
6239 1 15 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.955 0.856 25447
6240 1 15 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.561 0.837 25447
6241 1 15 . 1 1 72 72 ILE H H 72 8.762 8.762 7.606 1.156 25447
6242 1 15 . 1 1 73 73 ASP N N 73 121.636 121.636 120.143 1.493 25447
6243 1 15 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.299 -0.286 25447
6244 1 15 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.329 1.819 25447
6245 1 15 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.593 2.947 25447
6246 1 15 . 1 1 73 73 ASP H H 73 8.677 8.677 8.103 0.574 25447
6247 1 15 . 1 1 74 74 ALA N N 74 118.793 118.793 122.010 -3.217 25447
6248 1 15 . 1 1 74 74 ALA HA H 74 4.044 4.044 3.957 0.087 25447
6249 1 15 . 1 1 74 74 ALA CA C 74 55.321 55.321 55.209 0.112 25447
6250 1 15 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.495 -0.550 25447
6251 1 15 . 1 1 74 74 ALA H H 74 8.005 8.005 7.670 0.335 25447
6252 1 15 . 1 1 75 75 PHE N N 75 121.235 121.235 120.058 1.177 25447
6253 1 15 . 1 1 75 75 PHE HA H 75 4.038 4.038 4.076 -0.038 25447
6254 1 15 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.883 -0.868 25447
6255 1 15 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.500 -0.663 25447
6256 1 15 . 1 1 75 75 PHE H H 75 8.353 8.353 8.556 -0.203 25447
6257 1 15 . 1 1 76 76 VAL N N 76 120.866 120.866 118.968 1.898 25447
6258 1 15 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.351 -0.408 25447
6259 1 15 . 1 1 76 76 VAL CA C 76 66.901 66.901 66.900 0.001 25447
6260 1 15 . 1 1 76 76 VAL CB C 76 31.247 31.247 30.973 0.274 25447
6261 1 15 . 1 1 76 76 VAL H H 76 8.544 8.544 8.590 -0.046 25447
6262 1 15 . 1 1 77 77 VAL N N 77 121.408 121.408 119.282 2.126 25447
6263 1 15 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.883 -0.388 25447
6264 1 15 . 1 1 77 77 VAL CA C 77 66.833 66.833 65.703 1.130 25447
6265 1 15 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.253 0.677 25447
6266 1 15 . 1 1 77 77 VAL H H 77 8.708 8.708 8.153 0.555 25447
6267 1 15 . 1 1 78 78 GLY N N 78 106.402 106.402 106.620 -0.218 25447
6268 1 15 . 1 1 78 78 GLY CA C 78 46.840 46.840 46.847 -0.007 25447
6269 1 15 . 1 1 78 78 GLY H H 78 7.945 7.945 8.535 -0.590 25447
6270 1 15 . 1 1 79 79 ALA N N 79 121.146 121.146 122.817 -1.671 25447
6271 1 15 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.864 0.343 25447
6272 1 15 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.361 -1.432 25447
6273 1 15 . 1 1 79 79 ALA CB C 79 19.261 19.261 17.991 1.270 25447
6274 1 15 . 1 1 79 79 ALA H H 79 7.639 7.639 7.747 -0.108 25447
6275 1 15 . 1 1 80 80 THR N N 80 107.668 107.668 108.714 -1.046 25447
6276 1 15 . 1 1 80 80 THR HA H 80 4.443 4.443 4.204 0.239 25447
6277 1 15 . 1 1 80 80 THR CA C 80 61.406 61.406 63.078 -1.672 25447
6278 1 15 . 1 1 80 80 THR CB C 80 70.767 70.767 69.503 1.264 25447
6279 1 15 . 1 1 80 80 THR H H 80 7.449 7.449 7.709 -0.260 25447
6280 1 15 . 1 1 81 81 THR N N 81 119.953 119.953 116.507 3.446 25447
6281 1 15 . 1 1 81 81 THR HA H 81 4.665 4.665 4.816 -0.151 25447
6282 1 15 . 1 1 81 81 THR CA C 81 60.412 60.412 59.027 1.385 25447
6283 1 15 . 1 1 81 81 THR CB C 81 70.113 70.113 69.755 0.358 25447
6284 1 15 . 1 1 81 81 THR H H 81 7.685 7.685 7.749 -0.064 25447
6285 1 15 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.688 0.001 25447
6286 1 15 . 1 1 82 82 PRO CA C 82 61.688 61.688 61.485 0.203 25447
6287 1 15 . 1 1 82 82 PRO CB C 82 30.969 30.969 30.997 -0.028 25447
6288 1 15 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.461 0.020 25447
6289 1 15 . 1 1 83 83 PRO CA C 83 62.931 62.931 61.976 0.955 25447
6290 1 15 . 1 1 83 83 PRO CB C 83 32.193 32.193 32.815 -0.622 25447
6291 1 15 . 1 1 84 84 VAL N N 84 120.691 120.691 122.566 -1.875 25447
6292 1 15 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.185 -0.092 25447
6293 1 15 . 1 1 84 84 VAL CA C 84 62.339 62.339 61.867 0.472 25447
6294 1 15 . 1 1 84 84 VAL CB C 84 32.851 32.851 32.596 0.255 25447
6295 1 15 . 1 1 84 84 VAL H H 84 8.257 8.257 8.098 0.159 25447
6296 1 15 . 1 1 85 85 GLU N N 85 127.655 127.655 121.362 6.293 25447
6297 1 15 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.947 0.337 25447
6298 1 15 . 1 1 85 85 GLU CA C 85 56.754 56.754 57.125 -0.371 25447
6299 1 15 . 1 1 85 85 GLU CB C 85 30.559 30.559 28.526 2.033 25447
6300 1 15 . 1 1 85 85 GLU H H 85 8.202 8.202 8.745 -0.543 25447
6301 1 15 . 1 1 86 86 ALA N N 86 126.437 126.437 120.866 5.571 25447
6302 1 15 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.211 -0.160 25447
6303 1 15 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.289 -0.141 25447
6304 1 15 . 1 1 86 86 ALA CB C 86 19.460 19.460 19.462 -0.002 25447
6305 1 15 . 1 1 86 86 ALA H H 86 8.323 8.323 7.821 0.502 25447
6306 1 15 . 1 1 87 87 LYS N N 87 121.796 121.796 122.626 -0.830 25447
6307 1 15 . 1 1 87 87 LYS HA H 87 4.347 4.347 3.968 0.379 25447
6308 1 15 . 1 1 87 87 LYS CA C 87 56.297 56.297 56.718 -0.421 25447
6309 1 15 . 1 1 87 87 LYS CB C 87 33.276 33.276 31.652 1.624 25447
6310 1 15 . 1 1 87 87 LYS H H 87 8.333 8.333 8.559 -0.226 25447
6311 1 15 . 1 1 88 88 LEU N N 88 125.576 125.576 116.576 9.000 25447
6312 1 15 . 1 1 88 88 LEU HA H 88 3.907 3.907 3.904 0.003 25447
6313 1 15 . 1 1 88 88 LEU CA C 88 55.772 55.772 55.856 -0.084 25447
6314 1 15 . 1 1 88 88 LEU CB C 88 42.472 42.472 40.983 1.489 25447
6315 1 15 . 1 1 88 88 LEU H H 88 8.444 8.444 8.456 -0.012 25447
6316 1 16 . 1 1 1 1 MET N N 1 120.668 120.668 121.209 -0.541 25447
6317 1 16 . 1 1 1 1 MET HA H 1 4.484 4.484 4.601 -0.117 25447
6318 1 16 . 1 1 1 1 MET CA C 1 55.257 55.257 55.195 0.062 25447
6319 1 16 . 1 1 1 1 MET CB C 1 34.517 34.517 34.012 0.505 25447
6320 1 16 . 1 1 1 1 MET H H 1 8.313 8.313 8.091 0.222 25447
6321 1 16 . 1 1 2 2 GLN N N 2 123.739 123.739 118.497 5.242 25447
6322 1 16 . 1 1 2 2 GLN HA H 2 4.030 4.030 4.545 -0.515 25447
6323 1 16 . 1 1 2 2 GLN CA C 2 57.874 57.874 54.884 2.990 25447
6324 1 16 . 1 1 2 2 GLN CB C 2 29.938 29.938 29.367 0.571 25447
6325 1 16 . 1 1 2 2 GLN H H 2 9.455 9.455 8.505 0.951 25447
6326 1 16 . 1 1 3 3 HIS N N 3 119.115 119.115 118.146 0.969 25447
6327 1 16 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.070 1.046 25447
6328 1 16 . 1 1 3 3 HIS CA C 3 55.494 55.494 57.152 -1.658 25447
6329 1 16 . 1 1 3 3 HIS CB C 3 31.015 31.015 28.173 2.842 25447
6330 1 16 . 1 1 3 3 HIS H H 3 9.783 9.783 8.692 1.091 25447
6331 1 16 . 1 1 4 4 ALA N N 4 122.648 122.648 121.562 1.086 25447
6332 1 16 . 1 1 4 4 ALA HA H 4 3.903 3.903 3.984 -0.081 25447
6333 1 16 . 1 1 4 4 ALA CA C 4 56.479 56.479 55.052 1.427 25447
6334 1 16 . 1 1 4 4 ALA CB C 4 19.194 19.194 18.637 0.557 25447
6335 1 16 . 1 1 4 4 ALA H H 4 7.551 7.551 8.590 -1.039 25447
6336 1 16 . 1 1 5 5 SER N N 5 112.599 112.599 113.174 -0.575 25447
6337 1 16 . 1 1 5 5 SER HA H 5 4.298 4.298 4.268 0.030 25447
6338 1 16 . 1 1 5 5 SER CA C 5 62.117 62.117 61.309 0.808 25447
6339 1 16 . 1 1 5 5 SER CB C 5 62.334 62.334 62.277 0.057 25447
6340 1 16 . 1 1 5 5 SER H H 5 8.736 8.736 8.504 0.232 25447
6341 1 16 . 1 1 6 6 VAL N N 6 122.866 122.866 122.977 -0.111 25447
6342 1 16 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.803 0.302 25447
6343 1 16 . 1 1 6 6 VAL CA C 6 65.732 65.732 66.062 -0.330 25447
6344 1 16 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.634 1.103 25447
6345 1 16 . 1 1 6 6 VAL H H 6 7.660 7.660 7.408 0.252 25447
6346 1 16 . 1 1 7 7 ILE N N 7 121.715 121.715 120.393 1.322 25447
6347 1 16 . 1 1 7 7 ILE HA H 7 4.224 4.224 3.799 0.425 25447
6348 1 16 . 1 1 7 7 ILE CA C 7 65.329 65.329 65.919 -0.590 25447
6349 1 16 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.394 1.299 25447
6350 1 16 . 1 1 7 7 ILE H H 7 8.519 8.519 7.757 0.762 25447
6351 1 16 . 1 1 8 8 ALA N N 8 121.373 121.373 121.573 -0.200 25447
6352 1 16 . 1 1 8 8 ALA HA H 8 3.895 3.895 3.904 -0.009 25447
6353 1 16 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.322 0.935 25447
6354 1 16 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.084 0.556 25447
6355 1 16 . 1 1 8 8 ALA H H 8 8.940 8.940 7.860 1.080 25447
6356 1 16 . 1 1 9 9 GLN N N 9 115.076 115.076 118.479 -3.403 25447
6357 1 16 . 1 1 9 9 GLN HA H 9 3.870 3.870 4.011 -0.141 25447
6358 1 16 . 1 1 9 9 GLN CA C 9 59.192 59.192 58.904 0.288 25447
6359 1 16 . 1 1 9 9 GLN CB C 9 28.138 28.138 29.047 -0.909 25447
6360 1 16 . 1 1 9 9 GLN H H 9 7.729 7.729 8.052 -0.323 25447
6361 1 16 . 1 1 10 10 PHE N N 10 120.207 120.207 121.134 -0.927 25447
6362 1 16 . 1 1 10 10 PHE HA H 10 4.085 4.085 4.308 -0.223 25447
6363 1 16 . 1 1 10 10 PHE CA C 10 60.893 60.893 59.816 1.077 25447
6364 1 16 . 1 1 10 10 PHE CB C 10 38.932 38.932 38.943 -0.011 25447
6365 1 16 . 1 1 10 10 PHE H H 10 7.301 7.301 8.712 -1.411 25447
6366 1 16 . 1 1 11 11 VAL N N 11 117.569 117.569 120.296 -2.727 25447
6367 1 16 . 1 1 11 11 VAL HA H 11 3.307 3.307 2.538 0.769 25447
6368 1 16 . 1 1 11 11 VAL CA C 11 66.508 66.508 64.743 1.764 25447
6369 1 16 . 1 1 11 11 VAL CB C 11 31.487 31.487 30.777 0.710 25447
6370 1 16 . 1 1 11 11 VAL H H 11 8.370 8.370 7.700 0.670 25447
6371 1 16 . 1 1 12 12 VAL N N 12 117.909 117.909 119.465 -1.556 25447
6372 1 16 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.466 0.275 25447
6373 1 16 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.667 -0.791 25447
6374 1 16 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.707 -0.395 25447
6375 1 16 . 1 1 12 12 VAL H H 12 8.294 8.294 7.588 0.706 25447
6376 1 16 . 1 1 13 13 GLU N N 13 117.918 117.918 118.966 -1.048 25447
6377 1 16 . 1 1 13 13 GLU HA H 13 3.742 3.742 3.986 -0.244 25447
6378 1 16 . 1 1 13 13 GLU CA C 13 59.307 59.307 59.167 0.140 25447
6379 1 16 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.431 0.058 25447
6380 1 16 . 1 1 13 13 GLU H H 13 7.750 7.750 7.694 0.056 25447
6381 1 16 . 1 1 14 14 GLU N N 14 113.478 113.478 117.702 -4.224 25447
6382 1 16 . 1 1 14 14 GLU HA H 14 3.778 3.778 4.116 -0.338 25447
6383 1 16 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.740 -1.940 25447
6384 1 16 . 1 1 14 14 GLU CB C 14 29.643 29.643 29.878 -0.235 25447
6385 1 16 . 1 1 14 14 GLU H H 14 7.603 7.603 7.722 -0.119 25447
6386 1 16 . 1 1 15 15 PHE N N 15 114.193 114.193 116.319 -2.126 25447
6387 1 16 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.629 0.310 25447
6388 1 16 . 1 1 15 15 PHE CA C 15 58.095 58.095 59.086 -0.991 25447
6389 1 16 . 1 1 15 15 PHE CB C 15 42.095 42.095 41.742 0.353 25447
6390 1 16 . 1 1 15 15 PHE H H 15 7.908 7.908 7.312 0.596 25447
6391 1 16 . 1 1 16 16 LEU N N 16 121.492 121.492 121.002 0.490 25447
6392 1 16 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.762 0.205 25447
6393 1 16 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.019 0.358 25447
6394 1 16 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.106 1.627 25447
6395 1 16 . 1 1 16 16 LEU H H 16 8.015 8.015 8.124 -0.109 25447
6396 1 16 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.445 -0.062 25447
6397 1 16 . 1 1 17 17 PRO CA C 17 64.858 64.858 63.934 0.924 25447
6398 1 16 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.811 0.018 25447
6399 1 16 . 1 1 18 18 ASP N N 18 116.508 116.508 118.184 -1.676 25447
6400 1 16 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.669 -0.101 25447
6401 1 16 . 1 1 18 18 ASP CA C 18 54.688 54.688 54.502 0.186 25447
6402 1 16 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.603 0.023 25447
6403 1 16 . 1 1 18 18 ASP H H 18 8.399 8.399 8.629 -0.230 25447
6404 1 16 . 1 1 19 19 VAL N N 19 122.135 122.135 120.328 1.807 25447
6405 1 16 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.161 -0.043 25447
6406 1 16 . 1 1 19 19 VAL CA C 19 61.293 61.293 61.073 0.220 25447
6407 1 16 . 1 1 19 19 VAL CB C 19 33.582 33.582 34.146 -0.564 25447
6408 1 16 . 1 1 19 19 VAL H H 19 7.760 7.760 7.265 0.495 25447
6409 1 16 . 1 1 20 20 ALA N N 20 129.301 129.301 130.157 -0.856 25447
6410 1 16 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.532 0.067 25447
6411 1 16 . 1 1 20 20 ALA CA C 20 50.270 50.270 50.214 0.056 25447
6412 1 16 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.187 -0.759 25447
6413 1 16 . 1 1 20 20 ALA H H 20 8.761 8.761 8.468 0.293 25447
6414 1 16 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.107 -0.030 25447
6415 1 16 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.564 0.639 25447
6416 1 16 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.754 -0.346 25447
6417 1 16 . 1 1 22 22 ALA N N 22 116.106 116.106 118.190 -2.084 25447
6418 1 16 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.068 0.049 25447
6419 1 16 . 1 1 22 22 ALA CA C 22 53.996 53.996 53.820 0.176 25447
6420 1 16 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.287 0.557 25447
6421 1 16 . 1 1 22 22 ALA H H 22 8.064 8.064 8.120 -0.056 25447
6422 1 16 . 1 1 23 23 ASP N N 23 115.541 115.541 117.034 -1.493 25447
6423 1 16 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.625 0.052 25447
6424 1 16 . 1 1 23 23 ASP CA C 23 54.336 54.336 54.358 -0.022 25447
6425 1 16 . 1 1 23 23 ASP CB C 23 41.353 41.353 41.333 0.020 25447
6426 1 16 . 1 1 23 23 ASP H H 23 8.003 8.003 8.089 -0.086 25447
6427 1 16 . 1 1 24 24 VAL N N 24 121.517 121.517 120.793 0.724 25447
6428 1 16 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.189 -0.368 25447
6429 1 16 . 1 1 24 24 VAL CA C 24 62.345 62.345 60.666 1.679 25447
6430 1 16 . 1 1 24 24 VAL CB C 24 31.733 31.733 32.639 -0.906 25447
6431 1 16 . 1 1 24 24 VAL H H 24 7.069 7.069 7.487 -0.418 25447
6432 1 16 . 1 1 25 25 ASP N N 25 129.329 129.329 127.701 1.628 25447
6433 1 16 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.806 -0.232 25447
6434 1 16 . 1 1 25 25 ASP CA C 25 54.566 54.566 53.097 1.469 25447
6435 1 16 . 1 1 25 25 ASP CB C 25 42.333 42.333 41.927 0.406 25447
6436 1 16 . 1 1 25 25 ASP H H 25 8.474 8.474 8.708 -0.234 25447
6437 1 16 . 1 1 26 26 VAL N N 26 121.920 121.920 121.282 0.638 25447
6438 1 16 . 1 1 26 26 VAL HA H 26 4.108 4.108 3.955 0.153 25447
6439 1 16 . 1 1 26 26 VAL CA C 26 64.518 64.518 63.500 1.018 25447
6440 1 16 . 1 1 26 26 VAL CB C 26 31.198 31.198 31.565 -0.367 25447
6441 1 16 . 1 1 26 26 VAL H H 26 8.591 8.591 8.699 -0.108 25447
6442 1 16 . 1 1 27 27 ASP N N 27 116.286 116.286 118.619 -2.333 25447
6443 1 16 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.677 0.468 25447
6444 1 16 . 1 1 27 27 ASP CA C 27 54.181 54.181 54.661 -0.480 25447
6445 1 16 . 1 1 27 27 ASP CB C 27 42.575 42.575 40.834 1.741 25447
6446 1 16 . 1 1 27 27 ASP H H 27 8.609 8.609 8.114 0.495 25447
6447 1 16 . 1 1 28 28 LEU N N 28 125.116 125.116 122.350 2.766 25447
6448 1 16 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.460 -0.449 25447
6449 1 16 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.277 1.810 25447
6450 1 16 . 1 1 28 28 LEU CB C 28 43.321 43.321 43.854 -0.533 25447
6451 1 16 . 1 1 28 28 LEU H H 28 7.374 7.374 7.417 -0.043 25447
6452 1 16 . 1 1 29 29 ASP N N 29 125.924 125.924 124.345 1.579 25447
6453 1 16 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.589 0.245 25447
6454 1 16 . 1 1 29 29 ASP CA C 29 53.920 53.920 55.081 -1.161 25447
6455 1 16 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.280 0.099 25447
6456 1 16 . 1 1 29 29 ASP H H 29 8.699 8.699 8.680 0.019 25447
6457 1 16 . 1 1 30 30 LEU N N 30 129.975 129.975 125.938 4.037 25447
6458 1 16 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.141 -0.224 25447
6459 1 16 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.339 -0.951 25447
6460 1 16 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.441 -0.202 25447
6461 1 16 . 1 1 30 30 LEU H H 30 9.718 9.718 8.084 1.634 25447
6462 1 16 . 1 1 31 31 VAL N N 31 121.212 121.212 117.599 3.613 25447
6463 1 16 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.610 0.583 25447
6464 1 16 . 1 1 31 31 VAL CA C 31 64.433 64.433 66.487 -2.054 25447
6465 1 16 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.222 0.953 25447
6466 1 16 . 1 1 31 31 VAL H H 31 8.163 8.163 7.680 0.483 25447
6467 1 16 . 1 1 32 32 ASP N N 32 124.893 124.893 118.638 6.255 25447
6468 1 16 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.331 0.027 25447
6469 1 16 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.744 0.481 25447
6470 1 16 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.077 0.658 25447
6471 1 16 . 1 1 32 32 ASP H H 32 9.385 9.385 8.707 0.678 25447
6472 1 16 . 1 1 33 33 ASN N N 33 111.484 111.484 116.295 -4.811 25447
6473 1 16 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.587 0.133 25447
6474 1 16 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.649 0.237 25447
6475 1 16 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.004 0.002 25447
6476 1 16 . 1 1 33 33 ASN H H 33 7.396 7.396 7.572 -0.175 25447
6477 1 16 . 1 1 34 34 GLY N N 34 106.957 106.957 105.788 1.169 25447
6478 1 16 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.801 0.806 25447
6479 1 16 . 1 1 34 34 GLY H H 34 7.618 7.618 7.933 -0.315 25447
6480 1 16 . 1 1 35 35 VAL N N 35 120.424 120.424 118.424 2.000 25447
6481 1 16 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.033 0.733 25447
6482 1 16 . 1 1 35 35 VAL CA C 35 65.125 65.125 64.313 0.812 25447
6483 1 16 . 1 1 35 35 VAL CB C 35 31.879 31.879 31.652 0.227 25447
6484 1 16 . 1 1 35 35 VAL H H 35 7.792 7.792 7.744 0.048 25447
6485 1 16 . 1 1 36 36 ILE N N 36 116.364 116.364 120.548 -4.184 25447
6486 1 16 . 1 1 36 36 ILE HA H 36 3.737 3.737 3.815 -0.078 25447
6487 1 16 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.467 -0.782 25447
6488 1 16 . 1 1 36 36 ILE CB C 36 38.807 38.807 37.450 1.357 25447
6489 1 16 . 1 1 36 36 ILE H H 36 7.331 7.331 7.706 -0.375 25447
6490 1 16 . 1 1 37 37 ASP N N 37 127.306 127.306 127.847 -0.541 25447
6491 1 16 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.769 -0.105 25447
6492 1 16 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.753 -1.137 25447
6493 1 16 . 1 1 37 37 ASP CB C 37 41.209 41.209 42.952 -1.743 25447
6494 1 16 . 1 1 37 37 ASP H H 37 7.874 7.874 7.899 -0.025 25447
6495 1 16 . 1 1 38 38 ALA N N 38 120.352 120.352 123.133 -2.781 25447
6496 1 16 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.080 -0.085 25447
6497 1 16 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.417 0.875 25447
6498 1 16 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.603 -0.291 25447
6499 1 16 . 1 1 38 38 ALA H H 38 8.244 8.244 8.385 -0.141 25447
6500 1 16 . 1 1 39 39 LEU N N 39 117.438 117.438 118.246 -0.808 25447
6501 1 16 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.171 0.079 25447
6502 1 16 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.034 0.321 25447
6503 1 16 . 1 1 39 39 LEU CB C 39 41.236 41.236 41.126 0.110 25447
6504 1 16 . 1 1 39 39 LEU H H 39 7.688 7.688 8.431 -0.743 25447
6505 1 16 . 1 1 40 40 GLY N N 40 112.015 112.015 108.136 3.879 25447
6506 1 16 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.181 0.918 25447
6507 1 16 . 1 1 40 40 GLY H H 40 8.732 8.732 8.240 0.492 25447
6508 1 16 . 1 1 41 41 LEU N N 41 122.983 122.983 123.422 -0.439 25447
6509 1 16 . 1 1 41 41 LEU HA H 41 3.851 3.851 4.043 -0.192 25447
6510 1 16 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.738 0.594 25447
6511 1 16 . 1 1 41 41 LEU CB C 41 41.639 41.639 42.045 -0.407 25447
6512 1 16 . 1 1 41 41 LEU H H 41 8.548 8.548 8.434 0.114 25447
6513 1 16 . 1 1 42 42 LEU N N 42 116.076 116.076 120.035 -3.959 25447
6514 1 16 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.891 0.137 25447
6515 1 16 . 1 1 42 42 LEU CA C 42 58.064 58.064 58.511 -0.447 25447
6516 1 16 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.811 -0.871 25447
6517 1 16 . 1 1 42 42 LEU H H 42 7.168 7.168 7.625 -0.457 25447
6518 1 16 . 1 1 43 43 LYS N N 43 119.831 119.831 119.086 0.745 25447
6519 1 16 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.045 0.239 25447
6520 1 16 . 1 1 43 43 LYS CA C 43 59.644 59.644 59.993 -0.349 25447
6521 1 16 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.319 0.208 25447
6522 1 16 . 1 1 43 43 LYS H H 43 7.640 7.640 8.372 -0.732 25447
6523 1 16 . 1 1 44 44 VAL N N 44 121.046 121.046 120.497 0.549 25447
6524 1 16 . 1 1 44 44 VAL HA H 44 3.949 3.949 4.136 -0.187 25447
6525 1 16 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.729 -0.086 25447
6526 1 16 . 1 1 44 44 VAL H H 44 8.269 8.269 7.941 0.328 25447
6527 1 16 . 1 1 45 45 ILE N N 45 119.333 119.333 119.579 -0.246 25447
6528 1 16 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.577 -0.173 25447
6529 1 16 . 1 1 45 45 ILE CA C 45 66.148 66.148 64.685 1.463 25447
6530 1 16 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.210 1.067 25447
6531 1 16 . 1 1 45 45 ILE H H 45 8.145 8.145 7.715 0.430 25447
6532 1 16 . 1 1 46 46 ALA N N 46 121.213 121.213 123.367 -2.154 25447
6533 1 16 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.141 0.116 25447
6534 1 16 . 1 1 46 46 ALA CA C 46 55.164 55.164 55.240 -0.076 25447
6535 1 16 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.242 0.126 25447
6536 1 16 . 1 1 46 46 ALA H H 46 7.792 7.792 8.158 -0.366 25447
6537 1 16 . 1 1 47 47 TRP N N 47 121.416 121.416 119.816 1.600 25447
6538 1 16 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.516 -0.282 25447
6539 1 16 . 1 1 47 47 TRP CA C 47 61.670 61.670 60.020 1.651 25447
6540 1 16 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.752 -1.513 25447
6541 1 16 . 1 1 47 47 TRP H H 47 8.093 8.093 8.098 -0.005 25447
6542 1 16 . 1 1 48 48 LEU N N 48 118.963 118.963 121.039 -2.076 25447
6543 1 16 . 1 1 48 48 LEU HA H 48 3.586 3.586 3.117 0.469 25447
6544 1 16 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.392 0.803 25447
6545 1 16 . 1 1 48 48 LEU CB C 48 42.251 42.251 40.747 1.504 25447
6546 1 16 . 1 1 48 48 LEU H H 48 8.693 8.693 7.596 1.097 25447
6547 1 16 . 1 1 49 49 GLU N N 49 119.131 119.131 118.059 1.072 25447
6548 1 16 . 1 1 49 49 GLU HA H 49 4.050 4.050 4.047 0.003 25447
6549 1 16 . 1 1 49 49 GLU CA C 49 59.862 59.862 58.980 0.882 25447
6550 1 16 . 1 1 49 49 GLU CB C 49 29.586 29.586 28.837 0.749 25447
6551 1 16 . 1 1 49 49 GLU H H 49 7.771 7.771 7.941 -0.170 25447
6552 1 16 . 1 1 50 50 ASP N N 50 119.941 119.941 120.531 -0.590 25447
6553 1 16 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.426 -0.189 25447
6554 1 16 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.228 1.127 25447
6555 1 16 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.794 1.589 25447
6556 1 16 . 1 1 50 50 ASP H H 50 7.697 7.697 7.755 -0.058 25447
6557 1 16 . 1 1 51 51 ARG N N 51 116.911 116.911 117.787 -0.876 25447
6558 1 16 . 1 1 51 51 ARG HA H 51 3.736 3.736 3.995 -0.259 25447
6559 1 16 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.369 -2.005 25447
6560 1 16 . 1 1 51 51 ARG CB C 51 29.315 29.315 30.467 -1.152 25447
6561 1 16 . 1 1 51 51 ARG H H 51 8.881 8.881 7.932 0.949 25447
6562 1 16 . 1 1 52 52 PHE N N 52 112.328 112.328 115.224 -2.896 25447
6563 1 16 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.659 0.016 25447
6564 1 16 . 1 1 52 52 PHE CA C 52 57.413 57.413 57.962 -0.549 25447
6565 1 16 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.640 1.252 25447
6566 1 16 . 1 1 52 52 PHE H H 52 7.284 7.284 7.574 -0.290 25447
6567 1 16 . 1 1 53 53 GLY N N 53 109.826 109.826 109.664 0.162 25447
6568 1 16 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.621 1.179 25447
6569 1 16 . 1 1 53 53 GLY H H 53 7.427 7.427 8.439 -1.012 25447
6570 1 16 . 1 1 54 54 ILE N N 54 119.127 119.127 117.029 2.098 25447
6571 1 16 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.309 -0.358 25447
6572 1 16 . 1 1 54 54 ILE CA C 54 60.685 60.685 60.085 0.600 25447
6573 1 16 . 1 1 54 54 ILE CB C 54 39.490 39.490 38.024 1.466 25447
6574 1 16 . 1 1 54 54 ILE H H 54 6.876 6.876 7.413 -0.537 25447
6575 1 16 . 1 1 55 55 ALA N N 55 129.823 129.823 129.173 0.650 25447
6576 1 16 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.265 0.149 25447
6577 1 16 . 1 1 55 55 ALA CA C 55 51.610 51.610 51.892 -0.282 25447
6578 1 16 . 1 1 55 55 ALA CB C 55 19.262 19.262 20.167 -0.905 25447
6579 1 16 . 1 1 55 55 ALA H H 55 8.499 8.499 8.521 -0.022 25447
6580 1 16 . 1 1 56 56 ALA N N 56 126.300 126.300 125.364 0.936 25447
6581 1 16 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.098 0.171 25447
6582 1 16 . 1 1 56 56 ALA CA C 56 53.474 53.474 54.489 -1.015 25447
6583 1 16 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.621 0.623 25447
6584 1 16 . 1 1 56 56 ALA H H 56 8.641 8.641 8.749 -0.108 25447
6585 1 16 . 1 1 57 57 ASP N N 57 116.395 116.395 117.417 -1.022 25447
6586 1 16 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.400 0.079 25447
6587 1 16 . 1 1 57 57 ASP CA C 57 55.226 55.226 56.339 -1.113 25447
6588 1 16 . 1 1 57 57 ASP CB C 57 40.922 40.922 39.989 0.933 25447
6589 1 16 . 1 1 57 57 ASP H H 57 8.337 8.337 8.628 -0.291 25447
6590 1 16 . 1 1 58 58 ASP N N 58 118.557 118.557 118.341 0.216 25447
6591 1 16 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.476 0.160 25447
6592 1 16 . 1 1 58 58 ASP CA C 58 55.144 55.144 55.770 -0.625 25447
6593 1 16 . 1 1 58 58 ASP CB C 58 41.504 41.504 41.337 0.167 25447
6594 1 16 . 1 1 58 58 ASP H H 58 8.027 8.027 7.880 0.147 25447
6595 1 16 . 1 1 59 59 VAL N N 59 118.898 118.898 118.625 0.273 25447
6596 1 16 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.223 -0.047 25447
6597 1 16 . 1 1 59 59 VAL CA C 59 62.300 62.300 61.248 1.052 25447
6598 1 16 . 1 1 59 59 VAL CB C 59 33.078 33.078 34.284 -1.206 25447
6599 1 16 . 1 1 59 59 VAL H H 59 7.716 7.716 7.368 0.348 25447
6600 1 16 . 1 1 60 60 GLU N N 60 122.888 122.888 126.187 -3.299 25447
6601 1 16 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.378 -0.094 25447
6602 1 16 . 1 1 60 60 GLU CA C 60 56.546 56.546 55.914 0.632 25447
6603 1 16 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.586 -0.804 25447
6604 1 16 . 1 1 60 60 GLU H H 60 8.367 8.367 8.405 -0.038 25447
6605 1 16 . 1 1 61 61 LEU N N 61 124.827 124.827 126.098 -1.271 25447
6606 1 16 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.540 -0.182 25447
6607 1 16 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.030 0.786 25447
6608 1 16 . 1 1 61 61 LEU CB C 61 41.937 41.937 41.968 -0.031 25447
6609 1 16 . 1 1 61 61 LEU H H 61 8.198 8.198 8.414 -0.216 25447
6610 1 16 . 1 1 62 62 SER N N 62 118.715 118.715 120.351 -1.636 25447
6611 1 16 . 1 1 62 62 SER HA H 62 4.809 4.809 4.987 -0.178 25447
6612 1 16 . 1 1 62 62 SER CA C 62 55.732 55.732 55.478 0.254 25447
6613 1 16 . 1 1 62 62 SER CB C 62 64.017 64.017 65.116 -1.099 25447
6614 1 16 . 1 1 62 62 SER H H 62 8.137 8.137 8.260 -0.123 25447
6615 1 16 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.276 -0.023 25447
6616 1 16 . 1 1 63 63 PRO CA C 63 64.896 64.896 65.233 -0.337 25447
6617 1 16 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.868 0.184 25447
6618 1 16 . 1 1 64 64 GLU N N 64 116.554 116.554 119.154 -2.600 25447
6619 1 16 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.148 -0.275 25447
6620 1 16 . 1 1 64 64 GLU CA C 64 58.719 58.719 58.890 -0.171 25447
6621 1 16 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.243 -0.562 25447
6622 1 16 . 1 1 64 64 GLU H H 64 8.316 8.316 8.519 -0.203 25447
6623 1 16 . 1 1 65 65 HIS N N 65 115.487 115.487 120.230 -4.743 25447
6624 1 16 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.252 0.028 25447
6625 1 16 . 1 1 65 65 HIS CA C 65 57.652 57.652 58.443 -0.791 25447
6626 1 16 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.601 0.281 25447
6627 1 16 . 1 1 65 65 HIS H H 65 7.274 7.274 8.324 -1.050 25447
6628 1 16 . 1 1 66 66 PHE N N 66 116.127 116.127 116.379 -0.252 25447
6629 1 16 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.652 0.114 25447
6630 1 16 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.696 -1.913 25447
6631 1 16 . 1 1 66 66 PHE CB C 66 38.908 38.908 38.076 0.832 25447
6632 1 16 . 1 1 66 66 PHE H H 66 7.239 7.239 7.795 -0.556 25447
6633 1 16 . 1 1 67 67 ARG N N 67 112.468 112.468 119.447 -6.979 25447
6634 1 16 . 1 1 67 67 ARG HA H 67 4.085 4.085 3.991 0.094 25447
6635 1 16 . 1 1 67 67 ARG CA C 67 58.287 58.287 58.798 -0.511 25447
6636 1 16 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.611 1.149 25447
6637 1 16 . 1 1 67 67 ARG H H 67 6.628 6.628 7.927 -1.299 25447
6638 1 16 . 1 1 68 68 SER N N 68 109.305 109.305 110.156 -0.851 25447
6639 1 16 . 1 1 68 68 SER HA H 68 4.980 4.980 4.684 0.296 25447
6640 1 16 . 1 1 68 68 SER CA C 68 55.785 55.785 57.171 -1.386 25447
6641 1 16 . 1 1 68 68 SER CB C 68 67.691 67.691 64.897 2.795 25447
6642 1 16 . 1 1 68 68 SER H H 68 8.145 8.145 7.441 0.704 25447
6643 1 16 . 1 1 69 69 ILE N N 69 122.602 122.602 123.344 -0.742 25447
6644 1 16 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.755 -0.079 25447
6645 1 16 . 1 1 69 69 ILE CA C 69 66.754 66.754 65.132 1.622 25447
6646 1 16 . 1 1 69 69 ILE CB C 69 37.296 37.296 37.660 -0.363 25447
6647 1 16 . 1 1 69 69 ILE H H 69 9.775 9.775 9.055 0.720 25447
6648 1 16 . 1 1 70 70 ARG N N 70 118.764 118.764 118.837 -0.073 25447
6649 1 16 . 1 1 70 70 ARG HA H 70 3.955 3.955 4.042 -0.087 25447
6650 1 16 . 1 1 70 70 ARG CA C 70 60.533 60.533 59.595 0.938 25447
6651 1 16 . 1 1 70 70 ARG CB C 70 30.418 30.418 29.900 0.518 25447
6652 1 16 . 1 1 70 70 ARG H H 70 8.910 8.910 7.676 1.234 25447
6653 1 16 . 1 1 71 71 SER N N 71 117.670 117.670 115.546 2.124 25447
6654 1 16 . 1 1 71 71 SER HA H 71 4.330 4.330 4.208 0.122 25447
6655 1 16 . 1 1 71 71 SER CA C 71 62.287 62.287 61.192 1.095 25447
6656 1 16 . 1 1 71 71 SER CB C 71 63.278 63.278 61.989 1.289 25447
6657 1 16 . 1 1 71 71 SER H H 71 8.518 8.518 7.732 0.786 25447
6658 1 16 . 1 1 72 72 ILE N N 72 127.447 127.447 123.913 3.534 25447
6659 1 16 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.426 0.484 25447
6660 1 16 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.879 0.931 25447
6661 1 16 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.491 0.907 25447
6662 1 16 . 1 1 72 72 ILE H H 72 8.762 8.762 7.237 1.525 25447
6663 1 16 . 1 1 73 73 ASP N N 73 121.636 121.636 120.032 1.604 25447
6664 1 16 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.383 -0.370 25447
6665 1 16 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.238 1.910 25447
6666 1 16 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.711 2.829 25447
6667 1 16 . 1 1 73 73 ASP H H 73 8.677 8.677 7.923 0.754 25447
6668 1 16 . 1 1 74 74 ALA N N 74 118.793 118.793 121.891 -3.098 25447
6669 1 16 . 1 1 74 74 ALA HA H 74 4.044 4.044 3.981 0.063 25447
6670 1 16 . 1 1 74 74 ALA CA C 74 55.321 55.321 55.218 0.103 25447
6671 1 16 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.461 -0.516 25447
6672 1 16 . 1 1 74 74 ALA H H 74 8.005 8.005 7.717 0.288 25447
6673 1 16 . 1 1 75 75 PHE N N 75 121.235 121.235 119.944 1.291 25447
6674 1 16 . 1 1 75 75 PHE HA H 75 4.038 4.038 4.080 -0.042 25447
6675 1 16 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.929 -0.914 25447
6676 1 16 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.368 -0.531 25447
6677 1 16 . 1 1 75 75 PHE H H 75 8.353 8.353 8.524 -0.171 25447
6678 1 16 . 1 1 76 76 VAL N N 76 120.866 120.866 119.459 1.407 25447
6679 1 16 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.273 -0.330 25447
6680 1 16 . 1 1 76 76 VAL CA C 76 66.901 66.901 67.240 -0.339 25447
6681 1 16 . 1 1 76 76 VAL CB C 76 31.247 31.247 31.789 -0.542 25447
6682 1 16 . 1 1 76 76 VAL H H 76 8.544 8.544 7.969 0.575 25447
6683 1 16 . 1 1 77 77 VAL N N 77 121.408 121.408 120.070 1.338 25447
6684 1 16 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.700 -0.205 25447
6685 1 16 . 1 1 77 77 VAL CA C 77 66.833 66.833 66.309 0.524 25447
6686 1 16 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.729 0.201 25447
6687 1 16 . 1 1 77 77 VAL H H 77 8.708 8.708 7.936 0.772 25447
6688 1 16 . 1 1 78 78 GLY N N 78 106.402 106.402 107.273 -0.871 25447
6689 1 16 . 1 1 78 78 GLY CA C 78 46.840 46.840 47.010 -0.170 25447
6690 1 16 . 1 1 78 78 GLY H H 78 7.945 7.945 8.555 -0.610 25447
6691 1 16 . 1 1 79 79 ALA N N 79 121.146 121.146 122.563 -1.417 25447
6692 1 16 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.954 0.253 25447
6693 1 16 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.264 -1.335 25447
6694 1 16 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.416 0.845 25447
6695 1 16 . 1 1 79 79 ALA H H 79 7.639 7.639 7.852 -0.213 25447
6696 1 16 . 1 1 80 80 THR N N 80 107.668 107.668 109.862 -2.194 25447
6697 1 16 . 1 1 80 80 THR HA H 80 4.443 4.443 4.250 0.193 25447
6698 1 16 . 1 1 80 80 THR CA C 80 61.406 61.406 63.122 -1.716 25447
6699 1 16 . 1 1 80 80 THR CB C 80 70.767 70.767 69.629 1.138 25447
6700 1 16 . 1 1 80 80 THR H H 80 7.449 7.449 7.770 -0.321 25447
6701 1 16 . 1 1 81 81 THR N N 81 119.953 119.953 116.370 3.583 25447
6702 1 16 . 1 1 81 81 THR HA H 81 4.665 4.665 4.818 -0.153 25447
6703 1 16 . 1 1 81 81 THR CA C 81 60.412 60.412 59.241 1.171 25447
6704 1 16 . 1 1 81 81 THR CB C 81 70.113 70.113 69.463 0.650 25447
6705 1 16 . 1 1 81 81 THR H H 81 7.685 7.685 7.972 -0.287 25447
6706 1 16 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.357 0.332 25447
6707 1 16 . 1 1 82 82 PRO CA C 82 61.688 61.688 62.571 -0.883 25447
6708 1 16 . 1 1 82 82 PRO CB C 82 30.969 30.969 30.779 0.190 25447
6709 1 16 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.275 0.206 25447
6710 1 16 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.974 -0.043 25447
6711 1 16 . 1 1 83 83 PRO CB C 83 32.193 32.193 31.892 0.301 25447
6712 1 16 . 1 1 84 84 VAL N N 84 120.691 120.691 121.917 -1.226 25447
6713 1 16 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.135 -0.042 25447
6714 1 16 . 1 1 84 84 VAL CA C 84 62.339 62.339 61.069 1.270 25447
6715 1 16 . 1 1 84 84 VAL CB C 84 32.851 32.851 32.429 0.422 25447
6716 1 16 . 1 1 84 84 VAL H H 84 8.257 8.257 8.161 0.096 25447
6717 1 16 . 1 1 85 85 GLU N N 85 127.655 127.655 122.546 5.109 25447
6718 1 16 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.874 0.410 25447
6719 1 16 . 1 1 85 85 GLU CA C 85 56.754 56.754 57.096 -0.342 25447
6720 1 16 . 1 1 85 85 GLU CB C 85 30.559 30.559 28.730 1.829 25447
6721 1 16 . 1 1 85 85 GLU H H 85 8.202 8.202 8.690 -0.488 25447
6722 1 16 . 1 1 86 86 ALA N N 86 126.437 126.437 119.578 6.859 25447
6723 1 16 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.024 0.027 25447
6724 1 16 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.561 -0.413 25447
6725 1 16 . 1 1 86 86 ALA CB C 86 19.460 19.460 18.382 1.078 25447
6726 1 16 . 1 1 86 86 ALA H H 86 8.323 8.323 7.974 0.349 25447
6727 1 16 . 1 1 87 87 LYS N N 87 121.796 121.796 123.469 -1.673 25447
6728 1 16 . 1 1 87 87 LYS HA H 87 4.347 4.347 3.938 0.409 25447
6729 1 16 . 1 1 87 87 LYS CA C 87 56.297 56.297 58.594 -2.297 25447
6730 1 16 . 1 1 87 87 LYS CB C 87 33.276 33.276 32.591 0.685 25447
6731 1 16 . 1 1 87 87 LYS H H 87 8.333 8.333 8.604 -0.271 25447
6732 1 16 . 1 1 88 88 LEU N N 88 125.576 125.576 116.953 8.623 25447
6733 1 16 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.133 -0.226 25447
6734 1 16 . 1 1 88 88 LEU CA C 88 55.772 55.772 56.413 -0.641 25447
6735 1 16 . 1 1 88 88 LEU CB C 88 42.472 42.472 41.925 0.547 25447
6736 1 16 . 1 1 88 88 LEU H H 88 8.444 8.444 7.951 0.493 25447
6737 1 17 . 1 1 1 1 MET N N 1 120.668 120.668 115.166 5.502 25447
6738 1 17 . 1 1 1 1 MET HA H 1 4.484 4.484 4.222 0.262 25447
6739 1 17 . 1 1 1 1 MET CA C 1 55.257 55.257 56.886 -1.629 25447
6740 1 17 . 1 1 1 1 MET CB C 1 34.517 34.517 33.065 1.452 25447
6741 1 17 . 1 1 1 1 MET H H 1 8.313 8.313 7.766 0.547 25447
6742 1 17 . 1 1 2 2 GLN N N 2 123.739 123.739 113.049 10.690 25447
6743 1 17 . 1 1 2 2 GLN HA H 2 4.030 4.030 3.682 0.348 25447
6744 1 17 . 1 1 2 2 GLN CA C 2 57.874 57.874 56.305 1.569 25447
6745 1 17 . 1 1 2 2 GLN CB C 2 29.938 29.938 26.682 3.256 25447
6746 1 17 . 1 1 2 2 GLN H H 2 9.455 9.455 7.606 1.849 25447
6747 1 17 . 1 1 3 3 HIS N N 3 119.115 119.115 109.710 9.405 25447
6748 1 17 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.285 0.831 25447
6749 1 17 . 1 1 3 3 HIS CA C 3 55.494 55.494 56.253 -0.759 25447
6750 1 17 . 1 1 3 3 HIS CB C 3 31.015 31.015 27.906 3.109 25447
6751 1 17 . 1 1 3 3 HIS H H 3 9.783 9.783 8.045 1.738 25447
6752 1 17 . 1 1 4 4 ALA N N 4 122.648 122.648 121.216 1.432 25447
6753 1 17 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.251 -0.348 25447
6754 1 17 . 1 1 4 4 ALA CA C 4 56.479 56.479 55.492 0.987 25447
6755 1 17 . 1 1 4 4 ALA CB C 4 19.194 19.194 19.226 -0.032 25447
6756 1 17 . 1 1 4 4 ALA H H 4 7.551 7.551 8.022 -0.471 25447
6757 1 17 . 1 1 5 5 SER N N 5 112.599 112.599 115.261 -2.662 25447
6758 1 17 . 1 1 5 5 SER HA H 5 4.298 4.298 4.187 0.111 25447
6759 1 17 . 1 1 5 5 SER CA C 5 62.117 62.117 61.664 0.453 25447
6760 1 17 . 1 1 5 5 SER CB C 5 62.334 62.334 62.699 -0.365 25447
6761 1 17 . 1 1 5 5 SER H H 5 8.736 8.736 8.482 0.254 25447
6762 1 17 . 1 1 6 6 VAL N N 6 122.866 122.866 122.550 0.316 25447
6763 1 17 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.802 0.303 25447
6764 1 17 . 1 1 6 6 VAL CA C 6 65.732 65.732 66.114 -0.382 25447
6765 1 17 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.659 1.078 25447
6766 1 17 . 1 1 6 6 VAL H H 6 7.660 7.660 7.743 -0.083 25447
6767 1 17 . 1 1 7 7 ILE N N 7 121.715 121.715 120.181 1.534 25447
6768 1 17 . 1 1 7 7 ILE HA H 7 4.224 4.224 3.810 0.414 25447
6769 1 17 . 1 1 7 7 ILE CA C 7 65.329 65.329 66.041 -0.712 25447
6770 1 17 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.563 1.130 25447
6771 1 17 . 1 1 7 7 ILE H H 7 8.519 8.519 7.654 0.865 25447
6772 1 17 . 1 1 8 8 ALA N N 8 121.373 121.373 121.575 -0.202 25447
6773 1 17 . 1 1 8 8 ALA HA H 8 3.895 3.895 3.998 -0.103 25447
6774 1 17 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.346 0.911 25447
6775 1 17 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.170 0.470 25447
6776 1 17 . 1 1 8 8 ALA H H 8 8.940 8.940 7.879 1.061 25447
6777 1 17 . 1 1 9 9 GLN N N 9 115.076 115.076 118.668 -3.592 25447
6778 1 17 . 1 1 9 9 GLN HA H 9 3.870 3.870 4.017 -0.147 25447
6779 1 17 . 1 1 9 9 GLN CA C 9 59.192 59.192 59.001 0.191 25447
6780 1 17 . 1 1 9 9 GLN CB C 9 28.138 28.138 29.079 -0.941 25447
6781 1 17 . 1 1 9 9 GLN H H 9 7.729 7.729 8.595 -0.866 25447
6782 1 17 . 1 1 10 10 PHE N N 10 120.207 120.207 120.893 -0.686 25447
6783 1 17 . 1 1 10 10 PHE HA H 10 4.085 4.085 4.297 -0.212 25447
6784 1 17 . 1 1 10 10 PHE CA C 10 60.893 60.893 60.354 0.539 25447
6785 1 17 . 1 1 10 10 PHE CB C 10 38.932 38.932 38.858 0.074 25447
6786 1 17 . 1 1 10 10 PHE H H 10 7.301 7.301 8.729 -1.428 25447
6787 1 17 . 1 1 11 11 VAL N N 11 117.569 117.569 120.374 -2.805 25447
6788 1 17 . 1 1 11 11 VAL HA H 11 3.307 3.307 2.513 0.794 25447
6789 1 17 . 1 1 11 11 VAL CA C 11 66.508 66.508 65.705 0.803 25447
6790 1 17 . 1 1 11 11 VAL CB C 11 31.487 31.487 31.659 -0.172 25447
6791 1 17 . 1 1 11 11 VAL H H 11 8.370 8.370 8.015 0.355 25447
6792 1 17 . 1 1 12 12 VAL N N 12 117.909 117.909 119.484 -1.575 25447
6793 1 17 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.449 0.292 25447
6794 1 17 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.923 -1.047 25447
6795 1 17 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.576 -0.264 25447
6796 1 17 . 1 1 12 12 VAL H H 12 8.294 8.294 7.665 0.629 25447
6797 1 17 . 1 1 13 13 GLU N N 13 117.918 117.918 119.621 -1.703 25447
6798 1 17 . 1 1 13 13 GLU HA H 13 3.742 3.742 3.977 -0.235 25447
6799 1 17 . 1 1 13 13 GLU CA C 13 59.307 59.307 59.011 0.296 25447
6800 1 17 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.397 0.092 25447
6801 1 17 . 1 1 13 13 GLU H H 13 7.750 7.750 7.707 0.043 25447
6802 1 17 . 1 1 14 14 GLU N N 14 113.478 113.478 118.381 -4.903 25447
6803 1 17 . 1 1 14 14 GLU HA H 14 3.778 3.778 3.987 -0.209 25447
6804 1 17 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.516 -1.716 25447
6805 1 17 . 1 1 14 14 GLU CB C 14 29.643 29.643 29.682 -0.039 25447
6806 1 17 . 1 1 14 14 GLU H H 14 7.603 7.603 7.759 -0.156 25447
6807 1 17 . 1 1 15 15 PHE N N 15 114.193 114.193 117.052 -2.859 25447
6808 1 17 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.446 0.493 25447
6809 1 17 . 1 1 15 15 PHE CA C 15 58.095 58.095 60.153 -2.058 25447
6810 1 17 . 1 1 15 15 PHE CB C 15 42.095 42.095 41.313 0.782 25447
6811 1 17 . 1 1 15 15 PHE H H 15 7.908 7.908 7.644 0.264 25447
6812 1 17 . 1 1 16 16 LEU N N 16 121.492 121.492 120.842 0.650 25447
6813 1 17 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.729 0.238 25447
6814 1 17 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.056 0.321 25447
6815 1 17 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.115 1.618 25447
6816 1 17 . 1 1 16 16 LEU H H 16 8.015 8.015 8.436 -0.421 25447
6817 1 17 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.385 -0.002 25447
6818 1 17 . 1 1 17 17 PRO CA C 17 64.858 64.858 64.177 0.681 25447
6819 1 17 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.747 0.082 25447
6820 1 17 . 1 1 18 18 ASP N N 18 116.508 116.508 118.392 -1.884 25447
6821 1 17 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.731 -0.163 25447
6822 1 17 . 1 1 18 18 ASP CA C 18 54.688 54.688 53.934 0.754 25447
6823 1 17 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.694 -0.068 25447
6824 1 17 . 1 1 18 18 ASP H H 18 8.399 8.399 8.594 -0.195 25447
6825 1 17 . 1 1 19 19 VAL N N 19 122.135 122.135 120.742 1.393 25447
6826 1 17 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.181 -0.063 25447
6827 1 17 . 1 1 19 19 VAL CA C 19 61.293 61.293 60.632 0.661 25447
6828 1 17 . 1 1 19 19 VAL CB C 19 33.582 33.582 33.995 -0.413 25447
6829 1 17 . 1 1 19 19 VAL H H 19 7.760 7.760 7.297 0.463 25447
6830 1 17 . 1 1 20 20 ALA N N 20 129.301 129.301 130.503 -1.202 25447
6831 1 17 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.577 0.022 25447
6832 1 17 . 1 1 20 20 ALA CA C 20 50.270 50.270 49.958 0.312 25447
6833 1 17 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.293 -0.865 25447
6834 1 17 . 1 1 20 20 ALA H H 20 8.761 8.761 8.309 0.452 25447
6835 1 17 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.148 -0.071 25447
6836 1 17 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.387 0.816 25447
6837 1 17 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.809 -0.401 25447
6838 1 17 . 1 1 22 22 ALA N N 22 116.106 116.106 118.135 -2.029 25447
6839 1 17 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.130 -0.013 25447
6840 1 17 . 1 1 22 22 ALA CA C 22 53.996 53.996 54.203 -0.207 25447
6841 1 17 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.233 0.611 25447
6842 1 17 . 1 1 22 22 ALA H H 22 8.064 8.064 7.918 0.146 25447
6843 1 17 . 1 1 23 23 ASP N N 23 115.541 115.541 117.814 -2.273 25447
6844 1 17 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.637 0.040 25447
6845 1 17 . 1 1 23 23 ASP CA C 23 54.336 54.336 54.015 0.321 25447
6846 1 17 . 1 1 23 23 ASP CB C 23 41.353 41.353 41.167 0.186 25447
6847 1 17 . 1 1 23 23 ASP H H 23 8.003 8.003 8.113 -0.110 25447
6848 1 17 . 1 1 24 24 VAL N N 24 121.517 121.517 120.837 0.680 25447
6849 1 17 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.163 -0.342 25447
6850 1 17 . 1 1 24 24 VAL CA C 24 62.345 62.345 61.706 0.638 25447
6851 1 17 . 1 1 24 24 VAL CB C 24 31.733 31.733 33.426 -1.693 25447
6852 1 17 . 1 1 24 24 VAL H H 24 7.069 7.069 7.450 -0.381 25447
6853 1 17 . 1 1 25 25 ASP N N 25 129.329 129.329 128.098 1.231 25447
6854 1 17 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.826 -0.252 25447
6855 1 17 . 1 1 25 25 ASP CA C 25 54.566 54.566 53.123 1.443 25447
6856 1 17 . 1 1 25 25 ASP CB C 25 42.333 42.333 41.883 0.450 25447
6857 1 17 . 1 1 25 25 ASP H H 25 8.474 8.474 8.744 -0.270 25447
6858 1 17 . 1 1 26 26 VAL N N 26 121.920 121.920 121.161 0.759 25447
6859 1 17 . 1 1 26 26 VAL HA H 26 4.108 4.108 3.965 0.143 25447
6860 1 17 . 1 1 26 26 VAL CA C 26 64.518 64.518 63.352 1.166 25447
6861 1 17 . 1 1 26 26 VAL CB C 26 31.198 31.198 31.683 -0.485 25447
6862 1 17 . 1 1 26 26 VAL H H 26 8.591 8.591 8.666 -0.075 25447
6863 1 17 . 1 1 27 27 ASP N N 27 116.286 116.286 118.128 -1.842 25447
6864 1 17 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.660 0.485 25447
6865 1 17 . 1 1 27 27 ASP CA C 27 54.181 54.181 54.728 -0.547 25447
6866 1 17 . 1 1 27 27 ASP CB C 27 42.575 42.575 40.837 1.738 25447
6867 1 17 . 1 1 27 27 ASP H H 27 8.609 8.609 8.028 0.581 25447
6868 1 17 . 1 1 28 28 LEU N N 28 125.116 125.116 122.490 2.626 25447
6869 1 17 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.531 -0.520 25447
6870 1 17 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.340 1.748 25447
6871 1 17 . 1 1 28 28 LEU CB C 28 43.321 43.321 43.995 -0.674 25447
6872 1 17 . 1 1 28 28 LEU H H 28 7.374 7.374 7.392 -0.018 25447
6873 1 17 . 1 1 29 29 ASP N N 29 125.924 125.924 123.690 2.234 25447
6874 1 17 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.630 0.204 25447
6875 1 17 . 1 1 29 29 ASP CA C 29 53.920 53.920 54.852 -0.932 25447
6876 1 17 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.122 0.257 25447
6877 1 17 . 1 1 29 29 ASP H H 29 8.699 8.699 8.497 0.202 25447
6878 1 17 . 1 1 30 30 LEU N N 30 129.975 129.975 126.714 3.261 25447
6879 1 17 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.142 -0.225 25447
6880 1 17 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.267 -0.879 25447
6881 1 17 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.460 -0.221 25447
6882 1 17 . 1 1 30 30 LEU H H 30 9.718 9.718 8.015 1.703 25447
6883 1 17 . 1 1 31 31 VAL N N 31 121.212 121.212 118.057 3.155 25447
6884 1 17 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.540 0.653 25447
6885 1 17 . 1 1 31 31 VAL CA C 31 64.433 64.433 66.990 -2.557 25447
6886 1 17 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.510 0.665 25447
6887 1 17 . 1 1 31 31 VAL H H 31 8.163 8.163 7.338 0.825 25447
6888 1 17 . 1 1 32 32 ASP N N 32 124.893 124.893 118.371 6.522 25447
6889 1 17 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.323 0.035 25447
6890 1 17 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.693 0.532 25447
6891 1 17 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.620 0.115 25447
6892 1 17 . 1 1 32 32 ASP H H 32 9.385 9.385 8.694 0.691 25447
6893 1 17 . 1 1 33 33 ASN N N 33 111.484 111.484 116.615 -5.131 25447
6894 1 17 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.583 0.137 25447
6895 1 17 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.607 0.279 25447
6896 1 17 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.040 -0.034 25447
6897 1 17 . 1 1 33 33 ASN H H 33 7.396 7.396 7.636 -0.240 25447
6898 1 17 . 1 1 34 34 GLY N N 34 106.957 106.957 105.826 1.131 25447
6899 1 17 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.763 0.844 25447
6900 1 17 . 1 1 34 34 GLY H H 34 7.618 7.618 7.914 -0.296 25447
6901 1 17 . 1 1 35 35 VAL N N 35 120.424 120.424 118.596 1.828 25447
6902 1 17 . 1 1 35 35 VAL HA H 35 3.766 3.766 2.978 0.788 25447
6903 1 17 . 1 1 35 35 VAL CA C 35 65.125 65.125 63.982 1.143 25447
6904 1 17 . 1 1 35 35 VAL CB C 35 31.879 31.879 31.535 0.344 25447
6905 1 17 . 1 1 35 35 VAL H H 35 7.792 7.792 7.824 -0.032 25447
6906 1 17 . 1 1 36 36 ILE N N 36 116.364 116.364 119.467 -3.103 25447
6907 1 17 . 1 1 36 36 ILE HA H 36 3.737 3.737 3.844 -0.107 25447
6908 1 17 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.342 -0.657 25447
6909 1 17 . 1 1 36 36 ILE CB C 36 38.807 38.807 38.157 0.650 25447
6910 1 17 . 1 1 36 36 ILE H H 36 7.331 7.331 7.570 -0.239 25447
6911 1 17 . 1 1 37 37 ASP N N 37 127.306 127.306 125.941 1.365 25447
6912 1 17 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.635 0.029 25447
6913 1 17 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.852 -1.236 25447
6914 1 17 . 1 1 37 37 ASP CB C 37 41.209 41.209 43.612 -2.403 25447
6915 1 17 . 1 1 37 37 ASP H H 37 7.874 7.874 7.956 -0.082 25447
6916 1 17 . 1 1 38 38 ALA N N 38 120.352 120.352 122.690 -2.338 25447
6917 1 17 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.109 -0.114 25447
6918 1 17 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.297 0.994 25447
6919 1 17 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.481 -0.169 25447
6920 1 17 . 1 1 38 38 ALA H H 38 8.244 8.244 8.303 -0.059 25447
6921 1 17 . 1 1 39 39 LEU N N 39 117.438 117.438 119.411 -1.973 25447
6922 1 17 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.236 0.014 25447
6923 1 17 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.518 -0.163 25447
6924 1 17 . 1 1 39 39 LEU CB C 39 41.236 41.236 40.986 0.250 25447
6925 1 17 . 1 1 39 39 LEU H H 39 7.688 7.688 8.361 -0.673 25447
6926 1 17 . 1 1 40 40 GLY N N 40 112.015 112.015 107.232 4.783 25447
6927 1 17 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.171 0.928 25447
6928 1 17 . 1 1 40 40 GLY H H 40 8.732 8.732 8.291 0.441 25447
6929 1 17 . 1 1 41 41 LEU N N 41 122.983 122.983 122.818 0.165 25447
6930 1 17 . 1 1 41 41 LEU HA H 41 3.851 3.851 4.049 -0.198 25447
6931 1 17 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.494 0.838 25447
6932 1 17 . 1 1 41 41 LEU CB C 41 41.639 41.639 41.894 -0.255 25447
6933 1 17 . 1 1 41 41 LEU H H 41 8.548 8.548 8.081 0.467 25447
6934 1 17 . 1 1 42 42 LEU N N 42 116.076 116.076 120.023 -3.947 25447
6935 1 17 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.980 0.048 25447
6936 1 17 . 1 1 42 42 LEU CA C 42 58.064 58.064 58.021 0.043 25447
6937 1 17 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.504 -0.564 25447
6938 1 17 . 1 1 42 42 LEU H H 42 7.168 7.168 7.691 -0.523 25447
6939 1 17 . 1 1 43 43 LYS N N 43 119.831 119.831 119.035 0.796 25447
6940 1 17 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.096 0.188 25447
6941 1 17 . 1 1 43 43 LYS CA C 43 59.644 59.644 60.068 -0.424 25447
6942 1 17 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.315 0.212 25447
6943 1 17 . 1 1 43 43 LYS H H 43 7.640 7.640 8.290 -0.650 25447
6944 1 17 . 1 1 44 44 VAL N N 44 121.046 121.046 120.562 0.484 25447
6945 1 17 . 1 1 44 44 VAL HA H 44 3.949 3.949 4.097 -0.148 25447
6946 1 17 . 1 1 44 44 VAL CB C 44 31.643 31.643 32.061 -0.418 25447
6947 1 17 . 1 1 44 44 VAL H H 44 8.269 8.269 7.788 0.481 25447
6948 1 17 . 1 1 45 45 ILE N N 45 119.333 119.333 119.458 -0.125 25447
6949 1 17 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.690 -0.286 25447
6950 1 17 . 1 1 45 45 ILE CA C 45 66.148 66.148 64.675 1.473 25447
6951 1 17 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.380 0.896 25447
6952 1 17 . 1 1 45 45 ILE H H 45 8.145 8.145 7.798 0.347 25447
6953 1 17 . 1 1 46 46 ALA N N 46 121.213 121.213 123.452 -2.239 25447
6954 1 17 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.148 0.109 25447
6955 1 17 . 1 1 46 46 ALA CA C 46 55.164 55.164 55.236 -0.072 25447
6956 1 17 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.441 -0.073 25447
6957 1 17 . 1 1 46 46 ALA H H 46 7.792 7.792 8.197 -0.405 25447
6958 1 17 . 1 1 47 47 TRP N N 47 121.416 121.416 120.201 1.215 25447
6959 1 17 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.500 -0.266 25447
6960 1 17 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.794 1.876 25447
6961 1 17 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.597 -1.358 25447
6962 1 17 . 1 1 47 47 TRP H H 47 8.093 8.093 8.132 -0.039 25447
6963 1 17 . 1 1 48 48 LEU N N 48 118.963 118.963 121.154 -2.191 25447
6964 1 17 . 1 1 48 48 LEU HA H 48 3.586 3.586 2.843 0.743 25447
6965 1 17 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.807 0.388 25447
6966 1 17 . 1 1 48 48 LEU CB C 48 42.251 42.251 41.277 0.974 25447
6967 1 17 . 1 1 48 48 LEU H H 48 8.693 8.693 7.526 1.167 25447
6968 1 17 . 1 1 49 49 GLU N N 49 119.131 119.131 117.485 1.646 25447
6969 1 17 . 1 1 49 49 GLU HA H 49 4.050 4.050 4.002 0.048 25447
6970 1 17 . 1 1 49 49 GLU CA C 49 59.862 59.862 58.969 0.893 25447
6971 1 17 . 1 1 49 49 GLU CB C 49 29.586 29.586 28.802 0.784 25447
6972 1 17 . 1 1 49 49 GLU H H 49 7.771 7.771 7.877 -0.105 25447
6973 1 17 . 1 1 50 50 ASP N N 50 119.941 119.941 120.120 -0.179 25447
6974 1 17 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.404 -0.167 25447
6975 1 17 . 1 1 50 50 ASP CA C 50 57.355 57.355 57.044 0.311 25447
6976 1 17 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.961 1.422 25447
6977 1 17 . 1 1 50 50 ASP H H 50 7.697 7.697 7.598 0.099 25447
6978 1 17 . 1 1 51 51 ARG N N 51 116.911 116.911 118.028 -1.117 25447
6979 1 17 . 1 1 51 51 ARG HA H 51 3.736 3.736 3.987 -0.251 25447
6980 1 17 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.478 -2.114 25447
6981 1 17 . 1 1 51 51 ARG CB C 51 29.315 29.315 30.288 -0.973 25447
6982 1 17 . 1 1 51 51 ARG H H 51 8.881 8.881 7.833 1.048 25447
6983 1 17 . 1 1 52 52 PHE N N 52 112.328 112.328 116.563 -4.235 25447
6984 1 17 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.638 0.037 25447
6985 1 17 . 1 1 52 52 PHE CA C 52 57.413 57.413 57.928 -0.515 25447
6986 1 17 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.158 1.734 25447
6987 1 17 . 1 1 52 52 PHE H H 52 7.284 7.284 7.603 -0.319 25447
6988 1 17 . 1 1 53 53 GLY N N 53 109.826 109.826 108.710 1.116 25447
6989 1 17 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.631 1.170 25447
6990 1 17 . 1 1 53 53 GLY H H 53 7.427 7.427 7.807 -0.380 25447
6991 1 17 . 1 1 54 54 ILE N N 54 119.127 119.127 115.364 3.763 25447
6992 1 17 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.500 -0.549 25447
6993 1 17 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.677 1.008 25447
6994 1 17 . 1 1 54 54 ILE CB C 54 39.490 39.490 39.671 -0.181 25447
6995 1 17 . 1 1 54 54 ILE H H 54 6.876 6.876 7.598 -0.722 25447
6996 1 17 . 1 1 55 55 ALA N N 55 129.823 129.823 125.297 4.526 25447
6997 1 17 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.555 -0.141 25447
6998 1 17 . 1 1 55 55 ALA CA C 55 51.610 51.610 51.058 0.552 25447
6999 1 17 . 1 1 55 55 ALA CB C 55 19.262 19.262 20.288 -1.026 25447
7000 1 17 . 1 1 55 55 ALA H H 55 8.499 8.499 8.113 0.386 25447
7001 1 17 . 1 1 56 56 ALA N N 56 126.300 126.300 124.041 2.259 25447
7002 1 17 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.107 0.162 25447
7003 1 17 . 1 1 56 56 ALA CA C 56 53.474 53.474 53.279 0.195 25447
7004 1 17 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.791 0.453 25447
7005 1 17 . 1 1 56 56 ALA H H 56 8.641 8.641 8.558 0.083 25447
7006 1 17 . 1 1 57 57 ASP N N 57 116.395 116.395 116.726 -0.331 25447
7007 1 17 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.431 0.048 25447
7008 1 17 . 1 1 57 57 ASP CA C 57 55.226 55.226 54.381 0.845 25447
7009 1 17 . 1 1 57 57 ASP CB C 57 40.922 40.922 39.706 1.216 25447
7010 1 17 . 1 1 57 57 ASP H H 57 8.337 8.337 8.045 0.292 25447
7011 1 17 . 1 1 58 58 ASP N N 58 118.557 118.557 116.580 1.977 25447
7012 1 17 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.303 0.333 25447
7013 1 17 . 1 1 58 58 ASP CA C 58 55.144 55.144 54.940 0.204 25447
7014 1 17 . 1 1 58 58 ASP CB C 58 41.504 41.504 39.512 1.992 25447
7015 1 17 . 1 1 58 58 ASP H H 58 8.027 8.027 8.532 -0.505 25447
7016 1 17 . 1 1 59 59 VAL N N 59 118.898 118.898 117.873 1.025 25447
7017 1 17 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.363 -0.187 25447
7018 1 17 . 1 1 59 59 VAL CA C 59 62.300 62.300 60.975 1.325 25447
7019 1 17 . 1 1 59 59 VAL CB C 59 33.078 33.078 34.515 -1.437 25447
7020 1 17 . 1 1 59 59 VAL H H 59 7.716 7.716 7.430 0.286 25447
7021 1 17 . 1 1 60 60 GLU N N 60 122.888 122.888 126.655 -3.767 25447
7022 1 17 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.540 -0.256 25447
7023 1 17 . 1 1 60 60 GLU CA C 60 56.546 56.546 55.532 1.014 25447
7024 1 17 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.772 -0.990 25447
7025 1 17 . 1 1 60 60 GLU H H 60 8.367 8.367 8.455 -0.088 25447
7026 1 17 . 1 1 61 61 LEU N N 61 124.827 124.827 124.190 0.637 25447
7027 1 17 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.612 -0.254 25447
7028 1 17 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.332 0.484 25447
7029 1 17 . 1 1 61 61 LEU CB C 61 41.937 41.937 43.193 -1.256 25447
7030 1 17 . 1 1 61 61 LEU H H 61 8.198 8.198 8.569 -0.371 25447
7031 1 17 . 1 1 62 62 SER N N 62 118.715 118.715 118.428 0.287 25447
7032 1 17 . 1 1 62 62 SER HA H 62 4.809 4.809 4.876 -0.067 25447
7033 1 17 . 1 1 62 62 SER CA C 62 55.732 55.732 55.647 0.085 25447
7034 1 17 . 1 1 62 62 SER CB C 62 64.017 64.017 64.339 -0.322 25447
7035 1 17 . 1 1 62 62 SER H H 62 8.137 8.137 8.290 -0.153 25447
7036 1 17 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.181 0.072 25447
7037 1 17 . 1 1 63 63 PRO CA C 63 64.896 64.896 65.129 -0.233 25447
7038 1 17 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.734 0.318 25447
7039 1 17 . 1 1 64 64 GLU N N 64 116.554 116.554 119.337 -2.783 25447
7040 1 17 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.114 -0.241 25447
7041 1 17 . 1 1 64 64 GLU CA C 64 58.719 58.719 59.143 -0.424 25447
7042 1 17 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.143 -0.462 25447
7043 1 17 . 1 1 64 64 GLU H H 64 8.316 8.316 8.429 -0.113 25447
7044 1 17 . 1 1 65 65 HIS N N 65 115.487 115.487 119.337 -3.850 25447
7045 1 17 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.266 0.014 25447
7046 1 17 . 1 1 65 65 HIS CA C 65 57.652 57.652 57.977 -0.325 25447
7047 1 17 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.638 0.244 25447
7048 1 17 . 1 1 65 65 HIS H H 65 7.274 7.274 8.054 -0.780 25447
7049 1 17 . 1 1 66 66 PHE N N 66 116.127 116.127 116.246 -0.119 25447
7050 1 17 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.444 0.322 25447
7051 1 17 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.570 -1.788 25447
7052 1 17 . 1 1 66 66 PHE CB C 66 38.908 38.908 37.489 1.419 25447
7053 1 17 . 1 1 66 66 PHE H H 66 7.239 7.239 7.782 -0.543 25447
7054 1 17 . 1 1 67 67 ARG N N 67 112.468 112.468 119.405 -6.937 25447
7055 1 17 . 1 1 67 67 ARG HA H 67 4.085 4.085 3.958 0.127 25447
7056 1 17 . 1 1 67 67 ARG CA C 67 58.287 58.287 59.026 -0.739 25447
7057 1 17 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.472 1.288 25447
7058 1 17 . 1 1 67 67 ARG H H 67 6.628 6.628 7.859 -1.231 25447
7059 1 17 . 1 1 68 68 SER N N 68 109.305 109.305 111.098 -1.793 25447
7060 1 17 . 1 1 68 68 SER HA H 68 4.980 4.980 4.734 0.246 25447
7061 1 17 . 1 1 68 68 SER CA C 68 55.785 55.785 56.519 -0.734 25447
7062 1 17 . 1 1 68 68 SER CB C 68 67.691 67.691 65.190 2.501 25447
7063 1 17 . 1 1 68 68 SER H H 68 8.145 8.145 7.461 0.684 25447
7064 1 17 . 1 1 69 69 ILE N N 69 122.602 122.602 124.294 -1.692 25447
7065 1 17 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.741 -0.065 25447
7066 1 17 . 1 1 69 69 ILE CA C 69 66.754 66.754 65.461 1.293 25447
7067 1 17 . 1 1 69 69 ILE CB C 69 37.296 37.296 37.484 -0.188 25447
7068 1 17 . 1 1 69 69 ILE H H 69 9.775 9.775 9.152 0.623 25447
7069 1 17 . 1 1 70 70 ARG N N 70 118.764 118.764 120.220 -1.456 25447
7070 1 17 . 1 1 70 70 ARG HA H 70 3.955 3.955 3.963 -0.008 25447
7071 1 17 . 1 1 70 70 ARG CA C 70 60.533 60.533 59.741 0.792 25447
7072 1 17 . 1 1 70 70 ARG CB C 70 30.418 30.418 28.993 1.425 25447
7073 1 17 . 1 1 70 70 ARG H H 70 8.910 8.910 7.655 1.255 25447
7074 1 17 . 1 1 71 71 SER N N 71 117.670 117.670 116.661 1.009 25447
7075 1 17 . 1 1 71 71 SER HA H 71 4.330 4.330 4.347 -0.017 25447
7076 1 17 . 1 1 71 71 SER CA C 71 62.287 62.287 61.468 0.819 25447
7077 1 17 . 1 1 71 71 SER CB C 71 63.278 63.278 62.819 0.459 25447
7078 1 17 . 1 1 71 71 SER H H 71 8.518 8.518 7.773 0.745 25447
7079 1 17 . 1 1 72 72 ILE N N 72 127.447 127.447 123.273 4.174 25447
7080 1 17 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.786 0.124 25447
7081 1 17 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.306 1.505 25447
7082 1 17 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.788 0.610 25447
7083 1 17 . 1 1 72 72 ILE H H 72 8.762 8.762 7.974 0.788 25447
7084 1 17 . 1 1 73 73 ASP N N 73 121.636 121.636 119.853 1.783 25447
7085 1 17 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.327 -0.314 25447
7086 1 17 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.230 1.918 25447
7087 1 17 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.777 2.763 25447
7088 1 17 . 1 1 73 73 ASP H H 73 8.677 8.677 8.150 0.527 25447
7089 1 17 . 1 1 74 74 ALA N N 74 118.793 118.793 122.088 -3.295 25447
7090 1 17 . 1 1 74 74 ALA HA H 74 4.044 4.044 4.003 0.041 25447
7091 1 17 . 1 1 74 74 ALA CA C 74 55.321 55.321 55.108 0.212 25447
7092 1 17 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.513 -0.568 25447
7093 1 17 . 1 1 74 74 ALA H H 74 8.005 8.005 8.049 -0.044 25447
7094 1 17 . 1 1 75 75 PHE N N 75 121.235 121.235 120.125 1.110 25447
7095 1 17 . 1 1 75 75 PHE HA H 75 4.038 4.038 4.006 0.032 25447
7096 1 17 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.856 -0.841 25447
7097 1 17 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.289 -0.452 25447
7098 1 17 . 1 1 75 75 PHE H H 75 8.353 8.353 8.451 -0.098 25447
7099 1 17 . 1 1 76 76 VAL N N 76 120.866 120.866 118.641 2.225 25447
7100 1 17 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.369 -0.426 25447
7101 1 17 . 1 1 76 76 VAL CA C 76 66.901 66.901 67.048 -0.147 25447
7102 1 17 . 1 1 76 76 VAL CB C 76 31.247 31.247 31.043 0.204 25447
7103 1 17 . 1 1 76 76 VAL H H 76 8.544 8.544 7.825 0.719 25447
7104 1 17 . 1 1 77 77 VAL N N 77 121.408 121.408 120.011 1.397 25447
7105 1 17 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.730 -0.235 25447
7106 1 17 . 1 1 77 77 VAL CA C 77 66.833 66.833 66.230 0.603 25447
7107 1 17 . 1 1 77 77 VAL CB C 77 31.930 31.930 30.923 1.007 25447
7108 1 17 . 1 1 77 77 VAL H H 77 8.708 8.708 7.907 0.801 25447
7109 1 17 . 1 1 78 78 GLY N N 78 106.402 106.402 107.533 -1.131 25447
7110 1 17 . 1 1 78 78 GLY CA C 78 46.840 46.840 47.180 -0.340 25447
7111 1 17 . 1 1 78 78 GLY H H 78 7.945 7.945 8.575 -0.630 25447
7112 1 17 . 1 1 79 79 ALA N N 79 121.146 121.146 122.861 -1.715 25447
7113 1 17 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.954 0.253 25447
7114 1 17 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.220 -1.291 25447
7115 1 17 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.285 0.976 25447
7116 1 17 . 1 1 79 79 ALA H H 79 7.639 7.639 7.585 0.054 25447
7117 1 17 . 1 1 80 80 THR N N 80 107.668 107.668 109.321 -1.653 25447
7118 1 17 . 1 1 80 80 THR HA H 80 4.443 4.443 4.208 0.235 25447
7119 1 17 . 1 1 80 80 THR CA C 80 61.406 61.406 63.011 -1.605 25447
7120 1 17 . 1 1 80 80 THR CB C 80 70.767 70.767 69.450 1.317 25447
7121 1 17 . 1 1 80 80 THR H H 80 7.449 7.449 7.811 -0.362 25447
7122 1 17 . 1 1 81 81 THR N N 81 119.953 119.953 115.607 4.346 25447
7123 1 17 . 1 1 81 81 THR HA H 81 4.665 4.665 4.785 -0.120 25447
7124 1 17 . 1 1 81 81 THR CA C 81 60.412 60.412 58.890 1.522 25447
7125 1 17 . 1 1 81 81 THR CB C 81 70.113 70.113 69.531 0.582 25447
7126 1 17 . 1 1 81 81 THR H H 81 7.685 7.685 7.915 -0.230 25447
7127 1 17 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.611 0.078 25447
7128 1 17 . 1 1 82 82 PRO CA C 82 61.688 61.688 61.896 -0.208 25447
7129 1 17 . 1 1 82 82 PRO CB C 82 30.969 30.969 30.841 0.128 25447
7130 1 17 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.411 0.070 25447
7131 1 17 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.630 0.301 25447
7132 1 17 . 1 1 83 83 PRO CB C 83 32.193 32.193 32.467 -0.274 25447
7133 1 17 . 1 1 84 84 VAL N N 84 120.691 120.691 122.312 -1.621 25447
7134 1 17 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.131 -0.038 25447
7135 1 17 . 1 1 84 84 VAL CA C 84 62.339 62.339 61.496 0.843 25447
7136 1 17 . 1 1 84 84 VAL CB C 84 32.851 32.851 32.591 0.260 25447
7137 1 17 . 1 1 84 84 VAL H H 84 8.257 8.257 8.246 0.011 25447
7138 1 17 . 1 1 85 85 GLU N N 85 127.655 127.655 121.950 5.705 25447
7139 1 17 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.917 0.367 25447
7140 1 17 . 1 1 85 85 GLU CA C 85 56.754 56.754 57.030 -0.276 25447
7141 1 17 . 1 1 85 85 GLU CB C 85 30.559 30.559 28.697 1.862 25447
7142 1 17 . 1 1 85 85 GLU H H 85 8.202 8.202 8.708 -0.506 25447
7143 1 17 . 1 1 86 86 ALA N N 86 126.437 126.437 119.502 6.935 25447
7144 1 17 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.010 0.041 25447
7145 1 17 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.376 -0.228 25447
7146 1 17 . 1 1 86 86 ALA CB C 86 19.460 19.460 18.797 0.662 25447
7147 1 17 . 1 1 86 86 ALA H H 86 8.323 8.323 7.614 0.709 25447
7148 1 17 . 1 1 87 87 LYS N N 87 121.796 121.796 119.753 2.043 25447
7149 1 17 . 1 1 87 87 LYS HA H 87 4.347 4.347 4.080 0.267 25447
7150 1 17 . 1 1 87 87 LYS CA C 87 56.297 56.297 58.057 -1.760 25447
7151 1 17 . 1 1 87 87 LYS CB C 87 33.276 33.276 32.682 0.594 25447
7152 1 17 . 1 1 87 87 LYS H H 87 8.333 8.333 8.507 -0.174 25447
7153 1 17 . 1 1 88 88 LEU N N 88 125.576 125.576 121.044 4.532 25447
7154 1 17 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.452 -0.545 25447
7155 1 17 . 1 1 88 88 LEU CA C 88 55.772 55.772 54.255 1.517 25447
7156 1 17 . 1 1 88 88 LEU CB C 88 42.472 42.472 42.464 0.008 25447
7157 1 17 . 1 1 88 88 LEU H H 88 8.444 8.444 7.662 0.782 25447
7158 1 18 . 1 1 1 1 MET N N 1 120.668 120.668 120.312 0.356 25447
7159 1 18 . 1 1 1 1 MET HA H 1 4.484 4.484 4.660 -0.176 25447
7160 1 18 . 1 1 1 1 MET CA C 1 55.257 55.257 55.828 -0.571 25447
7161 1 18 . 1 1 1 1 MET CB C 1 34.517 34.517 33.738 0.779 25447
7162 1 18 . 1 1 1 1 MET H H 1 8.313 8.313 8.426 -0.113 25447
7163 1 18 . 1 1 2 2 GLN N N 2 123.739 123.739 117.376 6.363 25447
7164 1 18 . 1 1 2 2 GLN HA H 2 4.030 4.030 4.341 -0.311 25447
7165 1 18 . 1 1 2 2 GLN CA C 2 57.874 57.874 57.117 0.757 25447
7166 1 18 . 1 1 2 2 GLN CB C 2 29.938 29.938 29.557 0.381 25447
7167 1 18 . 1 1 2 2 GLN H H 2 9.455 9.455 8.568 0.887 25447
7168 1 18 . 1 1 3 3 HIS N N 3 119.115 119.115 117.841 1.274 25447
7169 1 18 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.951 0.165 25447
7170 1 18 . 1 1 3 3 HIS CA C 3 55.494 55.494 55.434 0.059 25447
7171 1 18 . 1 1 3 3 HIS CB C 3 31.015 31.015 30.451 0.564 25447
7172 1 18 . 1 1 3 3 HIS H H 3 9.783 9.783 8.085 1.698 25447
7173 1 18 . 1 1 4 4 ALA N N 4 122.648 122.648 124.224 -1.576 25447
7174 1 18 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.072 -0.169 25447
7175 1 18 . 1 1 4 4 ALA CA C 4 56.479 56.479 55.875 0.604 25447
7176 1 18 . 1 1 4 4 ALA CB C 4 19.194 19.194 18.401 0.793 25447
7177 1 18 . 1 1 4 4 ALA H H 4 7.551 7.551 7.914 -0.363 25447
7178 1 18 . 1 1 5 5 SER N N 5 112.599 112.599 113.591 -0.992 25447
7179 1 18 . 1 1 5 5 SER HA H 5 4.298 4.298 4.180 0.118 25447
7180 1 18 . 1 1 5 5 SER CA C 5 62.117 62.117 62.087 0.030 25447
7181 1 18 . 1 1 5 5 SER CB C 5 62.334 62.334 62.416 -0.082 25447
7182 1 18 . 1 1 5 5 SER H H 5 8.736 8.736 8.523 0.213 25447
7183 1 18 . 1 1 6 6 VAL N N 6 122.866 122.866 122.493 0.373 25447
7184 1 18 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.833 0.272 25447
7185 1 18 . 1 1 6 6 VAL CA C 6 65.732 65.732 66.356 -0.624 25447
7186 1 18 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.667 1.070 25447
7187 1 18 . 1 1 6 6 VAL H H 6 7.660 7.660 7.330 0.330 25447
7188 1 18 . 1 1 7 7 ILE N N 7 121.715 121.715 120.194 1.521 25447
7189 1 18 . 1 1 7 7 ILE HA H 7 4.224 4.224 4.176 0.048 25447
7190 1 18 . 1 1 7 7 ILE CA C 7 65.329 65.329 65.980 -0.651 25447
7191 1 18 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.528 1.165 25447
7192 1 18 . 1 1 7 7 ILE H H 7 8.519 8.519 8.210 0.309 25447
7193 1 18 . 1 1 8 8 ALA N N 8 121.373 121.373 121.386 -0.013 25447
7194 1 18 . 1 1 8 8 ALA HA H 8 3.895 3.895 4.021 -0.126 25447
7195 1 18 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.365 0.892 25447
7196 1 18 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.020 0.620 25447
7197 1 18 . 1 1 8 8 ALA H H 8 8.940 8.940 8.104 0.836 25447
7198 1 18 . 1 1 9 9 GLN N N 9 115.076 115.076 119.205 -4.129 25447
7199 1 18 . 1 1 9 9 GLN HA H 9 3.870 3.870 3.958 -0.088 25447
7200 1 18 . 1 1 9 9 GLN CA C 9 59.192 59.192 58.970 0.222 25447
7201 1 18 . 1 1 9 9 GLN CB C 9 28.138 28.138 28.642 -0.504 25447
7202 1 18 . 1 1 9 9 GLN H H 9 7.729 7.729 7.856 -0.127 25447
7203 1 18 . 1 1 10 10 PHE N N 10 120.207 120.207 118.855 1.352 25447
7204 1 18 . 1 1 10 10 PHE HA H 10 4.085 4.085 3.852 0.233 25447
7205 1 18 . 1 1 10 10 PHE CA C 10 60.893 60.893 61.793 -0.900 25447
7206 1 18 . 1 1 10 10 PHE CB C 10 38.932 38.932 38.143 0.789 25447
7207 1 18 . 1 1 10 10 PHE H H 10 7.301 7.301 7.935 -0.634 25447
7208 1 18 . 1 1 11 11 VAL N N 11 117.569 117.569 117.274 0.295 25447
7209 1 18 . 1 1 11 11 VAL HA H 11 3.307 3.307 3.910 -0.603 25447
7210 1 18 . 1 1 11 11 VAL CA C 11 66.508 66.508 65.708 0.800 25447
7211 1 18 . 1 1 11 11 VAL CB C 11 31.487 31.487 31.462 0.025 25447
7212 1 18 . 1 1 11 11 VAL H H 11 8.370 8.370 7.854 0.516 25447
7213 1 18 . 1 1 12 12 VAL N N 12 117.909 117.909 121.031 -3.122 25447
7214 1 18 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.675 0.066 25447
7215 1 18 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.560 -0.684 25447
7216 1 18 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.060 0.252 25447
7217 1 18 . 1 1 12 12 VAL H H 12 8.294 8.294 8.107 0.187 25447
7218 1 18 . 1 1 13 13 GLU N N 13 117.918 117.918 119.100 -1.182 25447
7219 1 18 . 1 1 13 13 GLU HA H 13 3.742 3.742 4.017 -0.275 25447
7220 1 18 . 1 1 13 13 GLU CA C 13 59.307 59.307 58.869 0.438 25447
7221 1 18 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.294 0.195 25447
7222 1 18 . 1 1 13 13 GLU H H 13 7.750 7.750 8.183 -0.433 25447
7223 1 18 . 1 1 14 14 GLU N N 14 113.478 113.478 118.330 -4.852 25447
7224 1 18 . 1 1 14 14 GLU HA H 14 3.778 3.778 4.115 -0.337 25447
7225 1 18 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.910 -2.110 25447
7226 1 18 . 1 1 14 14 GLU CB C 14 29.643 29.643 30.114 -0.471 25447
7227 1 18 . 1 1 14 14 GLU H H 14 7.603 7.603 8.166 -0.563 25447
7228 1 18 . 1 1 15 15 PHE N N 15 114.193 114.193 115.504 -1.311 25447
7229 1 18 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.684 0.255 25447
7230 1 18 . 1 1 15 15 PHE CA C 15 58.095 58.095 58.934 -0.839 25447
7231 1 18 . 1 1 15 15 PHE CB C 15 42.095 42.095 42.331 -0.236 25447
7232 1 18 . 1 1 15 15 PHE H H 15 7.908 7.908 7.593 0.315 25447
7233 1 18 . 1 1 16 16 LEU N N 16 121.492 121.492 121.511 -0.019 25447
7234 1 18 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.771 0.196 25447
7235 1 18 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.087 0.289 25447
7236 1 18 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.296 1.437 25447
7237 1 18 . 1 1 16 16 LEU H H 16 8.015 8.015 7.969 0.046 25447
7238 1 18 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.419 -0.036 25447
7239 1 18 . 1 1 17 17 PRO CA C 17 64.858 64.858 63.867 0.991 25447
7240 1 18 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.803 0.026 25447
7241 1 18 . 1 1 18 18 ASP N N 18 116.508 116.508 118.140 -1.632 25447
7242 1 18 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.681 -0.113 25447
7243 1 18 . 1 1 18 18 ASP CA C 18 54.688 54.688 54.148 0.540 25447
7244 1 18 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.609 0.017 25447
7245 1 18 . 1 1 18 18 ASP H H 18 8.399 8.399 8.542 -0.143 25447
7246 1 18 . 1 1 19 19 VAL N N 19 122.135 122.135 120.526 1.609 25447
7247 1 18 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.156 -0.038 25447
7248 1 18 . 1 1 19 19 VAL CA C 19 61.293 61.293 60.328 0.965 25447
7249 1 18 . 1 1 19 19 VAL CB C 19 33.582 33.582 33.293 0.289 25447
7250 1 18 . 1 1 19 19 VAL H H 19 7.760 7.760 7.247 0.513 25447
7251 1 18 . 1 1 20 20 ALA N N 20 129.301 129.301 130.588 -1.287 25447
7252 1 18 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.543 0.056 25447
7253 1 18 . 1 1 20 20 ALA CA C 20 50.270 50.270 50.154 0.116 25447
7254 1 18 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.375 -0.948 25447
7255 1 18 . 1 1 20 20 ALA H H 20 8.761 8.761 8.491 0.270 25447
7256 1 18 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.175 -0.098 25447
7257 1 18 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.512 0.691 25447
7258 1 18 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.805 -0.397 25447
7259 1 18 . 1 1 22 22 ALA N N 22 116.106 116.106 118.348 -2.242 25447
7260 1 18 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.152 -0.035 25447
7261 1 18 . 1 1 22 22 ALA CA C 22 53.996 53.996 54.034 -0.038 25447
7262 1 18 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.363 0.481 25447
7263 1 18 . 1 1 22 22 ALA H H 22 8.064 8.064 7.989 0.075 25447
7264 1 18 . 1 1 23 23 ASP N N 23 115.541 115.541 116.310 -0.769 25447
7265 1 18 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.575 0.102 25447
7266 1 18 . 1 1 23 23 ASP CA C 23 54.336 54.336 53.722 0.614 25447
7267 1 18 . 1 1 23 23 ASP CB C 23 41.353 41.353 40.383 0.970 25447
7268 1 18 . 1 1 23 23 ASP H H 23 8.003 8.003 8.140 -0.137 25447
7269 1 18 . 1 1 24 24 VAL N N 24 121.517 121.517 121.326 0.191 25447
7270 1 18 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.170 -0.349 25447
7271 1 18 . 1 1 24 24 VAL CA C 24 62.345 62.345 61.627 0.718 25447
7272 1 18 . 1 1 24 24 VAL CB C 24 31.733 31.733 32.870 -1.137 25447
7273 1 18 . 1 1 24 24 VAL H H 24 7.069 7.069 7.564 -0.495 25447
7274 1 18 . 1 1 25 25 ASP N N 25 129.329 129.329 126.777 2.552 25447
7275 1 18 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.813 -0.239 25447
7276 1 18 . 1 1 25 25 ASP CA C 25 54.566 54.566 53.357 1.209 25447
7277 1 18 . 1 1 25 25 ASP CB C 25 42.333 42.333 41.773 0.560 25447
7278 1 18 . 1 1 25 25 ASP H H 25 8.474 8.474 8.687 -0.213 25447
7279 1 18 . 1 1 26 26 VAL N N 26 121.920 121.920 120.474 1.446 25447
7280 1 18 . 1 1 26 26 VAL HA H 26 4.108 4.108 4.000 0.108 25447
7281 1 18 . 1 1 26 26 VAL CA C 26 64.518 64.518 63.615 0.903 25447
7282 1 18 . 1 1 26 26 VAL CB C 26 31.198 31.198 32.003 -0.805 25447
7283 1 18 . 1 1 26 26 VAL H H 26 8.591 8.591 8.586 0.005 25447
7284 1 18 . 1 1 27 27 ASP N N 27 116.286 116.286 116.904 -0.618 25447
7285 1 18 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.593 0.552 25447
7286 1 18 . 1 1 27 27 ASP CA C 27 54.181 54.181 53.133 1.048 25447
7287 1 18 . 1 1 27 27 ASP CB C 27 42.575 42.575 40.437 2.138 25447
7288 1 18 . 1 1 27 27 ASP H H 27 8.609 8.609 8.111 0.498 25447
7289 1 18 . 1 1 28 28 LEU N N 28 125.116 125.116 122.212 2.904 25447
7290 1 18 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.541 -0.530 25447
7291 1 18 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.339 1.748 25447
7292 1 18 . 1 1 28 28 LEU CB C 28 43.321 43.321 44.116 -0.795 25447
7293 1 18 . 1 1 28 28 LEU H H 28 7.374 7.374 7.348 0.026 25447
7294 1 18 . 1 1 29 29 ASP N N 29 125.924 125.924 124.793 1.131 25447
7295 1 18 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.596 0.238 25447
7296 1 18 . 1 1 29 29 ASP CA C 29 53.920 53.920 54.898 -0.978 25447
7297 1 18 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.210 0.169 25447
7298 1 18 . 1 1 29 29 ASP H H 29 8.699 8.699 8.613 0.086 25447
7299 1 18 . 1 1 30 30 LEU N N 30 129.975 129.975 127.090 2.885 25447
7300 1 18 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.151 -0.234 25447
7301 1 18 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.352 -0.964 25447
7302 1 18 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.466 -0.227 25447
7303 1 18 . 1 1 30 30 LEU H H 30 9.718 9.718 8.274 1.444 25447
7304 1 18 . 1 1 31 31 VAL N N 31 121.212 121.212 118.332 2.880 25447
7305 1 18 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.659 0.534 25447
7306 1 18 . 1 1 31 31 VAL CA C 31 64.433 64.433 65.923 -1.490 25447
7307 1 18 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.224 0.950 25447
7308 1 18 . 1 1 31 31 VAL H H 31 8.163 8.163 7.746 0.417 25447
7309 1 18 . 1 1 32 32 ASP N N 32 124.893 124.893 119.363 5.530 25447
7310 1 18 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.330 0.028 25447
7311 1 18 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.748 0.477 25447
7312 1 18 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.116 0.619 25447
7313 1 18 . 1 1 32 32 ASP H H 32 9.385 9.385 8.750 0.635 25447
7314 1 18 . 1 1 33 33 ASN N N 33 111.484 111.484 116.235 -4.751 25447
7315 1 18 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.554 0.166 25447
7316 1 18 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.875 0.011 25447
7317 1 18 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.135 -0.129 25447
7318 1 18 . 1 1 33 33 ASN H H 33 7.396 7.396 7.508 -0.112 25447
7319 1 18 . 1 1 34 34 GLY N N 34 106.957 106.957 105.939 1.018 25447
7320 1 18 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.650 0.957 25447
7321 1 18 . 1 1 34 34 GLY H H 34 7.618 7.618 7.918 -0.300 25447
7322 1 18 . 1 1 35 35 VAL N N 35 120.424 120.424 119.224 1.200 25447
7323 1 18 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.603 0.163 25447
7324 1 18 . 1 1 35 35 VAL CA C 35 65.125 65.125 64.737 0.388 25447
7325 1 18 . 1 1 35 35 VAL CB C 35 31.879 31.879 31.917 -0.038 25447
7326 1 18 . 1 1 35 35 VAL H H 35 7.792 7.792 7.637 0.155 25447
7327 1 18 . 1 1 36 36 ILE N N 36 116.364 116.364 120.370 -4.006 25447
7328 1 18 . 1 1 36 36 ILE HA H 36 3.737 3.737 3.990 -0.253 25447
7329 1 18 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.190 -0.505 25447
7330 1 18 . 1 1 36 36 ILE CB C 36 38.807 38.807 37.894 0.913 25447
7331 1 18 . 1 1 36 36 ILE H H 36 7.331 7.331 7.782 -0.451 25447
7332 1 18 . 1 1 37 37 ASP N N 37 127.306 127.306 127.378 -0.072 25447
7333 1 18 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.756 -0.092 25447
7334 1 18 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.838 -1.222 25447
7335 1 18 . 1 1 37 37 ASP CB C 37 41.209 41.209 42.925 -1.716 25447
7336 1 18 . 1 1 37 37 ASP H H 37 7.874 7.874 8.057 -0.183 25447
7337 1 18 . 1 1 38 38 ALA N N 38 120.352 120.352 122.738 -2.386 25447
7338 1 18 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.067 -0.072 25447
7339 1 18 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.416 0.876 25447
7340 1 18 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.617 -0.305 25447
7341 1 18 . 1 1 38 38 ALA H H 38 8.244 8.244 8.338 -0.094 25447
7342 1 18 . 1 1 39 39 LEU N N 39 117.438 117.438 119.332 -1.894 25447
7343 1 18 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.216 0.034 25447
7344 1 18 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.481 -0.126 25447
7345 1 18 . 1 1 39 39 LEU CB C 39 41.236 41.236 40.955 0.281 25447
7346 1 18 . 1 1 39 39 LEU H H 39 7.688 7.688 8.324 -0.636 25447
7347 1 18 . 1 1 40 40 GLY N N 40 112.015 112.015 107.279 4.736 25447
7348 1 18 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.156 0.943 25447
7349 1 18 . 1 1 40 40 GLY H H 40 8.732 8.732 8.250 0.482 25447
7350 1 18 . 1 1 41 41 LEU N N 41 122.983 122.983 123.262 -0.279 25447
7351 1 18 . 1 1 41 41 LEU HA H 41 3.851 3.851 3.801 0.050 25447
7352 1 18 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.453 0.879 25447
7353 1 18 . 1 1 41 41 LEU CB C 41 41.639 41.639 41.834 -0.195 25447
7354 1 18 . 1 1 41 41 LEU H H 41 8.548 8.548 8.261 0.287 25447
7355 1 18 . 1 1 42 42 LEU N N 42 116.076 116.076 119.890 -3.814 25447
7356 1 18 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.828 0.200 25447
7357 1 18 . 1 1 42 42 LEU CA C 42 58.064 58.064 58.464 -0.400 25447
7358 1 18 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.758 -0.818 25447
7359 1 18 . 1 1 42 42 LEU H H 42 7.168 7.168 7.583 -0.415 25447
7360 1 18 . 1 1 43 43 LYS N N 43 119.831 119.831 119.027 0.804 25447
7361 1 18 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.027 0.257 25447
7362 1 18 . 1 1 43 43 LYS CA C 43 59.644 59.644 59.838 -0.194 25447
7363 1 18 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.266 0.261 25447
7364 1 18 . 1 1 43 43 LYS H H 43 7.640 7.640 8.225 -0.585 25447
7365 1 18 . 1 1 44 44 VAL N N 44 121.046 121.046 120.105 0.941 25447
7366 1 18 . 1 1 44 44 VAL HA H 44 3.949 3.949 4.015 -0.066 25447
7367 1 18 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.516 0.127 25447
7368 1 18 . 1 1 44 44 VAL H H 44 8.269 8.269 7.743 0.526 25447
7369 1 18 . 1 1 45 45 ILE N N 45 119.333 119.333 119.787 -0.454 25447
7370 1 18 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.680 -0.276 25447
7371 1 18 . 1 1 45 45 ILE CA C 45 66.148 66.148 64.732 1.416 25447
7372 1 18 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.159 1.118 25447
7373 1 18 . 1 1 45 45 ILE H H 45 8.145 8.145 7.771 0.374 25447
7374 1 18 . 1 1 46 46 ALA N N 46 121.213 121.213 123.442 -2.229 25447
7375 1 18 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.095 0.162 25447
7376 1 18 . 1 1 46 46 ALA CA C 46 55.164 55.164 55.218 -0.053 25447
7377 1 18 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.359 0.009 25447
7378 1 18 . 1 1 46 46 ALA H H 46 7.792 7.792 7.999 -0.207 25447
7379 1 18 . 1 1 47 47 TRP N N 47 121.416 121.416 120.325 1.091 25447
7380 1 18 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.408 -0.174 25447
7381 1 18 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.963 1.707 25447
7382 1 18 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.432 -1.193 25447
7383 1 18 . 1 1 47 47 TRP H H 47 8.093 8.093 7.909 0.184 25447
7384 1 18 . 1 1 48 48 LEU N N 48 118.963 118.963 121.086 -2.123 25447
7385 1 18 . 1 1 48 48 LEU HA H 48 3.586 3.586 2.742 0.844 25447
7386 1 18 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.746 0.449 25447
7387 1 18 . 1 1 48 48 LEU CB C 48 42.251 42.251 41.188 1.063 25447
7388 1 18 . 1 1 48 48 LEU H H 48 8.693 8.693 7.530 1.163 25447
7389 1 18 . 1 1 49 49 GLU N N 49 119.131 119.131 117.491 1.640 25447
7390 1 18 . 1 1 49 49 GLU HA H 49 4.050 4.050 4.003 0.047 25447
7391 1 18 . 1 1 49 49 GLU CA C 49 59.862 59.862 58.966 0.896 25447
7392 1 18 . 1 1 49 49 GLU CB C 49 29.586 29.586 28.759 0.827 25447
7393 1 18 . 1 1 49 49 GLU H H 49 7.771 7.771 7.860 -0.089 25447
7394 1 18 . 1 1 50 50 ASP N N 50 119.941 119.941 120.890 -0.949 25447
7395 1 18 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.417 -0.180 25447
7396 1 18 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.577 0.778 25447
7397 1 18 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.938 1.445 25447
7398 1 18 . 1 1 50 50 ASP H H 50 7.697 7.697 7.576 0.121 25447
7399 1 18 . 1 1 51 51 ARG N N 51 116.911 116.911 117.514 -0.603 25447
7400 1 18 . 1 1 51 51 ARG HA H 51 3.736 3.736 4.056 -0.320 25447
7401 1 18 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.253 -1.889 25447
7402 1 18 . 1 1 51 51 ARG CB C 51 29.315 29.315 29.640 -0.325 25447
7403 1 18 . 1 1 51 51 ARG H H 51 8.881 8.881 7.913 0.968 25447
7404 1 18 . 1 1 52 52 PHE N N 52 112.328 112.328 118.013 -5.685 25447
7405 1 18 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.588 0.087 25447
7406 1 18 . 1 1 52 52 PHE CA C 52 57.413 57.413 58.327 -0.914 25447
7407 1 18 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.309 1.583 25447
7408 1 18 . 1 1 52 52 PHE H H 52 7.284 7.284 7.561 -0.277 25447
7409 1 18 . 1 1 53 53 GLY N N 53 109.826 109.826 108.471 1.355 25447
7410 1 18 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.538 1.263 25447
7411 1 18 . 1 1 53 53 GLY H H 53 7.427 7.427 7.832 -0.405 25447
7412 1 18 . 1 1 54 54 ILE N N 54 119.127 119.127 114.704 4.423 25447
7413 1 18 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.519 -0.568 25447
7414 1 18 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.134 1.551 25447
7415 1 18 . 1 1 54 54 ILE CB C 54 39.490 39.490 39.846 -0.355 25447
7416 1 18 . 1 1 54 54 ILE H H 54 6.876 6.876 7.539 -0.663 25447
7417 1 18 . 1 1 55 55 ALA N N 55 129.823 129.823 123.921 5.902 25447
7418 1 18 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.670 -0.256 25447
7419 1 18 . 1 1 55 55 ALA CA C 55 51.610 51.610 50.409 1.201 25447
7420 1 18 . 1 1 55 55 ALA CB C 55 19.262 19.262 20.102 -0.840 25447
7421 1 18 . 1 1 55 55 ALA H H 55 8.499 8.499 8.589 -0.090 25447
7422 1 18 . 1 1 56 56 ALA N N 56 126.300 126.300 127.192 -0.892 25447
7423 1 18 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.087 0.182 25447
7424 1 18 . 1 1 56 56 ALA CA C 56 53.474 53.474 54.688 -1.214 25447
7425 1 18 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.574 0.670 25447
7426 1 18 . 1 1 56 56 ALA H H 56 8.641 8.641 9.005 -0.364 25447
7427 1 18 . 1 1 57 57 ASP N N 57 116.395 116.395 116.446 -0.051 25447
7428 1 18 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.358 0.121 25447
7429 1 18 . 1 1 57 57 ASP CA C 57 55.226 55.226 56.546 -1.320 25447
7430 1 18 . 1 1 57 57 ASP CB C 57 40.922 40.922 40.768 0.154 25447
7431 1 18 . 1 1 57 57 ASP H H 57 8.337 8.337 8.527 -0.190 25447
7432 1 18 . 1 1 58 58 ASP N N 58 118.557 118.557 119.407 -0.850 25447
7433 1 18 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.442 0.194 25447
7434 1 18 . 1 1 58 58 ASP CA C 58 55.144 55.144 56.041 -0.897 25447
7435 1 18 . 1 1 58 58 ASP CB C 58 41.504 41.504 41.234 0.270 25447
7436 1 18 . 1 1 58 58 ASP H H 58 8.027 8.027 7.765 0.262 25447
7437 1 18 . 1 1 59 59 VAL N N 59 118.898 118.898 113.340 5.558 25447
7438 1 18 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.470 -0.294 25447
7439 1 18 . 1 1 59 59 VAL CA C 59 62.300 62.300 59.975 2.325 25447
7440 1 18 . 1 1 59 59 VAL CB C 59 33.078 33.078 35.301 -2.223 25447
7441 1 18 . 1 1 59 59 VAL H H 59 7.716 7.716 7.541 0.175 25447
7442 1 18 . 1 1 60 60 GLU N N 60 122.888 122.888 121.525 1.363 25447
7443 1 18 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.539 -0.255 25447
7444 1 18 . 1 1 60 60 GLU CA C 60 56.546 56.546 55.585 0.961 25447
7445 1 18 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.487 -0.705 25447
7446 1 18 . 1 1 60 60 GLU H H 60 8.367 8.367 8.465 -0.098 25447
7447 1 18 . 1 1 61 61 LEU N N 61 124.827 124.827 125.106 -0.279 25447
7448 1 18 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.494 -0.136 25447
7449 1 18 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.394 0.422 25447
7450 1 18 . 1 1 61 61 LEU CB C 61 41.937 41.937 43.325 -1.388 25447
7451 1 18 . 1 1 61 61 LEU H H 61 8.198 8.198 8.424 -0.226 25447
7452 1 18 . 1 1 62 62 SER N N 62 118.715 118.715 118.816 -0.101 25447
7453 1 18 . 1 1 62 62 SER HA H 62 4.809 4.809 4.977 -0.168 25447
7454 1 18 . 1 1 62 62 SER CA C 62 55.732 55.732 55.053 0.679 25447
7455 1 18 . 1 1 62 62 SER CB C 62 64.017 64.017 64.786 -0.769 25447
7456 1 18 . 1 1 62 62 SER H H 62 8.137 8.137 8.270 -0.133 25447
7457 1 18 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.354 -0.101 25447
7458 1 18 . 1 1 63 63 PRO CA C 63 64.896 64.896 64.837 0.060 25447
7459 1 18 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.731 0.321 25447
7460 1 18 . 1 1 64 64 GLU N N 64 116.554 116.554 118.746 -2.192 25447
7461 1 18 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.120 -0.247 25447
7462 1 18 . 1 1 64 64 GLU CA C 64 58.719 58.719 58.927 -0.208 25447
7463 1 18 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.184 -0.503 25447
7464 1 18 . 1 1 64 64 GLU H H 64 8.316 8.316 8.404 -0.088 25447
7465 1 18 . 1 1 65 65 HIS N N 65 115.487 115.487 119.513 -4.026 25447
7466 1 18 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.247 0.033 25447
7467 1 18 . 1 1 65 65 HIS CA C 65 57.652 57.652 58.363 -0.711 25447
7468 1 18 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.483 0.399 25447
7469 1 18 . 1 1 65 65 HIS H H 65 7.274 7.274 8.245 -0.971 25447
7470 1 18 . 1 1 66 66 PHE N N 66 116.127 116.127 115.506 0.621 25447
7471 1 18 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.363 0.403 25447
7472 1 18 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.654 -1.872 25447
7473 1 18 . 1 1 66 66 PHE CB C 66 38.908 38.908 37.697 1.211 25447
7474 1 18 . 1 1 66 66 PHE H H 66 7.239 7.239 7.630 -0.391 25447
7475 1 18 . 1 1 67 67 ARG N N 67 112.468 112.468 119.231 -6.763 25447
7476 1 18 . 1 1 67 67 ARG HA H 67 4.085 4.085 3.975 0.110 25447
7477 1 18 . 1 1 67 67 ARG CA C 67 58.287 58.287 59.020 -0.733 25447
7478 1 18 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.489 1.271 25447
7479 1 18 . 1 1 67 67 ARG H H 67 6.628 6.628 7.732 -1.104 25447
7480 1 18 . 1 1 68 68 SER N N 68 109.305 109.305 110.405 -1.100 25447
7481 1 18 . 1 1 68 68 SER HA H 68 4.980 4.980 4.774 0.206 25447
7482 1 18 . 1 1 68 68 SER CA C 68 55.785 55.785 56.346 -0.561 25447
7483 1 18 . 1 1 68 68 SER CB C 68 67.691 67.691 65.145 2.546 25447
7484 1 18 . 1 1 68 68 SER H H 68 8.145 8.145 7.393 0.752 25447
7485 1 18 . 1 1 69 69 ILE N N 69 122.602 122.602 124.629 -2.027 25447
7486 1 18 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.740 -0.064 25447
7487 1 18 . 1 1 69 69 ILE CA C 69 66.754 66.754 65.370 1.384 25447
7488 1 18 . 1 1 69 69 ILE CB C 69 37.296 37.296 37.625 -0.329 25447
7489 1 18 . 1 1 69 69 ILE H H 69 9.775 9.775 9.091 0.684 25447
7490 1 18 . 1 1 70 70 ARG N N 70 118.764 118.764 119.191 -0.427 25447
7491 1 18 . 1 1 70 70 ARG HA H 70 3.955 3.955 4.018 -0.063 25447
7492 1 18 . 1 1 70 70 ARG CA C 70 60.533 60.533 59.770 0.763 25447
7493 1 18 . 1 1 70 70 ARG CB C 70 30.418 30.418 29.748 0.670 25447
7494 1 18 . 1 1 70 70 ARG H H 70 8.910 8.910 7.701 1.209 25447
7495 1 18 . 1 1 71 71 SER N N 71 117.670 117.670 115.388 2.282 25447
7496 1 18 . 1 1 71 71 SER HA H 71 4.330 4.330 4.267 0.063 25447
7497 1 18 . 1 1 71 71 SER CA C 71 62.287 62.287 61.204 1.083 25447
7498 1 18 . 1 1 71 71 SER CB C 71 63.278 63.278 62.755 0.523 25447
7499 1 18 . 1 1 71 71 SER H H 71 8.518 8.518 7.641 0.877 25447
7500 1 18 . 1 1 72 72 ILE N N 72 127.447 127.447 123.277 4.170 25447
7501 1 18 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.738 0.172 25447
7502 1 18 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.305 1.506 25447
7503 1 18 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.786 0.612 25447
7504 1 18 . 1 1 72 72 ILE H H 72 8.762 8.762 7.582 1.180 25447
7505 1 18 . 1 1 73 73 ASP N N 73 121.636 121.636 120.024 1.612 25447
7506 1 18 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.415 -0.402 25447
7507 1 18 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.387 1.761 25447
7508 1 18 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.717 2.824 25447
7509 1 18 . 1 1 73 73 ASP H H 73 8.677 8.677 8.345 0.332 25447
7510 1 18 . 1 1 74 74 ALA N N 74 118.793 118.793 122.111 -3.318 25447
7511 1 18 . 1 1 74 74 ALA HA H 74 4.044 4.044 4.104 -0.060 25447
7512 1 18 . 1 1 74 74 ALA CA C 74 55.321 55.321 55.025 0.296 25447
7513 1 18 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.355 -0.410 25447
7514 1 18 . 1 1 74 74 ALA H H 74 8.005 8.005 7.902 0.103 25447
7515 1 18 . 1 1 75 75 PHE N N 75 121.235 121.235 119.848 1.387 25447
7516 1 18 . 1 1 75 75 PHE HA H 75 4.038 4.038 4.015 0.023 25447
7517 1 18 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.856 -0.841 25447
7518 1 18 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.291 -0.454 25447
7519 1 18 . 1 1 75 75 PHE H H 75 8.353 8.353 8.550 -0.197 25447
7520 1 18 . 1 1 76 76 VAL N N 76 120.866 120.866 119.063 1.803 25447
7521 1 18 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.376 -0.433 25447
7522 1 18 . 1 1 76 76 VAL CA C 76 66.901 66.901 67.385 -0.484 25447
7523 1 18 . 1 1 76 76 VAL CB C 76 31.247 31.247 31.664 -0.417 25447
7524 1 18 . 1 1 76 76 VAL H H 76 8.544 8.544 8.093 0.451 25447
7525 1 18 . 1 1 77 77 VAL N N 77 121.408 121.408 119.705 1.703 25447
7526 1 18 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.664 -0.169 25447
7527 1 18 . 1 1 77 77 VAL CA C 77 66.833 66.833 66.526 0.307 25447
7528 1 18 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.277 0.653 25447
7529 1 18 . 1 1 77 77 VAL H H 77 8.708 8.708 8.387 0.321 25447
7530 1 18 . 1 1 78 78 GLY N N 78 106.402 106.402 107.272 -0.870 25447
7531 1 18 . 1 1 78 78 GLY CA C 78 46.840 46.840 47.141 -0.301 25447
7532 1 18 . 1 1 78 78 GLY H H 78 7.945 7.945 8.623 -0.678 25447
7533 1 18 . 1 1 79 79 ALA N N 79 121.146 121.146 122.574 -1.428 25447
7534 1 18 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.947 0.260 25447
7535 1 18 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.439 -1.510 25447
7536 1 18 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.256 1.005 25447
7537 1 18 . 1 1 79 79 ALA H H 79 7.639 7.639 7.500 0.139 25447
7538 1 18 . 1 1 80 80 THR N N 80 107.668 107.668 110.503 -2.835 25447
7539 1 18 . 1 1 80 80 THR HA H 80 4.443 4.443 4.253 0.190 25447
7540 1 18 . 1 1 80 80 THR CA C 80 61.406 61.406 63.196 -1.790 25447
7541 1 18 . 1 1 80 80 THR CB C 80 70.767 70.767 69.491 1.276 25447
7542 1 18 . 1 1 80 80 THR H H 80 7.449 7.449 7.703 -0.254 25447
7543 1 18 . 1 1 81 81 THR N N 81 119.953 119.953 116.629 3.324 25447
7544 1 18 . 1 1 81 81 THR HA H 81 4.665 4.665 4.793 -0.128 25447
7545 1 18 . 1 1 81 81 THR CA C 81 60.412 60.412 59.016 1.396 25447
7546 1 18 . 1 1 81 81 THR CB C 81 70.113 70.113 69.463 0.650 25447
7547 1 18 . 1 1 81 81 THR H H 81 7.685 7.685 7.875 -0.190 25447
7548 1 18 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.627 0.062 25447
7549 1 18 . 1 1 82 82 PRO CA C 82 61.688 61.688 62.080 -0.392 25447
7550 1 18 . 1 1 82 82 PRO CB C 82 30.969 30.969 30.659 0.310 25447
7551 1 18 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.495 -0.014 25447
7552 1 18 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.321 0.610 25447
7553 1 18 . 1 1 83 83 PRO CB C 83 32.193 32.193 32.619 -0.426 25447
7554 1 18 . 1 1 84 84 VAL N N 84 120.691 120.691 122.156 -1.465 25447
7555 1 18 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.220 -0.127 25447
7556 1 18 . 1 1 84 84 VAL CA C 84 62.339 62.339 61.581 0.758 25447
7557 1 18 . 1 1 84 84 VAL CB C 84 32.851 32.851 33.674 -0.823 25447
7558 1 18 . 1 1 84 84 VAL H H 84 8.257 8.257 8.105 0.152 25447
7559 1 18 . 1 1 85 85 GLU N N 85 127.655 127.655 123.153 4.502 25447
7560 1 18 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.847 0.437 25447
7561 1 18 . 1 1 85 85 GLU CA C 85 56.754 56.754 56.549 0.205 25447
7562 1 18 . 1 1 85 85 GLU CB C 85 30.559 30.559 28.004 2.555 25447
7563 1 18 . 1 1 85 85 GLU H H 85 8.202 8.202 8.670 -0.468 25447
7564 1 18 . 1 1 86 86 ALA N N 86 126.437 126.437 120.847 5.590 25447
7565 1 18 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.156 -0.105 25447
7566 1 18 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.638 -0.490 25447
7567 1 18 . 1 1 86 86 ALA CB C 86 19.460 19.460 19.825 -0.365 25447
7568 1 18 . 1 1 86 86 ALA H H 86 8.323 8.323 8.206 0.117 25447
7569 1 18 . 1 1 87 87 LYS N N 87 121.796 121.796 120.579 1.217 25447
7570 1 18 . 1 1 87 87 LYS HA H 87 4.347 4.347 4.029 0.318 25447
7571 1 18 . 1 1 87 87 LYS CA C 87 56.297 56.297 58.092 -1.795 25447
7572 1 18 . 1 1 87 87 LYS CB C 87 33.276 33.276 32.468 0.808 25447
7573 1 18 . 1 1 87 87 LYS H H 87 8.333 8.333 8.387 -0.054 25447
7574 1 18 . 1 1 88 88 LEU N N 88 125.576 125.576 120.892 4.684 25447
7575 1 18 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.467 -0.560 25447
7576 1 18 . 1 1 88 88 LEU CA C 88 55.772 55.772 54.623 1.149 25447
7577 1 18 . 1 1 88 88 LEU CB C 88 42.472 42.472 42.239 0.233 25447
7578 1 18 . 1 1 88 88 LEU H H 88 8.444 8.444 7.653 0.791 25447
7579 1 19 . 1 1 1 1 MET N N 1 120.668 120.668 122.914 -2.246 25447
7580 1 19 . 1 1 1 1 MET HA H 1 4.484 4.484 4.353 0.131 25447
7581 1 19 . 1 1 1 1 MET CA C 1 55.257 55.257 56.991 -1.734 25447
7582 1 19 . 1 1 1 1 MET CB C 1 34.517 34.517 33.245 1.272 25447
7583 1 19 . 1 1 1 1 MET H H 1 8.313 8.313 8.759 -0.446 25447
7584 1 19 . 1 1 2 2 GLN N N 2 123.739 123.739 116.053 7.686 25447
7585 1 19 . 1 1 2 2 GLN HA H 2 4.030 4.030 3.801 0.229 25447
7586 1 19 . 1 1 2 2 GLN CA C 2 57.874 57.874 56.319 1.555 25447
7587 1 19 . 1 1 2 2 GLN CB C 2 29.938 29.938 27.080 2.858 25447
7588 1 19 . 1 1 2 2 GLN H H 2 9.455 9.455 8.084 1.371 25447
7589 1 19 . 1 1 3 3 HIS N N 3 119.115 119.115 114.731 4.384 25447
7590 1 19 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.317 0.799 25447
7591 1 19 . 1 1 3 3 HIS CA C 3 55.494 55.494 56.375 -0.881 25447
7592 1 19 . 1 1 3 3 HIS CB C 3 31.015 31.015 27.842 3.173 25447
7593 1 19 . 1 1 3 3 HIS H H 3 9.783 9.783 8.341 1.442 25447
7594 1 19 . 1 1 4 4 ALA N N 4 122.648 122.648 122.454 0.194 25447
7595 1 19 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.145 -0.242 25447
7596 1 19 . 1 1 4 4 ALA CA C 4 56.479 56.479 55.239 1.240 25447
7597 1 19 . 1 1 4 4 ALA CB C 4 19.194 19.194 18.884 0.310 25447
7598 1 19 . 1 1 4 4 ALA H H 4 7.551 7.551 8.448 -0.897 25447
7599 1 19 . 1 1 5 5 SER N N 5 112.599 112.599 114.520 -1.921 25447
7600 1 19 . 1 1 5 5 SER HA H 5 4.298 4.298 4.213 0.085 25447
7601 1 19 . 1 1 5 5 SER CA C 5 62.117 62.117 62.050 0.067 25447
7602 1 19 . 1 1 5 5 SER CB C 5 62.334 62.334 62.469 -0.135 25447
7603 1 19 . 1 1 5 5 SER H H 5 8.736 8.736 8.461 0.275 25447
7604 1 19 . 1 1 6 6 VAL N N 6 122.866 122.866 122.149 0.717 25447
7605 1 19 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.769 0.336 25447
7606 1 19 . 1 1 6 6 VAL CA C 6 65.732 65.732 66.394 -0.662 25447
7607 1 19 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.604 1.133 25447
7608 1 19 . 1 1 6 6 VAL H H 6 7.660 7.660 7.332 0.328 25447
7609 1 19 . 1 1 7 7 ILE N N 7 121.715 121.715 119.927 1.788 25447
7610 1 19 . 1 1 7 7 ILE HA H 7 4.224 4.224 4.169 0.055 25447
7611 1 19 . 1 1 7 7 ILE CA C 7 65.329 65.329 65.889 -0.560 25447
7612 1 19 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.539 1.154 25447
7613 1 19 . 1 1 7 7 ILE H H 7 8.519 8.519 7.608 0.911 25447
7614 1 19 . 1 1 8 8 ALA N N 8 121.373 121.373 121.349 0.024 25447
7615 1 19 . 1 1 8 8 ALA HA H 8 3.895 3.895 4.025 -0.130 25447
7616 1 19 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.326 0.931 25447
7617 1 19 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.016 0.624 25447
7618 1 19 . 1 1 8 8 ALA H H 8 8.940 8.940 7.963 0.977 25447
7619 1 19 . 1 1 9 9 GLN N N 9 115.076 115.076 119.102 -4.026 25447
7620 1 19 . 1 1 9 9 GLN HA H 9 3.870 3.870 3.963 -0.093 25447
7621 1 19 . 1 1 9 9 GLN CA C 9 59.192 59.192 58.904 0.288 25447
7622 1 19 . 1 1 9 9 GLN CB C 9 28.138 28.138 28.635 -0.497 25447
7623 1 19 . 1 1 9 9 GLN H H 9 7.729 7.729 8.034 -0.305 25447
7624 1 19 . 1 1 10 10 PHE N N 10 120.207 120.207 118.607 1.600 25447
7625 1 19 . 1 1 10 10 PHE HA H 10 4.085 4.085 3.909 0.176 25447
7626 1 19 . 1 1 10 10 PHE CA C 10 60.893 60.893 61.611 -0.718 25447
7627 1 19 . 1 1 10 10 PHE CB C 10 38.932 38.932 38.372 0.560 25447
7628 1 19 . 1 1 10 10 PHE H H 10 7.301 7.301 7.877 -0.576 25447
7629 1 19 . 1 1 11 11 VAL N N 11 117.569 117.569 117.521 0.048 25447
7630 1 19 . 1 1 11 11 VAL HA H 11 3.307 3.307 3.856 -0.549 25447
7631 1 19 . 1 1 11 11 VAL CA C 11 66.508 66.508 65.945 0.562 25447
7632 1 19 . 1 1 11 11 VAL CB C 11 31.487 31.487 31.528 -0.041 25447
7633 1 19 . 1 1 11 11 VAL H H 11 8.370 8.370 7.789 0.581 25447
7634 1 19 . 1 1 12 12 VAL N N 12 117.909 117.909 117.013 0.896 25447
7635 1 19 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.696 0.045 25447
7636 1 19 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.564 -0.688 25447
7637 1 19 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.551 -0.239 25447
7638 1 19 . 1 1 12 12 VAL H H 12 8.294 8.294 7.736 0.558 25447
7639 1 19 . 1 1 13 13 GLU N N 13 117.918 117.918 118.922 -1.004 25447
7640 1 19 . 1 1 13 13 GLU HA H 13 3.742 3.742 3.889 -0.147 25447
7641 1 19 . 1 1 13 13 GLU CA C 13 59.307 59.307 58.748 0.559 25447
7642 1 19 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.006 0.483 25447
7643 1 19 . 1 1 13 13 GLU H H 13 7.750 7.750 8.110 -0.360 25447
7644 1 19 . 1 1 14 14 GLU N N 14 113.478 113.478 117.401 -3.923 25447
7645 1 19 . 1 1 14 14 GLU HA H 14 3.778 3.778 3.851 -0.073 25447
7646 1 19 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.604 -1.804 25447
7647 1 19 . 1 1 14 14 GLU CB C 14 29.643 29.643 29.853 -0.210 25447
7648 1 19 . 1 1 14 14 GLU H H 14 7.603 7.603 7.976 -0.373 25447
7649 1 19 . 1 1 15 15 PHE N N 15 114.193 114.193 113.046 1.147 25447
7650 1 19 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.645 0.294 25447
7651 1 19 . 1 1 15 15 PHE CA C 15 58.095 58.095 58.511 -0.416 25447
7652 1 19 . 1 1 15 15 PHE CB C 15 42.095 42.095 42.327 -0.232 25447
7653 1 19 . 1 1 15 15 PHE H H 15 7.908 7.908 7.394 0.514 25447
7654 1 19 . 1 1 16 16 LEU N N 16 121.492 121.492 121.559 -0.067 25447
7655 1 19 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.896 0.071 25447
7656 1 19 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.326 0.051 25447
7657 1 19 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.678 1.055 25447
7658 1 19 . 1 1 16 16 LEU H H 16 8.015 8.015 8.326 -0.311 25447
7659 1 19 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.406 -0.023 25447
7660 1 19 . 1 1 17 17 PRO CA C 17 64.858 64.858 63.959 0.899 25447
7661 1 19 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.837 -0.008 25447
7662 1 19 . 1 1 18 18 ASP N N 18 116.508 116.508 118.338 -1.830 25447
7663 1 19 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.750 -0.182 25447
7664 1 19 . 1 1 18 18 ASP CA C 18 54.688 54.688 53.851 0.837 25447
7665 1 19 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.383 0.242 25447
7666 1 19 . 1 1 18 18 ASP H H 18 8.399 8.399 8.616 -0.217 25447
7667 1 19 . 1 1 19 19 VAL N N 19 122.135 122.135 120.800 1.335 25447
7668 1 19 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.084 0.034 25447
7669 1 19 . 1 1 19 19 VAL CA C 19 61.293 61.293 61.574 -0.281 25447
7670 1 19 . 1 1 19 19 VAL CB C 19 33.582 33.582 34.009 -0.427 25447
7671 1 19 . 1 1 19 19 VAL H H 19 7.760 7.760 7.190 0.570 25447
7672 1 19 . 1 1 20 20 ALA N N 20 129.301 129.301 130.756 -1.455 25447
7673 1 19 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.575 0.024 25447
7674 1 19 . 1 1 20 20 ALA CA C 20 50.270 50.270 50.025 0.245 25447
7675 1 19 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.364 -0.936 25447
7676 1 19 . 1 1 20 20 ALA H H 20 8.761 8.761 8.518 0.243 25447
7677 1 19 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.175 -0.098 25447
7678 1 19 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.501 0.702 25447
7679 1 19 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.827 -0.419 25447
7680 1 19 . 1 1 22 22 ALA N N 22 116.106 116.106 118.517 -2.411 25447
7681 1 19 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.158 -0.041 25447
7682 1 19 . 1 1 22 22 ALA CA C 22 53.996 53.996 54.084 -0.088 25447
7683 1 19 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.413 0.431 25447
7684 1 19 . 1 1 22 22 ALA H H 22 8.064 8.064 8.010 0.054 25447
7685 1 19 . 1 1 23 23 ASP N N 23 115.541 115.541 115.757 -0.216 25447
7686 1 19 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.609 0.068 25447
7687 1 19 . 1 1 23 23 ASP CA C 23 54.336 54.336 53.640 0.696 25447
7688 1 19 . 1 1 23 23 ASP CB C 23 41.353 41.353 40.588 0.765 25447
7689 1 19 . 1 1 23 23 ASP H H 23 8.003 8.003 8.011 -0.008 25447
7690 1 19 . 1 1 24 24 VAL N N 24 121.517 121.517 121.258 0.259 25447
7691 1 19 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.168 -0.347 25447
7692 1 19 . 1 1 24 24 VAL CA C 24 62.345 62.345 61.191 1.154 25447
7693 1 19 . 1 1 24 24 VAL CB C 24 31.733 31.733 32.456 -0.723 25447
7694 1 19 . 1 1 24 24 VAL H H 24 7.069 7.069 7.541 -0.472 25447
7695 1 19 . 1 1 25 25 ASP N N 25 129.329 129.329 126.379 2.950 25447
7696 1 19 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.734 -0.160 25447
7697 1 19 . 1 1 25 25 ASP CA C 25 54.566 54.566 52.912 1.654 25447
7698 1 19 . 1 1 25 25 ASP CB C 25 42.333 42.333 42.274 0.059 25447
7699 1 19 . 1 1 25 25 ASP H H 25 8.474 8.474 8.671 -0.197 25447
7700 1 19 . 1 1 26 26 VAL N N 26 121.920 121.920 122.386 -0.466 25447
7701 1 19 . 1 1 26 26 VAL HA H 26 4.108 4.108 4.111 -0.003 25447
7702 1 19 . 1 1 26 26 VAL CA C 26 64.518 64.518 62.530 1.988 25447
7703 1 19 . 1 1 26 26 VAL CB C 26 31.198 31.198 31.227 -0.029 25447
7704 1 19 . 1 1 26 26 VAL H H 26 8.591 8.591 8.715 -0.124 25447
7705 1 19 . 1 1 27 27 ASP N N 27 116.286 116.286 118.853 -2.567 25447
7706 1 19 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.732 0.413 25447
7707 1 19 . 1 1 27 27 ASP CA C 27 54.181 54.181 54.503 -0.322 25447
7708 1 19 . 1 1 27 27 ASP CB C 27 42.575 42.575 41.599 0.976 25447
7709 1 19 . 1 1 27 27 ASP H H 27 8.609 8.609 8.158 0.451 25447
7710 1 19 . 1 1 28 28 LEU N N 28 125.116 125.116 121.959 3.157 25447
7711 1 19 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.455 -0.444 25447
7712 1 19 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.171 1.916 25447
7713 1 19 . 1 1 28 28 LEU CB C 28 43.321 43.321 44.452 -1.131 25447
7714 1 19 . 1 1 28 28 LEU H H 28 7.374 7.374 7.342 0.032 25447
7715 1 19 . 1 1 29 29 ASP N N 29 125.924 125.924 123.804 2.120 25447
7716 1 19 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.589 0.245 25447
7717 1 19 . 1 1 29 29 ASP CA C 29 53.920 53.920 54.831 -0.911 25447
7718 1 19 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.913 -0.534 25447
7719 1 19 . 1 1 29 29 ASP H H 29 8.699 8.699 8.590 0.109 25447
7720 1 19 . 1 1 30 30 LEU N N 30 129.975 129.975 128.829 1.146 25447
7721 1 19 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.139 -0.222 25447
7722 1 19 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.299 -0.911 25447
7723 1 19 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.407 -0.168 25447
7724 1 19 . 1 1 30 30 LEU H H 30 9.718 9.718 8.246 1.472 25447
7725 1 19 . 1 1 31 31 VAL N N 31 121.212 121.212 119.138 2.074 25447
7726 1 19 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.572 0.621 25447
7727 1 19 . 1 1 31 31 VAL CA C 31 64.433 64.433 66.876 -2.443 25447
7728 1 19 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.674 0.501 25447
7729 1 19 . 1 1 31 31 VAL H H 31 8.163 8.163 7.724 0.439 25447
7730 1 19 . 1 1 32 32 ASP N N 32 124.893 124.893 119.755 5.138 25447
7731 1 19 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.367 -0.009 25447
7732 1 19 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.828 0.397 25447
7733 1 19 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.017 0.718 25447
7734 1 19 . 1 1 32 32 ASP H H 32 9.385 9.385 8.892 0.493 25447
7735 1 19 . 1 1 33 33 ASN N N 33 111.484 111.484 116.164 -4.680 25447
7736 1 19 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.558 0.162 25447
7737 1 19 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.916 -0.030 25447
7738 1 19 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.126 -0.120 25447
7739 1 19 . 1 1 33 33 ASN H H 33 7.396 7.396 7.497 -0.101 25447
7740 1 19 . 1 1 34 34 GLY N N 34 106.957 106.957 106.256 0.701 25447
7741 1 19 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.516 1.091 25447
7742 1 19 . 1 1 34 34 GLY H H 34 7.618 7.618 7.856 -0.238 25447
7743 1 19 . 1 1 35 35 VAL N N 35 120.424 120.424 118.858 1.566 25447
7744 1 19 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.618 0.148 25447
7745 1 19 . 1 1 35 35 VAL CA C 35 65.125 65.125 64.884 0.241 25447
7746 1 19 . 1 1 35 35 VAL CB C 35 31.879 31.879 31.765 0.114 25447
7747 1 19 . 1 1 35 35 VAL H H 35 7.792 7.792 7.669 0.123 25447
7748 1 19 . 1 1 36 36 ILE N N 36 116.364 116.364 118.792 -2.428 25447
7749 1 19 . 1 1 36 36 ILE HA H 36 3.737 3.737 4.061 -0.324 25447
7750 1 19 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.457 -0.772 25447
7751 1 19 . 1 1 36 36 ILE CB C 36 38.807 38.807 38.394 0.413 25447
7752 1 19 . 1 1 36 36 ILE H H 36 7.331 7.331 7.817 -0.486 25447
7753 1 19 . 1 1 37 37 ASP N N 37 127.306 127.306 126.189 1.117 25447
7754 1 19 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.698 -0.034 25447
7755 1 19 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.662 -1.046 25447
7756 1 19 . 1 1 37 37 ASP CB C 37 41.209 41.209 43.749 -2.540 25447
7757 1 19 . 1 1 37 37 ASP H H 37 7.874 7.874 8.132 -0.258 25447
7758 1 19 . 1 1 38 38 ALA N N 38 120.352 120.352 122.778 -2.426 25447
7759 1 19 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.127 -0.132 25447
7760 1 19 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.425 0.867 25447
7761 1 19 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.479 -0.167 25447
7762 1 19 . 1 1 38 38 ALA H H 38 8.244 8.244 8.354 -0.110 25447
7763 1 19 . 1 1 39 39 LEU N N 39 117.438 117.438 119.349 -1.911 25447
7764 1 19 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.253 -0.003 25447
7765 1 19 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.565 -0.210 25447
7766 1 19 . 1 1 39 39 LEU CB C 39 41.236 41.236 40.997 0.239 25447
7767 1 19 . 1 1 39 39 LEU H H 39 7.688 7.688 8.370 -0.682 25447
7768 1 19 . 1 1 40 40 GLY N N 40 112.015 112.015 107.356 4.659 25447
7769 1 19 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.275 0.824 25447
7770 1 19 . 1 1 40 40 GLY H H 40 8.732 8.732 8.327 0.405 25447
7771 1 19 . 1 1 41 41 LEU N N 41 122.983 122.983 123.197 -0.214 25447
7772 1 19 . 1 1 41 41 LEU HA H 41 3.851 3.851 3.881 -0.030 25447
7773 1 19 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.440 0.892 25447
7774 1 19 . 1 1 41 41 LEU CB C 41 41.639 41.639 41.889 -0.250 25447
7775 1 19 . 1 1 41 41 LEU H H 41 8.548 8.548 8.463 0.085 25447
7776 1 19 . 1 1 42 42 LEU N N 42 116.076 116.076 120.012 -3.936 25447
7777 1 19 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.850 0.178 25447
7778 1 19 . 1 1 42 42 LEU CA C 42 58.064 58.064 58.511 -0.447 25447
7779 1 19 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.746 -0.806 25447
7780 1 19 . 1 1 42 42 LEU H H 42 7.168 7.168 7.659 -0.491 25447
7781 1 19 . 1 1 43 43 LYS N N 43 119.831 119.831 119.068 0.763 25447
7782 1 19 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.043 0.241 25447
7783 1 19 . 1 1 43 43 LYS CA C 43 59.644 59.644 59.915 -0.271 25447
7784 1 19 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.318 0.209 25447
7785 1 19 . 1 1 43 43 LYS H H 43 7.640 7.640 8.244 -0.604 25447
7786 1 19 . 1 1 44 44 VAL N N 44 121.046 121.046 120.101 0.945 25447
7787 1 19 . 1 1 44 44 VAL HA H 44 3.949 3.949 3.862 0.087 25447
7788 1 19 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.359 0.284 25447
7789 1 19 . 1 1 44 44 VAL H H 44 8.269 8.269 7.738 0.531 25447
7790 1 19 . 1 1 45 45 ILE N N 45 119.333 119.333 121.328 -1.995 25447
7791 1 19 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.986 -0.582 25447
7792 1 19 . 1 1 45 45 ILE CA C 45 66.148 66.148 63.784 2.364 25447
7793 1 19 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.353 0.923 25447
7794 1 19 . 1 1 45 45 ILE H H 45 8.145 8.145 7.904 0.241 25447
7795 1 19 . 1 1 46 46 ALA N N 46 121.213 121.213 122.399 -1.186 25447
7796 1 19 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.033 0.224 25447
7797 1 19 . 1 1 46 46 ALA CA C 46 55.164 55.164 55.307 -0.143 25447
7798 1 19 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.550 -0.182 25447
7799 1 19 . 1 1 46 46 ALA H H 46 7.792 7.792 7.914 -0.122 25447
7800 1 19 . 1 1 47 47 TRP N N 47 121.416 121.416 119.927 1.489 25447
7801 1 19 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.407 -0.173 25447
7802 1 19 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.750 1.920 25447
7803 1 19 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.259 -1.020 25447
7804 1 19 . 1 1 47 47 TRP H H 47 8.093 8.093 7.943 0.150 25447
7805 1 19 . 1 1 48 48 LEU N N 48 118.963 118.963 120.081 -1.118 25447
7806 1 19 . 1 1 48 48 LEU HA H 48 3.586 3.586 2.903 0.683 25447
7807 1 19 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.198 0.997 25447
7808 1 19 . 1 1 48 48 LEU CB C 48 42.251 42.251 40.472 1.779 25447
7809 1 19 . 1 1 48 48 LEU H H 48 8.693 8.693 7.124 1.569 25447
7810 1 19 . 1 1 49 49 GLU N N 49 119.131 119.131 117.716 1.415 25447
7811 1 19 . 1 1 49 49 GLU HA H 49 4.050 4.050 4.035 0.015 25447
7812 1 19 . 1 1 49 49 GLU CA C 49 59.862 59.862 58.830 1.032 25447
7813 1 19 . 1 1 49 49 GLU CB C 49 29.586 29.586 28.832 0.754 25447
7814 1 19 . 1 1 49 49 GLU H H 49 7.771 7.771 7.631 0.140 25447
7815 1 19 . 1 1 50 50 ASP N N 50 119.941 119.941 119.787 0.154 25447
7816 1 19 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.459 -0.222 25447
7817 1 19 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.567 0.788 25447
7818 1 19 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.667 1.716 25447
7819 1 19 . 1 1 50 50 ASP H H 50 7.697 7.697 7.687 0.010 25447
7820 1 19 . 1 1 51 51 ARG N N 51 116.911 116.911 119.057 -2.146 25447
7821 1 19 . 1 1 51 51 ARG HA H 51 3.736 3.736 4.046 -0.310 25447
7822 1 19 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.196 -1.832 25447
7823 1 19 . 1 1 51 51 ARG CB C 51 29.315 29.315 29.817 -0.501 25447
7824 1 19 . 1 1 51 51 ARG H H 51 8.881 8.881 7.925 0.956 25447
7825 1 19 . 1 1 52 52 PHE N N 52 112.328 112.328 116.276 -3.948 25447
7826 1 19 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.646 0.029 25447
7827 1 19 . 1 1 52 52 PHE CA C 52 57.413 57.413 57.914 -0.501 25447
7828 1 19 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.297 1.595 25447
7829 1 19 . 1 1 52 52 PHE H H 52 7.284 7.284 7.664 -0.380 25447
7830 1 19 . 1 1 53 53 GLY N N 53 109.826 109.826 108.784 1.042 25447
7831 1 19 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.487 1.314 25447
7832 1 19 . 1 1 53 53 GLY H H 53 7.427 7.427 7.588 -0.161 25447
7833 1 19 . 1 1 54 54 ILE N N 54 119.127 119.127 114.577 4.550 25447
7834 1 19 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.536 -0.585 25447
7835 1 19 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.172 1.513 25447
7836 1 19 . 1 1 54 54 ILE CB C 54 39.490 39.490 39.985 -0.495 25447
7837 1 19 . 1 1 54 54 ILE H H 54 6.876 6.876 7.648 -0.772 25447
7838 1 19 . 1 1 55 55 ALA N N 55 129.823 129.823 124.297 5.526 25447
7839 1 19 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.627 -0.213 25447
7840 1 19 . 1 1 55 55 ALA CA C 55 51.610 51.610 50.578 1.032 25447
7841 1 19 . 1 1 55 55 ALA CB C 55 19.262 19.262 19.823 -0.561 25447
7842 1 19 . 1 1 55 55 ALA H H 55 8.499 8.499 8.388 0.111 25447
7843 1 19 . 1 1 56 56 ALA N N 56 126.300 126.300 127.022 -0.722 25447
7844 1 19 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.040 0.229 25447
7845 1 19 . 1 1 56 56 ALA CA C 56 53.474 53.474 54.606 -1.132 25447
7846 1 19 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.440 0.804 25447
7847 1 19 . 1 1 56 56 ALA H H 56 8.641 8.641 8.973 -0.332 25447
7848 1 19 . 1 1 57 57 ASP N N 57 116.395 116.395 116.838 -0.443 25447
7849 1 19 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.392 0.087 25447
7850 1 19 . 1 1 57 57 ASP CA C 57 55.226 55.226 56.302 -1.076 25447
7851 1 19 . 1 1 57 57 ASP CB C 57 40.922 40.922 39.820 1.102 25447
7852 1 19 . 1 1 57 57 ASP H H 57 8.337 8.337 8.631 -0.294 25447
7853 1 19 . 1 1 58 58 ASP N N 58 118.557 118.557 118.830 -0.273 25447
7854 1 19 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.429 0.207 25447
7855 1 19 . 1 1 58 58 ASP CA C 58 55.144 55.144 55.920 -0.776 25447
7856 1 19 . 1 1 58 58 ASP CB C 58 41.504 41.504 41.315 0.189 25447
7857 1 19 . 1 1 58 58 ASP H H 58 8.027 8.027 7.926 0.101 25447
7858 1 19 . 1 1 59 59 VAL N N 59 118.898 118.898 118.044 0.854 25447
7859 1 19 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.277 -0.101 25447
7860 1 19 . 1 1 59 59 VAL CA C 59 62.300 62.300 61.199 1.101 25447
7861 1 19 . 1 1 59 59 VAL CB C 59 33.078 33.078 35.197 -2.119 25447
7862 1 19 . 1 1 59 59 VAL H H 59 7.716 7.716 7.449 0.267 25447
7863 1 19 . 1 1 60 60 GLU N N 60 122.888 122.888 126.993 -4.105 25447
7864 1 19 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.512 -0.228 25447
7865 1 19 . 1 1 60 60 GLU CA C 60 56.546 56.546 55.639 0.907 25447
7866 1 19 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.676 -0.894 25447
7867 1 19 . 1 1 60 60 GLU H H 60 8.367 8.367 8.398 -0.031 25447
7868 1 19 . 1 1 61 61 LEU N N 61 124.827 124.827 125.469 -0.642 25447
7869 1 19 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.483 -0.125 25447
7870 1 19 . 1 1 61 61 LEU CA C 61 54.816 54.816 53.991 0.825 25447
7871 1 19 . 1 1 61 61 LEU CB C 61 41.937 41.937 43.263 -1.326 25447
7872 1 19 . 1 1 61 61 LEU H H 61 8.198 8.198 8.490 -0.292 25447
7873 1 19 . 1 1 62 62 SER N N 62 118.715 118.715 118.956 -0.241 25447
7874 1 19 . 1 1 62 62 SER HA H 62 4.809 4.809 4.899 -0.090 25447
7875 1 19 . 1 1 62 62 SER CA C 62 55.732 55.732 55.989 -0.257 25447
7876 1 19 . 1 1 62 62 SER CB C 62 64.017 64.017 64.689 -0.672 25447
7877 1 19 . 1 1 62 62 SER H H 62 8.137 8.137 8.246 -0.109 25447
7878 1 19 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.307 -0.054 25447
7879 1 19 . 1 1 63 63 PRO CA C 63 64.896 64.896 64.798 0.098 25447
7880 1 19 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.722 0.330 25447
7881 1 19 . 1 1 64 64 GLU N N 64 116.554 116.554 119.194 -2.640 25447
7882 1 19 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.143 -0.270 25447
7883 1 19 . 1 1 64 64 GLU CA C 64 58.719 58.719 58.888 -0.169 25447
7884 1 19 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.195 -0.514 25447
7885 1 19 . 1 1 64 64 GLU H H 64 8.316 8.316 8.373 -0.057 25447
7886 1 19 . 1 1 65 65 HIS N N 65 115.487 115.487 120.291 -4.804 25447
7887 1 19 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.262 0.018 25447
7888 1 19 . 1 1 65 65 HIS CA C 65 57.652 57.652 58.373 -0.721 25447
7889 1 19 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.390 0.492 25447
7890 1 19 . 1 1 65 65 HIS H H 65 7.274 7.274 8.180 -0.906 25447
7891 1 19 . 1 1 66 66 PHE N N 66 116.127 116.127 116.486 -0.359 25447
7892 1 19 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.498 0.268 25447
7893 1 19 . 1 1 66 66 PHE CA C 66 55.782 55.782 58.455 -2.673 25447
7894 1 19 . 1 1 66 66 PHE CB C 66 38.908 38.908 37.699 1.209 25447
7895 1 19 . 1 1 66 66 PHE H H 66 7.239 7.239 7.707 -0.468 25447
7896 1 19 . 1 1 67 67 ARG N N 67 112.468 112.468 118.227 -5.759 25447
7897 1 19 . 1 1 67 67 ARG HA H 67 4.085 4.085 3.980 0.105 25447
7898 1 19 . 1 1 67 67 ARG CA C 67 58.287 58.287 58.786 -0.499 25447
7899 1 19 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.490 1.270 25447
7900 1 19 . 1 1 67 67 ARG H H 67 6.628 6.628 7.721 -1.093 25447
7901 1 19 . 1 1 68 68 SER N N 68 109.305 109.305 110.872 -1.567 25447
7902 1 19 . 1 1 68 68 SER HA H 68 4.980 4.980 4.792 0.188 25447
7903 1 19 . 1 1 68 68 SER CA C 68 55.785 55.785 56.526 -0.742 25447
7904 1 19 . 1 1 68 68 SER CB C 68 67.691 67.691 65.279 2.412 25447
7905 1 19 . 1 1 68 68 SER H H 68 8.145 8.145 7.297 0.848 25447
7906 1 19 . 1 1 69 69 ILE N N 69 122.602 122.602 125.099 -2.497 25447
7907 1 19 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.749 -0.073 25447
7908 1 19 . 1 1 69 69 ILE CA C 69 66.754 66.754 65.358 1.396 25447
7909 1 19 . 1 1 69 69 ILE CB C 69 37.296 37.296 37.499 -0.203 25447
7910 1 19 . 1 1 69 69 ILE H H 69 9.775 9.775 9.188 0.587 25447
7911 1 19 . 1 1 70 70 ARG N N 70 118.764 118.764 119.105 -0.341 25447
7912 1 19 . 1 1 70 70 ARG HA H 70 3.955 3.955 3.938 0.017 25447
7913 1 19 . 1 1 70 70 ARG CA C 70 60.533 60.533 59.728 0.805 25447
7914 1 19 . 1 1 70 70 ARG CB C 70 30.418 30.418 29.291 1.127 25447
7915 1 19 . 1 1 70 70 ARG H H 70 8.910 8.910 7.912 0.998 25447
7916 1 19 . 1 1 71 71 SER N N 71 117.670 117.670 116.146 1.524 25447
7917 1 19 . 1 1 71 71 SER HA H 71 4.330 4.330 4.258 0.072 25447
7918 1 19 . 1 1 71 71 SER CA C 71 62.287 62.287 61.132 1.155 25447
7919 1 19 . 1 1 71 71 SER CB C 71 63.278 63.278 62.638 0.640 25447
7920 1 19 . 1 1 71 71 SER H H 71 8.518 8.518 7.521 0.997 25447
7921 1 19 . 1 1 72 72 ILE N N 72 127.447 127.447 123.686 3.761 25447
7922 1 19 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.686 0.224 25447
7923 1 19 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.081 1.730 25447
7924 1 19 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.492 0.906 25447
7925 1 19 . 1 1 72 72 ILE H H 72 8.762 8.762 7.302 1.460 25447
7926 1 19 . 1 1 73 73 ASP N N 73 121.636 121.636 119.995 1.641 25447
7927 1 19 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.309 -0.296 25447
7928 1 19 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.204 1.944 25447
7929 1 19 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.660 2.880 25447
7930 1 19 . 1 1 73 73 ASP H H 73 8.677 8.677 8.024 0.653 25447
7931 1 19 . 1 1 74 74 ALA N N 74 118.793 118.793 123.125 -4.332 25447
7932 1 19 . 1 1 74 74 ALA HA H 74 4.044 4.044 4.044 -0.000 25447
7933 1 19 . 1 1 74 74 ALA CA C 74 55.321 55.321 55.059 0.263 25447
7934 1 19 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.649 -0.704 25447
7935 1 19 . 1 1 74 74 ALA H H 74 8.005 8.005 7.659 0.346 25447
7936 1 19 . 1 1 75 75 PHE N N 75 121.235 121.235 119.647 1.588 25447
7937 1 19 . 1 1 75 75 PHE HA H 75 4.038 4.038 4.056 -0.018 25447
7938 1 19 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.783 -0.768 25447
7939 1 19 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.388 -0.551 25447
7940 1 19 . 1 1 75 75 PHE H H 75 8.353 8.353 8.329 0.024 25447
7941 1 19 . 1 1 76 76 VAL N N 76 120.866 120.866 119.213 1.653 25447
7942 1 19 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.290 -0.347 25447
7943 1 19 . 1 1 76 76 VAL CA C 76 66.901 66.901 66.945 -0.044 25447
7944 1 19 . 1 1 76 76 VAL CB C 76 31.247 31.247 31.483 -0.235 25447
7945 1 19 . 1 1 76 76 VAL H H 76 8.544 8.544 8.365 0.179 25447
7946 1 19 . 1 1 77 77 VAL N N 77 121.408 121.408 119.117 2.291 25447
7947 1 19 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.575 -0.080 25447
7948 1 19 . 1 1 77 77 VAL CA C 77 66.833 66.833 66.197 0.636 25447
7949 1 19 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.265 0.665 25447
7950 1 19 . 1 1 77 77 VAL H H 77 8.708 8.708 8.035 0.673 25447
7951 1 19 . 1 1 78 78 GLY N N 78 106.402 106.402 107.044 -0.642 25447
7952 1 19 . 1 1 78 78 GLY CA C 78 46.840 46.840 46.999 -0.159 25447
7953 1 19 . 1 1 78 78 GLY H H 78 7.945 7.945 8.428 -0.483 25447
7954 1 19 . 1 1 79 79 ALA N N 79 121.146 121.146 122.475 -1.329 25447
7955 1 19 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.945 0.262 25447
7956 1 19 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.105 -1.176 25447
7957 1 19 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.193 1.068 25447
7958 1 19 . 1 1 79 79 ALA H H 79 7.639 7.639 7.471 0.168 25447
7959 1 19 . 1 1 80 80 THR N N 80 107.668 107.668 109.485 -1.817 25447
7960 1 19 . 1 1 80 80 THR HA H 80 4.443 4.443 4.242 0.201 25447
7961 1 19 . 1 1 80 80 THR CA C 80 61.406 61.406 63.038 -1.632 25447
7962 1 19 . 1 1 80 80 THR CB C 80 70.767 70.767 69.551 1.216 25447
7963 1 19 . 1 1 80 80 THR H H 80 7.449 7.449 7.654 -0.205 25447
7964 1 19 . 1 1 81 81 THR N N 81 119.953 119.953 116.250 3.703 25447
7965 1 19 . 1 1 81 81 THR HA H 81 4.665 4.665 4.807 -0.142 25447
7966 1 19 . 1 1 81 81 THR CA C 81 60.412 60.412 59.011 1.401 25447
7967 1 19 . 1 1 81 81 THR CB C 81 70.113 70.113 69.627 0.486 25447
7968 1 19 . 1 1 81 81 THR H H 81 7.685 7.685 7.761 -0.076 25447
7969 1 19 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.656 0.033 25447
7970 1 19 . 1 1 82 82 PRO CA C 82 61.688 61.688 61.956 -0.268 25447
7971 1 19 . 1 1 82 82 PRO CB C 82 30.969 30.969 30.715 0.254 25447
7972 1 19 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.522 -0.041 25447
7973 1 19 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.239 0.692 25447
7974 1 19 . 1 1 83 83 PRO CB C 83 32.193 32.193 32.656 -0.463 25447
7975 1 19 . 1 1 84 84 VAL N N 84 120.691 120.691 117.716 2.975 25447
7976 1 19 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.336 -0.243 25447
7977 1 19 . 1 1 84 84 VAL CA C 84 62.339 62.339 61.432 0.907 25447
7978 1 19 . 1 1 84 84 VAL CB C 84 32.851 32.851 32.875 -0.024 25447
7979 1 19 . 1 1 84 84 VAL H H 84 8.257 8.257 8.033 0.224 25447
7980 1 19 . 1 1 85 85 GLU N N 85 127.655 127.655 123.169 4.486 25447
7981 1 19 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.901 0.383 25447
7982 1 19 . 1 1 85 85 GLU CA C 85 56.754 56.754 56.284 0.470 25447
7983 1 19 . 1 1 85 85 GLU CB C 85 30.559 30.559 28.039 2.520 25447
7984 1 19 . 1 1 85 85 GLU H H 85 8.202 8.202 8.747 -0.545 25447
7985 1 19 . 1 1 86 86 ALA N N 86 126.437 126.437 122.029 4.408 25447
7986 1 19 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.198 -0.147 25447
7987 1 19 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.540 -0.392 25447
7988 1 19 . 1 1 86 86 ALA CB C 86 19.460 19.460 19.555 -0.095 25447
7989 1 19 . 1 1 86 86 ALA H H 86 8.323 8.323 8.170 0.153 25447
7990 1 19 . 1 1 87 87 LYS N N 87 121.796 121.796 121.014 0.782 25447
7991 1 19 . 1 1 87 87 LYS HA H 87 4.347 4.347 4.077 0.270 25447
7992 1 19 . 1 1 87 87 LYS CA C 87 56.297 56.297 58.173 -1.876 25447
7993 1 19 . 1 1 87 87 LYS CB C 87 33.276 33.276 32.801 0.475 25447
7994 1 19 . 1 1 87 87 LYS H H 87 8.333 8.333 8.582 -0.249 25447
7995 1 19 . 1 1 88 88 LEU N N 88 125.576 125.576 121.027 4.549 25447
7996 1 19 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.551 -0.644 25447
7997 1 19 . 1 1 88 88 LEU CA C 88 55.772 55.772 54.145 1.627 25447
7998 1 19 . 1 1 88 88 LEU CB C 88 42.472 42.472 42.831 -0.359 25447
7999 1 19 . 1 1 88 88 LEU H H 88 8.444 8.444 7.683 0.761 25447
8000 1 20 . 1 1 1 1 MET N N 1 120.668 120.668 121.685 -1.017 25447
8001 1 20 . 1 1 1 1 MET HA H 1 4.484 4.484 4.226 0.258 25447
8002 1 20 . 1 1 1 1 MET CA C 1 55.257 55.257 57.454 -2.197 25447
8003 1 20 . 1 1 1 1 MET CB C 1 34.517 34.517 32.324 2.193 25447
8004 1 20 . 1 1 1 1 MET H H 1 8.313 8.313 8.767 -0.454 25447
8005 1 20 . 1 1 2 2 GLN N N 2 123.739 123.739 114.900 8.839 25447
8006 1 20 . 1 1 2 2 GLN HA H 2 4.030 4.030 4.226 -0.196 25447
8007 1 20 . 1 1 2 2 GLN CA C 2 57.874 57.874 56.789 1.085 25447
8008 1 20 . 1 1 2 2 GLN CB C 2 29.938 29.938 28.688 1.250 25447
8009 1 20 . 1 1 2 2 GLN H H 2 9.455 9.455 8.055 1.400 25447
8010 1 20 . 1 1 3 3 HIS N N 3 119.115 119.115 119.738 -0.623 25447
8011 1 20 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.896 0.220 25447
8012 1 20 . 1 1 3 3 HIS CA C 3 55.494 55.494 55.584 -0.090 25447
8013 1 20 . 1 1 3 3 HIS CB C 3 31.015 31.015 30.016 0.999 25447
8014 1 20 . 1 1 3 3 HIS H H 3 9.783 9.783 8.227 1.556 25447
8015 1 20 . 1 1 4 4 ALA N N 4 122.648 122.648 123.675 -1.027 25447
8016 1 20 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.061 -0.158 25447
8017 1 20 . 1 1 4 4 ALA CA C 4 56.479 56.479 55.774 0.705 25447
8018 1 20 . 1 1 4 4 ALA CB C 4 19.194 19.194 18.261 0.933 25447
8019 1 20 . 1 1 4 4 ALA H H 4 7.551 7.551 7.994 -0.443 25447
8020 1 20 . 1 1 5 5 SER N N 5 112.599 112.599 114.496 -1.897 25447
8021 1 20 . 1 1 5 5 SER HA H 5 4.298 4.298 4.163 0.135 25447
8022 1 20 . 1 1 5 5 SER CA C 5 62.117 62.117 61.321 0.796 25447
8023 1 20 . 1 1 5 5 SER CB C 5 62.334 62.334 62.817 -0.483 25447
8024 1 20 . 1 1 5 5 SER H H 5 8.736 8.736 8.335 0.401 25447
8025 1 20 . 1 1 6 6 VAL N N 6 122.866 122.866 122.330 0.536 25447
8026 1 20 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.804 0.301 25447
8027 1 20 . 1 1 6 6 VAL CA C 6 65.732 65.732 66.174 -0.442 25447
8028 1 20 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.665 1.072 25447
8029 1 20 . 1 1 6 6 VAL H H 6 7.660 7.660 7.741 -0.081 25447
8030 1 20 . 1 1 7 7 ILE N N 7 121.715 121.715 120.021 1.694 25447
8031 1 20 . 1 1 7 7 ILE HA H 7 4.224 4.224 4.145 0.079 25447
8032 1 20 . 1 1 7 7 ILE CA C 7 65.329 65.329 65.972 -0.643 25447
8033 1 20 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.496 1.197 25447
8034 1 20 . 1 1 7 7 ILE H H 7 8.519 8.519 7.621 0.898 25447
8035 1 20 . 1 1 8 8 ALA N N 8 121.373 121.373 121.801 -0.428 25447
8036 1 20 . 1 1 8 8 ALA HA H 8 3.895 3.895 4.029 -0.134 25447
8037 1 20 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.414 0.843 25447
8038 1 20 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.053 0.587 25447
8039 1 20 . 1 1 8 8 ALA H H 8 8.940 8.940 7.916 1.024 25447
8040 1 20 . 1 1 9 9 GLN N N 9 115.076 115.076 118.726 -3.650 25447
8041 1 20 . 1 1 9 9 GLN HA H 9 3.870 3.870 3.893 -0.023 25447
8042 1 20 . 1 1 9 9 GLN CA C 9 59.192 59.192 59.012 0.180 25447
8043 1 20 . 1 1 9 9 GLN CB C 9 28.138 28.138 28.621 -0.483 25447
8044 1 20 . 1 1 9 9 GLN H H 9 7.729 7.729 7.834 -0.105 25447
8045 1 20 . 1 1 10 10 PHE N N 10 120.207 120.207 119.488 0.719 25447
8046 1 20 . 1 1 10 10 PHE HA H 10 4.085 4.085 3.877 0.208 25447
8047 1 20 . 1 1 10 10 PHE CA C 10 60.893 60.893 61.680 -0.787 25447
8048 1 20 . 1 1 10 10 PHE CB C 10 38.932 38.932 37.852 1.080 25447
8049 1 20 . 1 1 10 10 PHE H H 10 7.301 7.301 7.929 -0.628 25447
8050 1 20 . 1 1 11 11 VAL N N 11 117.569 117.569 119.695 -2.126 25447
8051 1 20 . 1 1 11 11 VAL HA H 11 3.307 3.307 3.941 -0.634 25447
8052 1 20 . 1 1 11 11 VAL CA C 11 66.508 66.508 66.604 -0.096 25447
8053 1 20 . 1 1 11 11 VAL CB C 11 31.487 31.487 31.607 -0.120 25447
8054 1 20 . 1 1 11 11 VAL H H 11 8.370 8.370 7.810 0.560 25447
8055 1 20 . 1 1 12 12 VAL N N 12 117.909 117.909 119.400 -1.491 25447
8056 1 20 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.669 0.072 25447
8057 1 20 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.635 -0.759 25447
8058 1 20 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.206 0.106 25447
8059 1 20 . 1 1 12 12 VAL H H 12 8.294 8.294 8.064 0.230 25447
8060 1 20 . 1 1 13 13 GLU N N 13 117.918 117.918 117.888 0.030 25447
8061 1 20 . 1 1 13 13 GLU HA H 13 3.742 3.742 4.004 -0.262 25447
8062 1 20 . 1 1 13 13 GLU CA C 13 59.307 59.307 58.076 1.231 25447
8063 1 20 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.062 0.427 25447
8064 1 20 . 1 1 13 13 GLU H H 13 7.750 7.750 8.206 -0.456 25447
8065 1 20 . 1 1 14 14 GLU N N 14 113.478 113.478 117.932 -4.454 25447
8066 1 20 . 1 1 14 14 GLU HA H 14 3.778 3.778 4.128 -0.350 25447
8067 1 20 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.845 -2.045 25447
8068 1 20 . 1 1 14 14 GLU CB C 14 29.643 29.643 30.125 -0.482 25447
8069 1 20 . 1 1 14 14 GLU H H 14 7.603 7.603 8.108 -0.505 25447
8070 1 20 . 1 1 15 15 PHE N N 15 114.193 114.193 114.007 0.186 25447
8071 1 20 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.631 0.308 25447
8072 1 20 . 1 1 15 15 PHE CA C 15 58.095 58.095 58.454 -0.359 25447
8073 1 20 . 1 1 15 15 PHE CB C 15 42.095 42.095 42.231 -0.136 25447
8074 1 20 . 1 1 15 15 PHE H H 15 7.908 7.908 7.481 0.426 25447
8075 1 20 . 1 1 16 16 LEU N N 16 121.492 121.492 122.228 -0.736 25447
8076 1 20 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.833 0.134 25447
8077 1 20 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.270 0.107 25447
8078 1 20 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.506 1.227 25447
8079 1 20 . 1 1 16 16 LEU H H 16 8.015 8.015 7.882 0.133 25447
8080 1 20 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.404 -0.021 25447
8081 1 20 . 1 1 17 17 PRO CA C 17 64.858 64.858 63.965 0.893 25447
8082 1 20 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.843 -0.014 25447
8083 1 20 . 1 1 18 18 ASP N N 18 116.508 116.508 118.011 -1.503 25447
8084 1 20 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.736 -0.168 25447
8085 1 20 . 1 1 18 18 ASP CA C 18 54.688 54.688 53.843 0.845 25447
8086 1 20 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.441 0.186 25447
8087 1 20 . 1 1 18 18 ASP H H 18 8.399 8.399 8.491 -0.092 25447
8088 1 20 . 1 1 19 19 VAL N N 19 122.135 122.135 120.636 1.499 25447
8089 1 20 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.133 -0.015 25447
8090 1 20 . 1 1 19 19 VAL CA C 19 61.293 61.293 61.193 0.100 25447
8091 1 20 . 1 1 19 19 VAL CB C 19 33.582 33.582 33.552 0.030 25447
8092 1 20 . 1 1 19 19 VAL H H 19 7.760 7.760 7.267 0.493 25447
8093 1 20 . 1 1 20 20 ALA N N 20 129.301 129.301 130.331 -1.030 25447
8094 1 20 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.591 0.008 25447
8095 1 20 . 1 1 20 20 ALA CA C 20 50.270 50.270 50.067 0.203 25447
8096 1 20 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.362 -0.934 25447
8097 1 20 . 1 1 20 20 ALA H H 20 8.761 8.761 8.396 0.365 25447
8098 1 20 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.171 -0.094 25447
8099 1 20 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.201 1.002 25447
8100 1 20 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.796 -0.388 25447
8101 1 20 . 1 1 22 22 ALA N N 22 116.106 116.106 118.349 -2.243 25447
8102 1 20 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.126 -0.009 25447
8103 1 20 . 1 1 22 22 ALA CA C 22 53.996 53.996 54.157 -0.161 25447
8104 1 20 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.218 0.626 25447
8105 1 20 . 1 1 22 22 ALA H H 22 8.064 8.064 7.911 0.153 25447
8106 1 20 . 1 1 23 23 ASP N N 23 115.541 115.541 117.541 -2.000 25447
8107 1 20 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.630 0.047 25447
8108 1 20 . 1 1 23 23 ASP CA C 23 54.336 54.336 54.314 0.022 25447
8109 1 20 . 1 1 23 23 ASP CB C 23 41.353 41.353 41.402 -0.049 25447
8110 1 20 . 1 1 23 23 ASP H H 23 8.003 8.003 8.057 -0.054 25447
8111 1 20 . 1 1 24 24 VAL N N 24 121.517 121.517 120.108 1.409 25447
8112 1 20 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.182 -0.361 25447
8113 1 20 . 1 1 24 24 VAL CA C 24 62.345 62.345 61.615 0.730 25447
8114 1 20 . 1 1 24 24 VAL CB C 24 31.733 31.733 33.434 -1.701 25447
8115 1 20 . 1 1 24 24 VAL H H 24 7.069 7.069 7.525 -0.456 25447
8116 1 20 . 1 1 25 25 ASP N N 25 129.329 129.329 126.305 3.024 25447
8117 1 20 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.738 -0.164 25447
8118 1 20 . 1 1 25 25 ASP CA C 25 54.566 54.566 52.837 1.728 25447
8119 1 20 . 1 1 25 25 ASP CB C 25 42.333 42.333 42.051 0.282 25447
8120 1 20 . 1 1 25 25 ASP H H 25 8.474 8.474 8.669 -0.195 25447
8121 1 20 . 1 1 26 26 VAL N N 26 121.920 121.920 122.443 -0.523 25447
8122 1 20 . 1 1 26 26 VAL HA H 26 4.108 4.108 4.093 0.015 25447
8123 1 20 . 1 1 26 26 VAL CA C 26 64.518 64.518 62.553 1.965 25447
8124 1 20 . 1 1 26 26 VAL CB C 26 31.198 31.198 30.984 0.214 25447
8125 1 20 . 1 1 26 26 VAL H H 26 8.591 8.591 8.722 -0.131 25447
8126 1 20 . 1 1 27 27 ASP N N 27 116.286 116.286 119.075 -2.789 25447
8127 1 20 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.700 0.445 25447
8128 1 20 . 1 1 27 27 ASP CA C 27 54.181 54.181 54.919 -0.738 25447
8129 1 20 . 1 1 27 27 ASP CB C 27 42.575 42.575 41.499 1.076 25447
8130 1 20 . 1 1 27 27 ASP H H 27 8.609 8.609 8.168 0.441 25447
8131 1 20 . 1 1 28 28 LEU N N 28 125.116 125.116 121.977 3.139 25447
8132 1 20 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.496 -0.485 25447
8133 1 20 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.195 1.892 25447
8134 1 20 . 1 1 28 28 LEU CB C 28 43.321 43.321 44.126 -0.805 25447
8135 1 20 . 1 1 28 28 LEU H H 28 7.374 7.374 7.410 -0.036 25447
8136 1 20 . 1 1 29 29 ASP N N 29 125.924 125.924 124.941 0.983 25447
8137 1 20 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.689 0.145 25447
8138 1 20 . 1 1 29 29 ASP CA C 29 53.920 53.920 55.021 -1.101 25447
8139 1 20 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.269 0.111 25447
8140 1 20 . 1 1 29 29 ASP H H 29 8.699 8.699 8.615 0.084 25447
8141 1 20 . 1 1 30 30 LEU N N 30 129.975 129.975 124.562 5.413 25447
8142 1 20 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.130 -0.213 25447
8143 1 20 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.354 -0.966 25447
8144 1 20 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.445 -0.206 25447
8145 1 20 . 1 1 30 30 LEU H H 30 9.718 9.718 8.075 1.643 25447
8146 1 20 . 1 1 31 31 VAL N N 31 121.212 121.212 117.316 3.896 25447
8147 1 20 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.646 0.547 25447
8148 1 20 . 1 1 31 31 VAL CA C 31 64.433 64.433 66.475 -2.042 25447
8149 1 20 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.291 0.883 25447
8150 1 20 . 1 1 31 31 VAL H H 31 8.163 8.163 7.736 0.427 25447
8151 1 20 . 1 1 32 32 ASP N N 32 124.893 124.893 118.837 6.056 25447
8152 1 20 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.343 0.015 25447
8153 1 20 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.763 0.462 25447
8154 1 20 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.092 0.643 25447
8155 1 20 . 1 1 32 32 ASP H H 32 9.385 9.385 8.725 0.660 25447
8156 1 20 . 1 1 33 33 ASN N N 33 111.484 111.484 116.355 -4.871 25447
8157 1 20 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.603 0.117 25447
8158 1 20 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.693 0.194 25447
8159 1 20 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.048 -0.042 25447
8160 1 20 . 1 1 33 33 ASN H H 33 7.396 7.396 7.690 -0.294 25447
8161 1 20 . 1 1 34 34 GLY N N 34 106.957 106.957 106.310 0.647 25447
8162 1 20 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.814 0.793 25447
8163 1 20 . 1 1 34 34 GLY H H 34 7.618 7.618 7.995 -0.377 25447
8164 1 20 . 1 1 35 35 VAL N N 35 120.424 120.424 119.123 1.301 25447
8165 1 20 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.746 0.020 25447
8166 1 20 . 1 1 35 35 VAL CA C 35 65.125 65.125 64.412 0.713 25447
8167 1 20 . 1 1 35 35 VAL CB C 35 31.879 31.879 31.968 -0.089 25447
8168 1 20 . 1 1 35 35 VAL H H 35 7.792 7.792 7.903 -0.111 25447
8169 1 20 . 1 1 36 36 ILE N N 36 116.364 116.364 119.527 -3.163 25447
8170 1 20 . 1 1 36 36 ILE HA H 36 3.737 3.737 3.922 -0.185 25447
8171 1 20 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.773 -1.088 25447
8172 1 20 . 1 1 36 36 ILE CB C 36 38.807 38.807 37.742 1.065 25447
8173 1 20 . 1 1 36 36 ILE H H 36 7.331 7.331 7.874 -0.543 25447
8174 1 20 . 1 1 37 37 ASP N N 37 127.306 127.306 126.881 0.425 25447
8175 1 20 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.663 0.001 25447
8176 1 20 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.654 -1.038 25447
8177 1 20 . 1 1 37 37 ASP CB C 37 41.209 41.209 43.653 -2.443 25447
8178 1 20 . 1 1 37 37 ASP H H 37 7.874 7.874 8.007 -0.133 25447
8179 1 20 . 1 1 38 38 ALA N N 38 120.352 120.352 122.759 -2.407 25447
8180 1 20 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.157 -0.162 25447
8181 1 20 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.156 1.136 25447
8182 1 20 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.519 -0.207 25447
8183 1 20 . 1 1 38 38 ALA H H 38 8.244 8.244 8.289 -0.045 25447
8184 1 20 . 1 1 39 39 LEU N N 39 117.438 117.438 118.402 -0.964 25447
8185 1 20 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.185 0.065 25447
8186 1 20 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.048 0.307 25447
8187 1 20 . 1 1 39 39 LEU CB C 39 41.236 41.236 41.171 0.065 25447
8188 1 20 . 1 1 39 39 LEU H H 39 7.688 7.688 8.404 -0.716 25447
8189 1 20 . 1 1 40 40 GLY N N 40 112.015 112.015 107.669 4.346 25447
8190 1 20 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.145 0.954 25447
8191 1 20 . 1 1 40 40 GLY H H 40 8.732 8.732 8.327 0.405 25447
8192 1 20 . 1 1 41 41 LEU N N 41 122.983 122.983 122.924 0.059 25447
8193 1 20 . 1 1 41 41 LEU HA H 41 3.851 3.851 3.992 -0.141 25447
8194 1 20 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.537 0.795 25447
8195 1 20 . 1 1 41 41 LEU CB C 41 41.639 41.639 41.957 -0.318 25447
8196 1 20 . 1 1 41 41 LEU H H 41 8.548 8.548 7.992 0.556 25447
8197 1 20 . 1 1 42 42 LEU N N 42 116.076 116.076 119.858 -3.782 25447
8198 1 20 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.931 0.097 25447
8199 1 20 . 1 1 42 42 LEU CA C 42 58.064 58.064 57.992 0.072 25447
8200 1 20 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.493 -0.553 25447
8201 1 20 . 1 1 42 42 LEU H H 42 7.168 7.168 7.628 -0.460 25447
8202 1 20 . 1 1 43 43 LYS N N 43 119.831 119.831 118.988 0.843 25447
8203 1 20 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.037 0.247 25447
8204 1 20 . 1 1 43 43 LYS CA C 43 59.644 59.644 59.956 -0.312 25447
8205 1 20 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.271 0.256 25447
8206 1 20 . 1 1 43 43 LYS H H 43 7.640 7.640 8.277 -0.637 25447
8207 1 20 . 1 1 44 44 VAL N N 44 121.046 121.046 120.593 0.453 25447
8208 1 20 . 1 1 44 44 VAL HA H 44 3.949 3.949 4.029 -0.080 25447
8209 1 20 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.691 -0.048 25447
8210 1 20 . 1 1 44 44 VAL H H 44 8.269 8.269 7.777 0.492 25447
8211 1 20 . 1 1 45 45 ILE N N 45 119.333 119.333 119.675 -0.342 25447
8212 1 20 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.582 -0.178 25447
8213 1 20 . 1 1 45 45 ILE CA C 45 66.148 66.148 64.730 1.418 25447
8214 1 20 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.267 1.010 25447
8215 1 20 . 1 1 45 45 ILE H H 45 8.145 8.145 7.750 0.395 25447
8216 1 20 . 1 1 46 46 ALA N N 46 121.213 121.213 123.584 -2.371 25447
8217 1 20 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.441 -0.184 25447
8218 1 20 . 1 1 46 46 ALA CA C 46 55.164 55.164 54.804 0.360 25447
8219 1 20 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.593 -0.225 25447
8220 1 20 . 1 1 46 46 ALA H H 46 7.792 7.792 8.075 -0.283 25447
8221 1 20 . 1 1 47 47 TRP N N 47 121.416 121.416 120.079 1.337 25447
8222 1 20 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.444 -0.210 25447
8223 1 20 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.514 2.156 25447
8224 1 20 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.363 -1.124 25447
8225 1 20 . 1 1 47 47 TRP H H 47 8.093 8.093 7.973 0.120 25447
8226 1 20 . 1 1 48 48 LEU N N 48 118.963 118.963 121.189 -2.226 25447
8227 1 20 . 1 1 48 48 LEU HA H 48 3.586 3.586 2.800 0.786 25447
8228 1 20 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.656 0.539 25447
8229 1 20 . 1 1 48 48 LEU CB C 48 42.251 42.251 41.194 1.057 25447
8230 1 20 . 1 1 48 48 LEU H H 48 8.693 8.693 7.300 1.393 25447
8231 1 20 . 1 1 49 49 GLU N N 49 119.131 119.131 117.008 2.123 25447
8232 1 20 . 1 1 49 49 GLU HA H 49 4.050 4.050 3.944 0.106 25447
8233 1 20 . 1 1 49 49 GLU CA C 49 59.862 59.862 59.002 0.860 25447
8234 1 20 . 1 1 49 49 GLU CB C 49 29.586 29.586 28.950 0.636 25447
8235 1 20 . 1 1 49 49 GLU H H 49 7.771 7.771 7.632 0.139 25447
8236 1 20 . 1 1 50 50 ASP N N 50 119.941 119.941 120.398 -0.457 25447
8237 1 20 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.397 -0.160 25447
8238 1 20 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.925 0.430 25447
8239 1 20 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.903 1.480 25447
8240 1 20 . 1 1 50 50 ASP H H 50 7.697 7.697 7.598 0.099 25447
8241 1 20 . 1 1 51 51 ARG N N 51 116.911 116.911 117.710 -0.799 25447
8242 1 20 . 1 1 51 51 ARG HA H 51 3.736 3.736 4.029 -0.293 25447
8243 1 20 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.408 -2.044 25447
8244 1 20 . 1 1 51 51 ARG CB C 51 29.315 29.315 30.305 -0.990 25447
8245 1 20 . 1 1 51 51 ARG H H 51 8.881 8.881 7.788 1.093 25447
8246 1 20 . 1 1 52 52 PHE N N 52 112.328 112.328 116.588 -4.260 25447
8247 1 20 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.602 0.073 25447
8248 1 20 . 1 1 52 52 PHE CA C 52 57.413 57.413 58.023 -0.610 25447
8249 1 20 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.477 1.415 25447
8250 1 20 . 1 1 52 52 PHE H H 52 7.284 7.284 7.553 -0.269 25447
8251 1 20 . 1 1 53 53 GLY N N 53 109.826 109.826 108.837 0.989 25447
8252 1 20 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.565 1.236 25447
8253 1 20 . 1 1 53 53 GLY H H 53 7.427 7.427 7.923 -0.496 25447
8254 1 20 . 1 1 54 54 ILE N N 54 119.127 119.127 115.352 3.775 25447
8255 1 20 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.504 -0.553 25447
8256 1 20 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.612 1.073 25447
8257 1 20 . 1 1 54 54 ILE CB C 54 39.490 39.490 39.672 -0.182 25447
8258 1 20 . 1 1 54 54 ILE H H 54 6.876 6.876 7.595 -0.719 25447
8259 1 20 . 1 1 55 55 ALA N N 55 129.823 129.823 123.619 6.204 25447
8260 1 20 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.524 -0.110 25447
8261 1 20 . 1 1 55 55 ALA CA C 55 51.610 51.610 50.565 1.045 25447
8262 1 20 . 1 1 55 55 ALA CB C 55 19.262 19.262 20.247 -0.985 25447
8263 1 20 . 1 1 55 55 ALA H H 55 8.499 8.499 8.096 0.403 25447
8264 1 20 . 1 1 56 56 ALA N N 56 126.300 126.300 126.122 0.178 25447
8265 1 20 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.028 0.241 25447
8266 1 20 . 1 1 56 56 ALA CA C 56 53.474 53.474 54.556 -1.082 25447
8267 1 20 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.672 0.572 25447
8268 1 20 . 1 1 56 56 ALA H H 56 8.641 8.641 8.788 -0.147 25447
8269 1 20 . 1 1 57 57 ASP N N 57 116.395 116.395 116.720 -0.325 25447
8270 1 20 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.348 0.131 25447
8271 1 20 . 1 1 57 57 ASP CA C 57 55.226 55.226 56.064 -0.838 25447
8272 1 20 . 1 1 57 57 ASP CB C 57 40.922 40.922 39.531 1.391 25447
8273 1 20 . 1 1 57 57 ASP H H 57 8.337 8.337 8.439 -0.102 25447
8274 1 20 . 1 1 58 58 ASP N N 58 118.557 118.557 119.995 -1.438 25447
8275 1 20 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.441 0.195 25447
8276 1 20 . 1 1 58 58 ASP CA C 58 55.144 55.144 55.833 -0.689 25447
8277 1 20 . 1 1 58 58 ASP CB C 58 41.504 41.504 41.498 0.006 25447
8278 1 20 . 1 1 58 58 ASP H H 58 8.027 8.027 7.822 0.205 25447
8279 1 20 . 1 1 59 59 VAL N N 59 118.898 118.898 118.779 0.119 25447
8280 1 20 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.280 -0.104 25447
8281 1 20 . 1 1 59 59 VAL CA C 59 62.300 62.300 60.511 1.789 25447
8282 1 20 . 1 1 59 59 VAL CB C 59 33.078 33.078 34.519 -1.440 25447
8283 1 20 . 1 1 59 59 VAL H H 59 7.716 7.716 7.442 0.274 25447
8284 1 20 . 1 1 60 60 GLU N N 60 122.888 122.888 126.596 -3.708 25447
8285 1 20 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.416 -0.132 25447
8286 1 20 . 1 1 60 60 GLU CA C 60 56.546 56.546 55.812 0.734 25447
8287 1 20 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.609 -0.827 25447
8288 1 20 . 1 1 60 60 GLU H H 60 8.367 8.367 8.355 0.012 25447
8289 1 20 . 1 1 61 61 LEU N N 61 124.827 124.827 125.122 -0.295 25447
8290 1 20 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.412 -0.054 25447
8291 1 20 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.243 0.573 25447
8292 1 20 . 1 1 61 61 LEU CB C 61 41.937 41.937 42.586 -0.648 25447
8293 1 20 . 1 1 61 61 LEU H H 61 8.198 8.198 8.414 -0.216 25447
8294 1 20 . 1 1 62 62 SER N N 62 118.715 118.715 119.386 -0.671 25447
8295 1 20 . 1 1 62 62 SER HA H 62 4.809 4.809 4.940 -0.131 25447
8296 1 20 . 1 1 62 62 SER CA C 62 55.732 55.732 55.506 0.226 25447
8297 1 20 . 1 1 62 62 SER CB C 62 64.017 64.017 64.993 -0.977 25447
8298 1 20 . 1 1 62 62 SER H H 62 8.137 8.137 8.246 -0.109 25447
8299 1 20 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.283 -0.030 25447
8300 1 20 . 1 1 63 63 PRO CA C 63 64.896 64.896 65.189 -0.293 25447
8301 1 20 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.806 0.246 25447
8302 1 20 . 1 1 64 64 GLU N N 64 116.554 116.554 119.067 -2.513 25447
8303 1 20 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.145 -0.272 25447
8304 1 20 . 1 1 64 64 GLU CA C 64 58.719 58.719 58.849 -0.130 25447
8305 1 20 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.250 -0.569 25447
8306 1 20 . 1 1 64 64 GLU H H 64 8.316 8.316 8.492 -0.176 25447
8307 1 20 . 1 1 65 65 HIS N N 65 115.487 115.487 119.245 -3.758 25447
8308 1 20 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.158 0.122 25447
8309 1 20 . 1 1 65 65 HIS CA C 65 57.652 57.652 57.877 -0.225 25447
8310 1 20 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.394 0.488 25447
8311 1 20 . 1 1 65 65 HIS H H 65 7.274 7.274 8.289 -1.015 25447
8312 1 20 . 1 1 66 66 PHE N N 66 116.127 116.127 115.131 0.996 25447
8313 1 20 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.681 0.085 25447
8314 1 20 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.415 -1.633 25447
8315 1 20 . 1 1 66 66 PHE CB C 66 38.908 38.908 38.086 0.822 25447
8316 1 20 . 1 1 66 66 PHE H H 66 7.239 7.239 7.734 -0.495 25447
8317 1 20 . 1 1 67 67 ARG N N 67 112.468 112.468 119.674 -7.206 25447
8318 1 20 . 1 1 67 67 ARG HA H 67 4.085 4.085 3.981 0.104 25447
8319 1 20 . 1 1 67 67 ARG CA C 67 58.287 58.287 59.365 -1.079 25447
8320 1 20 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.445 1.315 25447
8321 1 20 . 1 1 67 67 ARG H H 67 6.628 6.628 7.864 -1.236 25447
8322 1 20 . 1 1 68 68 SER N N 68 109.305 109.305 110.172 -0.867 25447
8323 1 20 . 1 1 68 68 SER HA H 68 4.980 4.980 4.676 0.304 25447
8324 1 20 . 1 1 68 68 SER CA C 68 55.785 55.785 56.518 -0.733 25447
8325 1 20 . 1 1 68 68 SER CB C 68 67.691 67.691 65.438 2.253 25447
8326 1 20 . 1 1 68 68 SER H H 68 8.145 8.145 7.446 0.699 25447
8327 1 20 . 1 1 69 69 ILE N N 69 122.602 122.602 124.416 -1.814 25447
8328 1 20 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.825 -0.149 25447
8329 1 20 . 1 1 69 69 ILE CA C 69 66.754 66.754 64.124 2.630 25447
8330 1 20 . 1 1 69 69 ILE CB C 69 37.296 37.296 36.948 0.348 25447
8331 1 20 . 1 1 69 69 ILE H H 69 9.775 9.775 9.204 0.571 25447
8332 1 20 . 1 1 70 70 ARG N N 70 118.764 118.764 119.953 -1.189 25447
8333 1 20 . 1 1 70 70 ARG HA H 70 3.955 3.955 3.965 -0.010 25447
8334 1 20 . 1 1 70 70 ARG CA C 70 60.533 60.533 59.583 0.950 25447
8335 1 20 . 1 1 70 70 ARG CB C 70 30.418 30.418 28.873 1.545 25447
8336 1 20 . 1 1 70 70 ARG H H 70 8.910 8.910 7.620 1.290 25447
8337 1 20 . 1 1 71 71 SER N N 71 117.670 117.670 115.495 2.175 25447
8338 1 20 . 1 1 71 71 SER HA H 71 4.330 4.330 4.252 0.078 25447
8339 1 20 . 1 1 71 71 SER CA C 71 62.287 62.287 61.076 1.211 25447
8340 1 20 . 1 1 71 71 SER CB C 71 63.278 63.278 62.168 1.110 25447
8341 1 20 . 1 1 71 71 SER H H 71 8.518 8.518 7.981 0.537 25447
8342 1 20 . 1 1 72 72 ILE N N 72 127.447 127.447 122.743 4.704 25447
8343 1 20 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.235 0.675 25447
8344 1 20 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.677 1.134 25447
8345 1 20 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.546 0.852 25447
8346 1 20 . 1 1 72 72 ILE H H 72 8.762 8.762 7.602 1.160 25447
8347 1 20 . 1 1 73 73 ASP N N 73 121.636 121.636 120.060 1.576 25447
8348 1 20 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.367 -0.354 25447
8349 1 20 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.366 1.782 25447
8350 1 20 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.670 2.870 25447
8351 1 20 . 1 1 73 73 ASP H H 73 8.677 8.677 7.949 0.728 25447
8352 1 20 . 1 1 74 74 ALA N N 74 118.793 118.793 121.994 -3.201 25447
8353 1 20 . 1 1 74 74 ALA HA H 74 4.044 4.044 4.087 -0.043 25447
8354 1 20 . 1 1 74 74 ALA CA C 74 55.321 55.321 54.945 0.376 25447
8355 1 20 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.341 -0.396 25447
8356 1 20 . 1 1 74 74 ALA H H 74 8.005 8.005 7.924 0.081 25447
8357 1 20 . 1 1 75 75 PHE N N 75 121.235 121.235 120.142 1.093 25447
8358 1 20 . 1 1 75 75 PHE HA H 75 4.038 4.038 4.056 -0.018 25447
8359 1 20 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.931 -0.916 25447
8360 1 20 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.394 -0.557 25447
8361 1 20 . 1 1 75 75 PHE H H 75 8.353 8.353 8.369 -0.016 25447
8362 1 20 . 1 1 76 76 VAL N N 76 120.866 120.866 119.105 1.761 25447
8363 1 20 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.468 -0.525 25447
8364 1 20 . 1 1 76 76 VAL CA C 76 66.901 66.901 65.968 0.933 25447
8365 1 20 . 1 1 76 76 VAL CB C 76 31.247 31.247 30.982 0.265 25447
8366 1 20 . 1 1 76 76 VAL H H 76 8.544 8.544 8.208 0.336 25447
8367 1 20 . 1 1 77 77 VAL N N 77 121.408 121.408 119.871 1.537 25447
8368 1 20 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.729 -0.234 25447
8369 1 20 . 1 1 77 77 VAL CA C 77 66.833 66.833 66.992 -0.159 25447
8370 1 20 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.195 0.735 25447
8371 1 20 . 1 1 77 77 VAL H H 77 8.708 8.708 8.612 0.096 25447
8372 1 20 . 1 1 78 78 GLY N N 78 106.402 106.402 107.246 -0.844 25447
8373 1 20 . 1 1 78 78 GLY CA C 78 46.840 46.840 46.995 -0.155 25447
8374 1 20 . 1 1 78 78 GLY H H 78 7.945 7.945 8.537 -0.592 25447
8375 1 20 . 1 1 79 79 ALA N N 79 121.146 121.146 122.500 -1.354 25447
8376 1 20 . 1 1 79 79 ALA HA H 79 4.207 4.207 4.008 0.199 25447
8377 1 20 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.297 -1.367 25447
8378 1 20 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.416 0.845 25447
8379 1 20 . 1 1 79 79 ALA H H 79 7.639 7.639 7.577 0.062 25447
8380 1 20 . 1 1 80 80 THR N N 80 107.668 107.668 110.396 -2.728 25447
8381 1 20 . 1 1 80 80 THR HA H 80 4.443 4.443 4.244 0.199 25447
8382 1 20 . 1 1 80 80 THR CA C 80 61.406 61.406 63.383 -1.976 25447
8383 1 20 . 1 1 80 80 THR CB C 80 70.767 70.767 69.555 1.212 25447
8384 1 20 . 1 1 80 80 THR H H 80 7.449 7.449 7.747 -0.298 25447
8385 1 20 . 1 1 81 81 THR N N 81 119.953 119.953 116.132 3.821 25447
8386 1 20 . 1 1 81 81 THR HA H 81 4.665 4.665 4.797 -0.132 25447
8387 1 20 . 1 1 81 81 THR CA C 81 60.412 60.412 59.171 1.241 25447
8388 1 20 . 1 1 81 81 THR CB C 81 70.113 70.113 69.370 0.743 25447
8389 1 20 . 1 1 81 81 THR H H 81 7.685 7.685 7.995 -0.310 25447
8390 1 20 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.499 0.190 25447
8391 1 20 . 1 1 82 82 PRO CA C 82 61.688 61.688 62.608 -0.920 25447
8392 1 20 . 1 1 82 82 PRO CB C 82 30.969 30.969 30.738 0.231 25447
8393 1 20 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.343 0.138 25447
8394 1 20 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.921 0.010 25447
8395 1 20 . 1 1 83 83 PRO CB C 83 32.193 32.193 32.439 -0.246 25447
8396 1 20 . 1 1 84 84 VAL N N 84 120.691 120.691 122.334 -1.643 25447
8397 1 20 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.156 -0.063 25447
8398 1 20 . 1 1 84 84 VAL CA C 84 62.339 62.339 61.941 0.398 25447
8399 1 20 . 1 1 84 84 VAL CB C 84 32.851 32.851 32.901 -0.050 25447
8400 1 20 . 1 1 84 84 VAL H H 84 8.257 8.257 8.099 0.158 25447
8401 1 20 . 1 1 85 85 GLU N N 85 127.655 127.655 121.871 5.784 25447
8402 1 20 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.927 0.357 25447
8403 1 20 . 1 1 85 85 GLU CA C 85 56.754 56.754 56.839 -0.085 25447
8404 1 20 . 1 1 85 85 GLU CB C 85 30.559 30.559 28.290 2.269 25447
8405 1 20 . 1 1 85 85 GLU H H 85 8.202 8.202 8.742 -0.540 25447
8406 1 20 . 1 1 86 86 ALA N N 86 126.437 126.437 120.918 5.519 25447
8407 1 20 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.004 0.047 25447
8408 1 20 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.881 -0.733 25447
8409 1 20 . 1 1 86 86 ALA CB C 86 19.460 19.460 18.881 0.579 25447
8410 1 20 . 1 1 86 86 ALA H H 86 8.323 8.323 7.666 0.657 25447
8411 1 20 . 1 1 87 87 LYS N N 87 121.796 121.796 120.322 1.474 25447
8412 1 20 . 1 1 87 87 LYS HA H 87 4.347 4.347 4.222 0.125 25447
8413 1 20 . 1 1 87 87 LYS CA C 87 56.297 56.297 55.972 0.325 25447
8414 1 20 . 1 1 87 87 LYS CB C 87 33.276 33.276 32.769 0.507 25447
8415 1 20 . 1 1 87 87 LYS H H 87 8.333 8.333 8.109 0.224 25447
8416 1 20 . 1 1 88 88 LEU N N 88 125.576 125.576 125.241 0.335 25447
8417 1 20 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.067 -0.160 25447
8418 1 20 . 1 1 88 88 LEU CA C 88 55.772 55.772 57.557 -1.785 25447
8419 1 20 . 1 1 88 88 LEU CB C 88 42.472 42.472 42.178 0.294 25447
8420 1 20 . 1 1 88 88 LEU H H 88 8.444 8.444 8.638 -0.194 25447
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 83 3.196 -0.331 3.199 25447
2 1 1 "Average Difference" HA 92 0.274 -0.035 0.273 25447
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25447
4 1 1 "Average Difference" CA 87 1.068 -0.077 1.071 25447
5 1 1 "Average Difference" CB 84 1.082 -0.332 1.036 25447
6 1 1 "Average Difference" HN 83 0.601 -0.083 0.599 25447
7 1 2 "Average Difference" N 83 2.865 -0.144 2.878 25447
8 1 2 "Average Difference" HA 92 0.256 -0.008 0.257 25447
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25447
10 1 2 "Average Difference" CA 87 1.021 -0.199 1.007 25447
11 1 2 "Average Difference" CB 84 1.112 -0.342 1.065 25447
12 1 2 "Average Difference" HN 83 0.602 -0.112 0.595 25447
13 1 3 "Average Difference" N 83 2.538 -0.096 2.551 25447
14 1 3 "Average Difference" HA 92 0.246 0.002 0.247 25447
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25447
16 1 3 "Average Difference" CA 87 1.030 -0.196 1.017 25447
17 1 3 "Average Difference" CB 84 0.899 -0.286 0.858 25447
18 1 3 "Average Difference" HN 83 0.552 -0.065 0.552 25447
19 1 4 "Average Difference" N 83 2.782 -0.231 2.789 25447
20 1 4 "Average Difference" HA 92 0.263 -0.002 0.265 25447
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25447
22 1 4 "Average Difference" CA 87 1.078 -0.159 1.073 25447
23 1 4 "Average Difference" CB 84 0.991 -0.240 0.967 25447
24 1 4 "Average Difference" HN 83 0.551 -0.097 0.546 25447
25 1 5 "Average Difference" N 83 2.632 0.122 2.645 25447
26 1 5 "Average Difference" HA 92 0.266 0.009 0.267 25447
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25447
28 1 5 "Average Difference" CA 87 1.007 -0.079 1.010 25447
29 1 5 "Average Difference" CB 84 0.928 -0.252 0.898 25447
30 1 5 "Average Difference" HN 83 0.584 -0.061 0.585 25447
31 1 6 "Average Difference" N 83 2.641 -0.149 2.653 25447
32 1 6 "Average Difference" HA 92 0.261 -0.014 0.262 25447
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25447
34 1 6 "Average Difference" CA 87 1.052 -0.246 1.028 25447
35 1 6 "Average Difference" CB 84 1.027 -0.297 0.989 25447
36 1 6 "Average Difference" HN 83 0.542 -0.096 0.536 25447
37 1 7 "Average Difference" N 83 2.906 -0.126 2.921 25447
38 1 7 "Average Difference" HA 92 0.287 -0.016 0.288 25447
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25447
40 1 7 "Average Difference" CA 87 1.118 -0.253 1.095 25447
41 1 7 "Average Difference" CB 84 1.045 -0.271 1.016 25447
42 1 7 "Average Difference" HN 83 0.576 -0.108 0.569 25447
43 1 8 "Average Difference" N 83 2.641 -0.047 2.656 25447
44 1 8 "Average Difference" HA 92 0.254 -0.003 0.256 25447
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25447
46 1 8 "Average Difference" CA 87 1.076 -0.181 1.067 25447
47 1 8 "Average Difference" CB 84 0.904 -0.249 0.874 25447
48 1 8 "Average Difference" HN 83 0.560 -0.102 0.554 25447
49 1 9 "Average Difference" N 83 2.845 -0.275 2.849 25447
50 1 9 "Average Difference" HA 92 0.263 -0.028 0.263 25447
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25447
52 1 9 "Average Difference" CA 87 1.085 -0.177 1.076 25447
53 1 9 "Average Difference" CB 84 1.073 -0.313 1.032 25447
54 1 9 "Average Difference" HN 83 0.599 -0.105 0.593 25447
55 1 10 "Average Difference" N 83 2.989 -0.159 3.003 25447
56 1 10 "Average Difference" HA 92 0.279 -0.037 0.278 25447
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25447
58 1 10 "Average Difference" CA 87 1.098 -0.160 1.093 25447
59 1 10 "Average Difference" CB 84 1.132 -0.322 1.092 25447
60 1 10 "Average Difference" HN 83 0.616 -0.100 0.611 25447
61 1 11 "Average Difference" N 83 3.000 -0.347 2.998 25447
62 1 11 "Average Difference" HA 92 0.268 -0.015 0.269 25447
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25447
64 1 11 "Average Difference" CA 87 1.065 -0.116 1.064 25447
65 1 11 "Average Difference" CB 84 1.019 -0.276 0.987 25447
66 1 11 "Average Difference" HN 83 0.578 -0.081 0.576 25447
67 1 12 "Average Difference" N 83 3.113 -0.453 3.098 25447
68 1 12 "Average Difference" HA 92 0.263 -0.035 0.262 25447
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25447
70 1 12 "Average Difference" CA 87 1.059 -0.144 1.055 25447
71 1 12 "Average Difference" CB 84 1.078 -0.338 1.030 25447
72 1 12 "Average Difference" HN 83 0.617 -0.142 0.604 25447
73 1 13 "Average Difference" N 83 2.996 -0.259 3.003 25447
74 1 13 "Average Difference" HA 92 0.255 -0.020 0.256 25447
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25447
76 1 13 "Average Difference" CA 87 1.040 -0.188 1.029 25447
77 1 13 "Average Difference" CB 84 1.078 -0.290 1.044 25447
78 1 13 "Average Difference" HN 83 0.554 -0.108 0.547 25447
79 1 14 "Average Difference" N 83 2.820 -0.220 2.828 25447
80 1 14 "Average Difference" HA 92 0.258 -0.012 0.259 25447
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25447
82 1 14 "Average Difference" CA 87 0.964 -0.152 0.958 25447
83 1 14 "Average Difference" CB 84 0.971 -0.251 0.944 25447
84 1 14 "Average Difference" HN 83 0.555 -0.123 0.544 25447
85 1 15 "Average Difference" N 83 3.224 -0.347 3.224 25447
86 1 15 "Average Difference" HA 92 0.263 -0.009 0.264 25447
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25447
88 1 15 "Average Difference" CA 87 1.074 -0.122 1.074 25447
89 1 15 "Average Difference" CB 84 1.021 -0.322 0.975 25447
90 1 15 "Average Difference" HN 83 0.606 -0.095 0.602 25447
91 1 16 "Average Difference" N 83 2.680 0.039 2.696 25447
92 1 16 "Average Difference" HA 92 0.272 -0.029 0.272 25447
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25447
94 1 16 "Average Difference" CA 87 1.067 -0.109 1.067 25447
95 1 16 "Average Difference" CB 84 0.969 -0.320 0.920 25447
96 1 16 "Average Difference" HN 83 0.605 -0.086 0.603 25447
97 1 17 "Average Difference" N 83 3.180 -0.322 3.183 25447
98 1 17 "Average Difference" HA 92 0.285 -0.043 0.283 25447
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25447
100 1 17 "Average Difference" CA 87 1.008 -0.159 1.001 25447
101 1 17 "Average Difference" CB 84 1.072 -0.318 1.030 25447
102 1 17 "Average Difference" HN 83 0.634 -0.125 0.626 25447
103 1 18 "Average Difference" N 83 2.743 -0.168 2.755 25447
104 1 18 "Average Difference" HA 92 0.270 0.049 0.267 25447
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25447
106 1 18 "Average Difference" CA 87 0.994 -0.147 0.989 25447
107 1 18 "Average Difference" CB 84 0.938 -0.245 0.911 25447
108 1 18 "Average Difference" HN 83 0.538 -0.096 0.533 25447
109 1 19 "Average Difference" N 83 2.678 -0.171 2.689 25447
110 1 19 "Average Difference" HA 92 0.264 0.030 0.264 25447
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25447
112 1 19 "Average Difference" CA 87 1.088 -0.167 1.081 25447
113 1 19 "Average Difference" CB 84 1.043 -0.284 1.010 25447
114 1 19 "Average Difference" HN 83 0.586 -0.117 0.578 25447
115 1 20 "Average Difference" N 83 2.811 -0.051 2.828 25447
116 1 20 "Average Difference" HA 92 0.240 -0.010 0.241 25447
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25447
118 1 20 "Average Difference" CA 87 1.060 -0.125 1.059 25447
119 1 20 "Average Difference" CB 84 0.957 -0.296 0.915 25447
120 1 20 "Average Difference" HN 83 0.585 -0.107 0.579 25447
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 25447
_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 1 1 MET N N 1 120.668 120.668 118.279 2.389 25447
2 1 . 1 1 1 1 MET HA H 1 4.484 4.484 4.399 0.085 25447
3 1 . 1 1 1 1 MET CA C 1 55.257 55.257 56.026 -0.769 25447
4 1 . 1 1 1 1 MET CB C 1 34.517 34.517 33.112 1.405 25447
5 1 . 1 1 1 1 MET H H 1 8.313 8.313 8.075 0.238 25447
6 1 . 1 1 2 2 GLN N N 2 123.739 123.739 116.915 6.824 25447
7 1 . 1 1 2 2 GLN HA H 2 4.030 4.030 4.020 0.010 25447
8 1 . 1 1 2 2 GLN CA C 2 57.874 57.874 56.100 1.774 25447
9 1 . 1 1 2 2 GLN CB C 2 29.938 29.938 27.967 1.971 25447
10 1 . 1 1 2 2 GLN H H 2 9.455 9.455 8.143 1.312 25447
11 1 . 1 1 3 3 HIS N N 3 119.115 119.115 115.248 3.867 25447
12 1 . 1 1 3 3 HIS HA H 3 5.116 5.116 4.373 0.743 25447
13 1 . 1 1 3 3 HIS CA C 3 55.494 55.494 56.382 -0.888 25447
14 1 . 1 1 3 3 HIS CB C 3 31.015 31.015 28.133 2.882 25447
15 1 . 1 1 3 3 HIS H H 3 9.783 9.783 8.408 1.375 25447
16 1 . 1 1 4 4 ALA N N 4 122.648 122.648 122.507 0.141 25447
17 1 . 1 1 4 4 ALA HA H 4 3.903 3.903 4.105 -0.202 25447
18 1 . 1 1 4 4 ALA CA C 4 56.479 56.479 55.251 1.228 25447
19 1 . 1 1 4 4 ALA CB C 4 19.194 19.194 18.835 0.359 25447
20 1 . 1 1 4 4 ALA H H 4 7.551 7.551 8.246 -0.695 25447
21 1 . 1 1 5 5 SER N N 5 112.599 112.599 114.003 -1.404 25447
22 1 . 1 1 5 5 SER HA H 5 4.298 4.298 4.224 0.074 25447
23 1 . 1 1 5 5 SER CA C 5 62.117 62.117 61.517 0.600 25447
24 1 . 1 1 5 5 SER CB C 5 62.334 62.334 62.495 -0.162 25447
25 1 . 1 1 5 5 SER H H 5 8.736 8.736 8.418 0.318 25447
26 1 . 1 1 6 6 VAL N N 6 122.866 122.866 122.529 0.337 25447
27 1 . 1 1 6 6 VAL HA H 6 4.105 4.105 3.792 0.313 25447
28 1 . 1 1 6 6 VAL CA C 6 65.732 65.732 66.234 -0.502 25447
29 1 . 1 1 6 6 VAL CB C 6 32.737 32.737 31.619 1.118 25447
30 1 . 1 1 6 6 VAL H H 6 7.660 7.660 7.624 0.036 25447
31 1 . 1 1 7 7 ILE N N 7 121.715 121.715 120.110 1.605 25447
32 1 . 1 1 7 7 ILE HA H 7 4.224 4.224 4.042 0.182 25447
33 1 . 1 1 7 7 ILE CA C 7 65.329 65.329 65.912 -0.584 25447
34 1 . 1 1 7 7 ILE CB C 7 38.693 38.693 37.543 1.150 25447
35 1 . 1 1 7 7 ILE H H 7 8.519 8.519 7.720 0.799 25447
36 1 . 1 1 8 8 ALA N N 8 121.373 121.373 121.468 -0.095 25447
37 1 . 1 1 8 8 ALA HA H 8 3.895 3.895 4.005 -0.110 25447
38 1 . 1 1 8 8 ALA CA C 8 56.257 56.257 55.357 0.900 25447
39 1 . 1 1 8 8 ALA CB C 8 18.640 18.640 18.058 0.582 25447
40 1 . 1 1 8 8 ALA H H 8 8.940 8.940 8.004 0.936 25447
41 1 . 1 1 9 9 GLN N N 9 115.076 115.076 119.011 -3.935 25447
42 1 . 1 1 9 9 GLN HA H 9 3.870 3.870 3.961 -0.091 25447
43 1 . 1 1 9 9 GLN CA C 9 59.192 59.192 58.940 0.252 25447
44 1 . 1 1 9 9 GLN CB C 9 28.138 28.138 28.723 -0.585 25447
45 1 . 1 1 9 9 GLN H H 9 7.729 7.729 8.084 -0.355 25447
46 1 . 1 1 10 10 PHE N N 10 120.207 120.207 119.389 0.818 25447
47 1 . 1 1 10 10 PHE HA H 10 4.085 4.085 3.987 0.098 25447
48 1 . 1 1 10 10 PHE CA C 10 60.893 60.893 61.269 -0.376 25447
49 1 . 1 1 10 10 PHE CB C 10 38.932 38.932 38.329 0.603 25447
50 1 . 1 1 10 10 PHE H H 10 7.301 7.301 8.131 -0.830 25447
51 1 . 1 1 11 11 VAL N N 11 117.569 117.569 118.737 -1.168 25447
52 1 . 1 1 11 11 VAL HA H 11 3.307 3.307 3.597 -0.290 25447
53 1 . 1 1 11 11 VAL CA C 11 66.508 66.508 65.736 0.771 25447
54 1 . 1 1 11 11 VAL CB C 11 31.487 31.487 31.534 -0.047 25447
55 1 . 1 1 11 11 VAL H H 11 8.370 8.370 7.858 0.512 25447
56 1 . 1 1 12 12 VAL N N 12 117.909 117.909 119.782 -1.873 25447
57 1 . 1 1 12 12 VAL HA H 12 3.741 3.741 3.608 0.133 25447
58 1 . 1 1 12 12 VAL CA C 12 65.876 65.876 66.766 -0.890 25447
59 1 . 1 1 12 12 VAL CB C 12 31.312 31.312 31.440 -0.128 25447
60 1 . 1 1 12 12 VAL H H 12 8.294 8.294 7.941 0.353 25447
61 1 . 1 1 13 13 GLU N N 13 117.918 117.918 118.743 -0.825 25447
62 1 . 1 1 13 13 GLU HA H 13 3.742 3.742 3.980 -0.238 25447
63 1 . 1 1 13 13 GLU CA C 13 59.307 59.307 58.660 0.647 25447
64 1 . 1 1 13 13 GLU CB C 13 29.489 29.489 29.220 0.269 25447
65 1 . 1 1 13 13 GLU H H 13 7.750 7.750 8.061 -0.311 25447
66 1 . 1 1 14 14 GLU N N 14 113.478 113.478 117.988 -4.510 25447
67 1 . 1 1 14 14 GLU HA H 14 3.778 3.778 4.046 -0.268 25447
68 1 . 1 1 14 14 GLU CA C 14 56.800 56.800 58.720 -1.920 25447
69 1 . 1 1 14 14 GLU CB C 14 29.643 29.643 30.015 -0.372 25447
70 1 . 1 1 14 14 GLU H H 14 7.603 7.603 7.944 -0.340 25447
71 1 . 1 1 15 15 PHE N N 15 114.193 114.193 115.265 -1.072 25447
72 1 . 1 1 15 15 PHE HA H 15 4.939 4.939 4.583 0.356 25447
73 1 . 1 1 15 15 PHE CA C 15 58.095 58.095 59.001 -0.906 25447
74 1 . 1 1 15 15 PHE CB C 15 42.095 42.095 41.883 0.212 25447
75 1 . 1 1 15 15 PHE H H 15 7.908 7.908 7.566 0.342 25447
76 1 . 1 1 16 16 LEU N N 16 121.492 121.492 121.415 0.077 25447
77 1 . 1 1 16 16 LEU HA H 16 4.967 4.967 4.806 0.161 25447
78 1 . 1 1 16 16 LEU CA C 16 52.377 52.377 52.201 0.176 25447
79 1 . 1 1 16 16 LEU CB C 16 44.733 44.733 43.389 1.344 25447
80 1 . 1 1 16 16 LEU H H 16 8.015 8.015 8.141 -0.126 25447
81 1 . 1 1 17 17 PRO HA H 17 4.383 4.383 4.407 -0.024 25447
82 1 . 1 1 17 17 PRO CA C 17 64.858 64.858 64.027 0.831 25447
83 1 . 1 1 17 17 PRO CB C 17 31.829 31.829 31.814 0.015 25447
84 1 . 1 1 18 18 ASP N N 18 116.508 116.508 118.148 -1.640 25447
85 1 . 1 1 18 18 ASP HA H 18 4.568 4.568 4.685 -0.117 25447
86 1 . 1 1 18 18 ASP CA C 18 54.688 54.688 53.827 0.861 25447
87 1 . 1 1 18 18 ASP CB C 18 40.626 40.626 40.501 0.124 25447
88 1 . 1 1 18 18 ASP H H 18 8.399 8.399 8.565 -0.165 25447
89 1 . 1 1 19 19 VAL N N 19 122.135 122.135 120.684 1.451 25447
90 1 . 1 1 19 19 VAL HA H 19 4.118 4.118 4.145 -0.027 25447
91 1 . 1 1 19 19 VAL CA C 19 61.293 61.293 60.831 0.462 25447
92 1 . 1 1 19 19 VAL CB C 19 33.582 33.582 33.716 -0.134 25447
93 1 . 1 1 19 19 VAL H H 19 7.760 7.760 7.255 0.505 25447
94 1 . 1 1 20 20 ALA N N 20 129.301 129.301 130.561 -1.260 25447
95 1 . 1 1 20 20 ALA HA H 20 4.599 4.599 4.547 0.052 25447
96 1 . 1 1 20 20 ALA CA C 20 50.270 50.270 50.130 0.140 25447
97 1 . 1 1 20 20 ALA CB C 20 17.428 17.428 18.326 -0.898 25447
98 1 . 1 1 20 20 ALA H H 20 8.761 8.761 8.426 0.335 25447
99 1 . 1 1 21 21 PRO HA H 21 4.077 4.077 4.157 -0.080 25447
100 1 . 1 1 21 21 PRO CA C 21 66.203 66.203 65.476 0.727 25447
101 1 . 1 1 21 21 PRO CB C 21 31.408 31.408 31.791 -0.383 25447
102 1 . 1 1 22 22 ALA N N 22 116.106 116.106 118.026 -1.920 25447
103 1 . 1 1 22 22 ALA HA H 22 4.117 4.117 4.136 -0.019 25447
104 1 . 1 1 22 22 ALA CA C 22 53.996 53.996 54.061 -0.065 25447
105 1 . 1 1 22 22 ALA CB C 22 18.844 18.844 18.284 0.560 25447
106 1 . 1 1 22 22 ALA H H 22 8.064 8.064 7.998 0.066 25447
107 1 . 1 1 23 23 ASP N N 23 115.541 115.541 117.047 -1.506 25447
108 1 . 1 1 23 23 ASP HA H 23 4.677 4.677 4.619 0.058 25447
109 1 . 1 1 23 23 ASP CA C 23 54.336 54.336 53.969 0.367 25447
110 1 . 1 1 23 23 ASP CB C 23 41.353 41.353 40.795 0.558 25447
111 1 . 1 1 23 23 ASP H H 23 8.003 8.003 8.111 -0.108 25447
112 1 . 1 1 24 24 VAL N N 24 121.517 121.517 120.837 0.680 25447
113 1 . 1 1 24 24 VAL HA H 24 3.821 3.821 4.160 -0.339 25447
114 1 . 1 1 24 24 VAL CA C 24 62.345 62.345 61.480 0.865 25447
115 1 . 1 1 24 24 VAL CB C 24 31.733 31.733 33.046 -1.313 25447
116 1 . 1 1 24 24 VAL H H 24 7.069 7.069 7.478 -0.409 25447
117 1 . 1 1 25 25 ASP N N 25 129.329 129.329 126.938 2.391 25447
118 1 . 1 1 25 25 ASP HA H 25 4.574 4.574 4.786 -0.212 25447
119 1 . 1 1 25 25 ASP CA C 25 54.566 54.566 53.180 1.386 25447
120 1 . 1 1 25 25 ASP CB C 25 42.333 42.333 41.865 0.468 25447
121 1 . 1 1 25 25 ASP H H 25 8.474 8.474 8.688 -0.214 25447
122 1 . 1 1 26 26 VAL N N 26 121.920 121.920 121.892 0.028 25447
123 1 . 1 1 26 26 VAL HA H 26 4.108 4.108 4.025 0.083 25447
124 1 . 1 1 26 26 VAL CA C 26 64.518 64.518 63.271 1.247 25447
125 1 . 1 1 26 26 VAL CB C 26 31.198 31.198 31.767 -0.569 25447
126 1 . 1 1 26 26 VAL H H 26 8.591 8.591 8.641 -0.050 25447
127 1 . 1 1 27 27 ASP N N 27 116.286 116.286 118.718 -2.432 25447
128 1 . 1 1 27 27 ASP HA H 27 5.145 5.145 4.666 0.479 25447
129 1 . 1 1 27 27 ASP CA C 27 54.181 54.181 54.788 -0.607 25447
130 1 . 1 1 27 27 ASP CB C 27 42.575 42.575 41.019 1.556 25447
131 1 . 1 1 27 27 ASP H H 27 8.609 8.609 8.129 0.480 25447
132 1 . 1 1 28 28 LEU N N 28 125.116 125.116 122.144 2.972 25447
133 1 . 1 1 28 28 LEU HA H 28 4.011 4.011 4.487 -0.476 25447
134 1 . 1 1 28 28 LEU CA C 28 56.087 56.087 54.325 1.762 25447
135 1 . 1 1 28 28 LEU CB C 28 43.321 43.321 43.950 -0.629 25447
136 1 . 1 1 28 28 LEU H H 28 7.374 7.374 7.374 -0.000 25447
137 1 . 1 1 29 29 ASP N N 29 125.924 125.924 124.656 1.268 25447
138 1 . 1 1 29 29 ASP HA H 29 4.834 4.834 4.635 0.199 25447
139 1 . 1 1 29 29 ASP CA C 29 53.920 53.920 54.933 -1.013 25447
140 1 . 1 1 29 29 ASP CB C 29 41.379 41.379 41.351 0.028 25447
141 1 . 1 1 29 29 ASP H H 29 8.699 8.699 8.608 0.091 25447
142 1 . 1 1 30 30 LEU N N 30 129.975 129.975 125.123 4.852 25447
143 1 . 1 1 30 30 LEU HA H 30 3.917 3.917 4.134 -0.217 25447
144 1 . 1 1 30 30 LEU CA C 30 56.388 56.388 57.387 -0.999 25447
145 1 . 1 1 30 30 LEU CB C 30 42.239 42.239 42.397 -0.158 25447
146 1 . 1 1 30 30 LEU H H 30 9.718 9.718 8.260 1.458 25447
147 1 . 1 1 31 31 VAL N N 31 121.212 121.212 117.422 3.790 25447
148 1 . 1 1 31 31 VAL HA H 31 4.193 4.193 3.619 0.574 25447
149 1 . 1 1 31 31 VAL CA C 31 64.433 64.433 66.318 -1.885 25447
150 1 . 1 1 31 31 VAL CB C 31 32.175 32.175 31.324 0.851 25447
151 1 . 1 1 31 31 VAL H H 31 8.163 8.163 7.579 0.584 25447
152 1 . 1 1 32 32 ASP N N 32 124.893 124.893 118.941 5.952 25447
153 1 . 1 1 32 32 ASP HA H 32 4.358 4.358 4.337 0.022 25447
154 1 . 1 1 32 32 ASP CA C 32 57.225 57.225 56.712 0.513 25447
155 1 . 1 1 32 32 ASP CB C 32 40.735 40.735 40.191 0.544 25447
156 1 . 1 1 32 32 ASP H H 32 9.385 9.385 8.710 0.675 25447
157 1 . 1 1 33 33 ASN N N 33 111.484 111.484 116.378 -4.894 25447
158 1 . 1 1 33 33 ASN HA H 33 4.720 4.720 4.579 0.141 25447
159 1 . 1 1 33 33 ASN CA C 33 53.886 53.886 53.721 0.165 25447
160 1 . 1 1 33 33 ASN CB C 33 39.006 39.006 39.076 -0.070 25447
161 1 . 1 1 33 33 ASN H H 33 7.396 7.396 7.603 -0.207 25447
162 1 . 1 1 34 34 GLY N N 34 106.957 106.957 106.129 0.828 25447
163 1 . 1 1 34 34 GLY CA C 34 46.607 46.607 45.689 0.918 25447
164 1 . 1 1 34 34 GLY H H 34 7.618 7.618 7.950 -0.332 25447
165 1 . 1 1 35 35 VAL N N 35 120.424 120.424 118.694 1.730 25447
166 1 . 1 1 35 35 VAL HA H 35 3.766 3.766 3.456 0.310 25447
167 1 . 1 1 35 35 VAL CA C 35 65.125 65.125 64.722 0.403 25447
168 1 . 1 1 35 35 VAL CB C 35 31.879 31.879 31.901 -0.022 25447
169 1 . 1 1 35 35 VAL H H 35 7.792 7.792 7.724 0.069 25447
170 1 . 1 1 36 36 ILE N N 36 116.364 116.364 119.792 -3.428 25447
171 1 . 1 1 36 36 ILE HA H 36 3.737 3.737 3.905 -0.168 25447
172 1 . 1 1 36 36 ILE CA C 36 60.685 60.685 61.552 -0.867 25447
173 1 . 1 1 36 36 ILE CB C 36 38.807 38.807 37.743 1.064 25447
174 1 . 1 1 36 36 ILE H H 36 7.331 7.331 7.768 -0.437 25447
175 1 . 1 1 37 37 ASP N N 37 127.306 127.306 127.211 0.095 25447
176 1 . 1 1 37 37 ASP HA H 37 4.664 4.664 4.725 -0.061 25447
177 1 . 1 1 37 37 ASP CA C 37 51.616 51.616 52.800 -1.184 25447
178 1 . 1 1 37 37 ASP CB C 37 41.209 41.209 43.071 -1.862 25447
179 1 . 1 1 37 37 ASP H H 37 7.874 7.874 7.978 -0.104 25447
180 1 . 1 1 38 38 ALA N N 38 120.352 120.352 122.908 -2.556 25447
181 1 . 1 1 38 38 ALA HA H 38 3.995 3.995 4.101 -0.106 25447
182 1 . 1 1 38 38 ALA CA C 38 56.292 56.292 55.339 0.953 25447
183 1 . 1 1 38 38 ALA CB C 38 18.312 18.312 18.575 -0.263 25447
184 1 . 1 1 38 38 ALA H H 38 8.244 8.244 8.341 -0.097 25447
185 1 . 1 1 39 39 LEU N N 39 117.438 117.438 118.818 -1.380 25447
186 1 . 1 1 39 39 LEU HA H 39 4.250 4.250 4.207 0.043 25447
187 1 . 1 1 39 39 LEU CA C 39 57.355 57.355 57.283 0.072 25447
188 1 . 1 1 39 39 LEU CB C 39 41.236 41.236 41.050 0.186 25447
189 1 . 1 1 39 39 LEU H H 39 7.688 7.688 8.392 -0.704 25447
190 1 . 1 1 40 40 GLY N N 40 112.015 112.015 107.669 4.346 25447
191 1 . 1 1 40 40 GLY CA C 40 48.099 48.099 47.209 0.890 25447
192 1 . 1 1 40 40 GLY H H 40 8.732 8.732 8.285 0.447 25447
193 1 . 1 1 41 41 LEU N N 41 122.983 122.983 123.224 -0.241 25447
194 1 . 1 1 41 41 LEU HA H 41 3.851 3.851 3.976 -0.125 25447
195 1 . 1 1 41 41 LEU CA C 41 58.332 58.332 57.539 0.793 25447
196 1 . 1 1 41 41 LEU CB C 41 41.639 41.639 41.892 -0.253 25447
197 1 . 1 1 41 41 LEU H H 41 8.548 8.548 8.240 0.308 25447
198 1 . 1 1 42 42 LEU N N 42 116.076 116.076 120.002 -3.926 25447
199 1 . 1 1 42 42 LEU HA H 42 4.028 4.028 3.890 0.138 25447
200 1 . 1 1 42 42 LEU CA C 42 58.064 58.064 58.409 -0.345 25447
201 1 . 1 1 42 42 LEU CB C 42 40.940 40.940 41.737 -0.797 25447
202 1 . 1 1 42 42 LEU H H 42 7.168 7.168 7.641 -0.473 25447
203 1 . 1 1 43 43 LYS N N 43 119.831 119.831 119.002 0.829 25447
204 1 . 1 1 43 43 LYS HA H 43 4.284 4.284 4.040 0.244 25447
205 1 . 1 1 43 43 LYS CA C 43 59.644 59.644 59.980 -0.336 25447
206 1 . 1 1 43 43 LYS CB C 43 32.527 32.527 32.316 0.211 25447
207 1 . 1 1 43 43 LYS H H 43 7.640 7.640 8.284 -0.644 25447
208 1 . 1 1 44 44 VAL N N 44 121.046 121.046 120.391 0.655 25447
209 1 . 1 1 44 44 VAL HA H 44 3.949 3.949 4.020 -0.071 25447
210 1 . 1 1 44 44 VAL CB C 44 31.643 31.643 31.716 -0.073 25447
211 1 . 1 1 44 44 VAL H H 44 8.269 8.269 7.828 0.441 25447
212 1 . 1 1 45 45 ILE N N 45 119.333 119.333 119.731 -0.398 25447
213 1 . 1 1 45 45 ILE HA H 45 3.404 3.404 3.658 -0.254 25447
214 1 . 1 1 45 45 ILE CA C 45 66.148 66.148 64.150 1.998 25447
215 1 . 1 1 45 45 ILE CB C 45 38.277 38.277 37.115 1.162 25447
216 1 . 1 1 45 45 ILE H H 45 8.145 8.145 7.756 0.389 25447
217 1 . 1 1 46 46 ALA N N 46 121.213 121.213 123.384 -2.171 25447
218 1 . 1 1 46 46 ALA HA H 46 4.257 4.257 4.222 0.035 25447
219 1 . 1 1 46 46 ALA CA C 46 55.164 55.164 55.101 0.063 25447
220 1 . 1 1 46 46 ALA CB C 46 18.368 18.368 18.489 -0.121 25447
221 1 . 1 1 46 46 ALA H H 46 7.792 7.792 8.062 -0.271 25447
222 1 . 1 1 47 47 TRP N N 47 121.416 121.416 120.149 1.267 25447
223 1 . 1 1 47 47 TRP HA H 47 4.234 4.234 4.462 -0.228 25447
224 1 . 1 1 47 47 TRP CA C 47 61.670 61.670 59.701 1.969 25447
225 1 . 1 1 47 47 TRP CB C 47 28.239 28.239 29.443 -1.204 25447
226 1 . 1 1 47 47 TRP H H 47 8.093 8.093 8.002 0.091 25447
227 1 . 1 1 48 48 LEU N N 48 118.963 118.963 121.035 -2.072 25447
228 1 . 1 1 48 48 LEU HA H 48 3.586 3.586 2.852 0.734 25447
229 1 . 1 1 48 48 LEU CA C 48 58.195 58.195 57.627 0.568 25447
230 1 . 1 1 48 48 LEU CB C 48 42.251 42.251 41.117 1.134 25447
231 1 . 1 1 48 48 LEU H H 48 8.693 8.693 7.396 1.297 25447
232 1 . 1 1 49 49 GLU N N 49 119.131 119.131 117.412 1.719 25447
233 1 . 1 1 49 49 GLU HA H 49 4.050 4.050 3.983 0.067 25447
234 1 . 1 1 49 49 GLU CA C 49 59.862 59.862 59.005 0.857 25447
235 1 . 1 1 49 49 GLU CB C 49 29.586 29.586 28.844 0.742 25447
236 1 . 1 1 49 49 GLU H H 49 7.771 7.771 7.757 0.014 25447
237 1 . 1 1 50 50 ASP N N 50 119.941 119.941 120.564 -0.623 25447
238 1 . 1 1 50 50 ASP HA H 50 4.237 4.237 4.427 -0.190 25447
239 1 . 1 1 50 50 ASP CA C 50 57.355 57.355 56.572 0.783 25447
240 1 . 1 1 50 50 ASP CB C 50 42.383 42.383 40.822 1.561 25447
241 1 . 1 1 50 50 ASP H H 50 7.697 7.697 7.643 0.054 25447
242 1 . 1 1 51 51 ARG N N 51 116.911 116.911 118.068 -1.157 25447
243 1 . 1 1 51 51 ARG HA H 51 3.736 3.736 4.047 -0.311 25447
244 1 . 1 1 51 51 ARG CA C 51 56.364 56.364 58.377 -2.013 25447
245 1 . 1 1 51 51 ARG CB C 51 29.315 29.315 30.213 -0.898 25447
246 1 . 1 1 51 51 ARG H H 51 8.881 8.881 7.869 1.012 25447
247 1 . 1 1 52 52 PHE N N 52 112.328 112.328 116.516 -4.188 25447
248 1 . 1 1 52 52 PHE HA H 52 4.675 4.675 4.628 0.047 25447
249 1 . 1 1 52 52 PHE CA C 52 57.413 57.413 58.039 -0.626 25447
250 1 . 1 1 52 52 PHE CB C 52 40.892 40.892 39.374 1.518 25447
251 1 . 1 1 52 52 PHE H H 52 7.284 7.284 7.608 -0.324 25447
252 1 . 1 1 53 53 GLY N N 53 109.826 109.826 108.869 0.957 25447
253 1 . 1 1 53 53 GLY CA C 53 46.801 46.801 45.581 1.220 25447
254 1 . 1 1 53 53 GLY H H 53 7.427 7.427 7.944 -0.517 25447
255 1 . 1 1 54 54 ILE N N 54 119.127 119.127 115.187 3.940 25447
256 1 . 1 1 54 54 ILE HA H 54 3.951 3.951 4.501 -0.550 25447
257 1 . 1 1 54 54 ILE CA C 54 60.685 60.685 59.433 1.252 25447
258 1 . 1 1 54 54 ILE CB C 54 39.490 39.490 39.623 -0.133 25447
259 1 . 1 1 54 54 ILE H H 54 6.876 6.876 7.564 -0.688 25447
260 1 . 1 1 55 55 ALA N N 55 129.823 129.823 124.860 4.963 25447
261 1 . 1 1 55 55 ALA HA H 55 4.414 4.414 4.556 -0.142 25447
262 1 . 1 1 55 55 ALA CA C 55 51.610 51.610 50.756 0.854 25447
263 1 . 1 1 55 55 ALA CB C 55 19.262 19.262 20.160 -0.898 25447
264 1 . 1 1 55 55 ALA H H 55 8.499 8.499 8.346 0.153 25447
265 1 . 1 1 56 56 ALA N N 56 126.300 126.300 125.792 0.508 25447
266 1 . 1 1 56 56 ALA HA H 56 4.269 4.269 4.085 0.184 25447
267 1 . 1 1 56 56 ALA CA C 56 53.474 53.474 54.384 -0.910 25447
268 1 . 1 1 56 56 ALA CB C 56 19.244 19.244 18.653 0.591 25447
269 1 . 1 1 56 56 ALA H H 56 8.641 8.641 8.747 -0.106 25447
270 1 . 1 1 57 57 ASP N N 57 116.395 116.395 117.178 -0.783 25447
271 1 . 1 1 57 57 ASP HA H 57 4.479 4.479 4.371 0.108 25447
272 1 . 1 1 57 57 ASP CA C 57 55.226 55.226 56.064 -0.838 25447
273 1 . 1 1 57 57 ASP CB C 57 40.922 40.922 40.123 0.799 25447
274 1 . 1 1 57 57 ASP H H 57 8.337 8.337 8.432 -0.095 25447
275 1 . 1 1 58 58 ASP N N 58 118.557 118.557 118.308 0.249 25447
276 1 . 1 1 58 58 ASP HA H 58 4.636 4.636 4.421 0.215 25447
277 1 . 1 1 58 58 ASP CA C 58 55.144 55.144 55.750 -0.606 25447
278 1 . 1 1 58 58 ASP CB C 58 41.504 41.504 41.108 0.396 25447
279 1 . 1 1 58 58 ASP H H 58 8.027 8.027 7.993 0.034 25447
280 1 . 1 1 59 59 VAL N N 59 118.898 118.898 117.980 0.918 25447
281 1 . 1 1 59 59 VAL HA H 59 4.176 4.176 4.273 -0.097 25447
282 1 . 1 1 59 59 VAL CA C 59 62.300 62.300 60.970 1.330 25447
283 1 . 1 1 59 59 VAL CB C 59 33.078 33.078 34.651 -1.573 25447
284 1 . 1 1 59 59 VAL H H 59 7.716 7.716 7.459 0.257 25447
285 1 . 1 1 60 60 GLU N N 60 122.888 122.888 125.785 -2.897 25447
286 1 . 1 1 60 60 GLU HA H 60 4.284 4.284 4.462 -0.178 25447
287 1 . 1 1 60 60 GLU CA C 60 56.546 56.546 55.819 0.727 25447
288 1 . 1 1 60 60 GLU CB C 60 29.782 29.782 30.651 -0.869 25447
289 1 . 1 1 60 60 GLU H H 60 8.367 8.367 8.399 -0.033 25447
290 1 . 1 1 61 61 LEU N N 61 124.827 124.827 125.048 -0.221 25447
291 1 . 1 1 61 61 LEU HA H 61 4.358 4.358 4.500 -0.142 25447
292 1 . 1 1 61 61 LEU CA C 61 54.816 54.816 54.231 0.585 25447
293 1 . 1 1 61 61 LEU CB C 61 41.937 41.937 42.943 -1.006 25447
294 1 . 1 1 61 61 LEU H H 61 8.198 8.198 8.458 -0.260 25447
295 1 . 1 1 62 62 SER N N 62 118.715 118.715 118.755 -0.040 25447
296 1 . 1 1 62 62 SER HA H 62 4.809 4.809 4.950 -0.141 25447
297 1 . 1 1 62 62 SER CA C 62 55.732 55.732 55.409 0.323 25447
298 1 . 1 1 62 62 SER CB C 62 64.017 64.017 64.727 -0.710 25447
299 1 . 1 1 62 62 SER H H 62 8.137 8.137 8.245 -0.108 25447
300 1 . 1 1 63 63 PRO HA H 63 4.253 4.253 4.260 -0.007 25447
301 1 . 1 1 63 63 PRO CA C 63 64.896 64.896 65.103 -0.207 25447
302 1 . 1 1 63 63 PRO CB C 63 32.052 32.052 31.789 0.263 25447
303 1 . 1 1 64 64 GLU N N 64 116.554 116.554 118.948 -2.394 25447
304 1 . 1 1 64 64 GLU HA H 64 3.873 3.873 4.138 -0.265 25447
305 1 . 1 1 64 64 GLU CA C 64 58.719 58.719 58.948 -0.229 25447
306 1 . 1 1 64 64 GLU CB C 64 28.681 28.681 29.200 -0.519 25447
307 1 . 1 1 64 64 GLU H H 64 8.316 8.316 8.571 -0.255 25447
308 1 . 1 1 65 65 HIS N N 65 115.487 115.487 119.617 -4.130 25447
309 1 . 1 1 65 65 HIS HA H 65 4.280 4.280 4.236 0.044 25447
310 1 . 1 1 65 65 HIS CA C 65 57.652 57.652 58.174 -0.522 25447
311 1 . 1 1 65 65 HIS CB C 65 29.882 29.882 29.526 0.356 25447
312 1 . 1 1 65 65 HIS H H 65 7.274 7.274 8.253 -0.980 25447
313 1 . 1 1 66 66 PHE N N 66 116.127 116.127 116.405 -0.278 25447
314 1 . 1 1 66 66 PHE HA H 66 4.766 4.766 4.536 0.230 25447
315 1 . 1 1 66 66 PHE CA C 66 55.782 55.782 57.599 -1.817 25447
316 1 . 1 1 66 66 PHE CB C 66 38.908 38.908 37.720 1.188 25447
317 1 . 1 1 66 66 PHE H H 66 7.239 7.239 7.732 -0.493 25447
318 1 . 1 1 67 67 ARG N N 67 112.468 112.468 119.511 -7.043 25447
319 1 . 1 1 67 67 ARG HA H 67 4.085 4.085 3.980 0.105 25447
320 1 . 1 1 67 67 ARG CA C 67 58.287 58.287 59.038 -0.751 25447
321 1 . 1 1 67 67 ARG CB C 67 31.760 31.760 30.450 1.310 25447
322 1 . 1 1 67 67 ARG H H 67 6.628 6.628 7.854 -1.226 25447
323 1 . 1 1 68 68 SER N N 68 109.305 109.305 110.602 -1.297 25447
324 1 . 1 1 68 68 SER HA H 68 4.980 4.980 4.780 0.200 25447
325 1 . 1 1 68 68 SER CA C 68 55.785 55.785 56.679 -0.894 25447
326 1 . 1 1 68 68 SER CB C 68 67.691 67.691 65.825 1.866 25447
327 1 . 1 1 68 68 SER H H 68 8.145 8.145 7.410 0.735 25447
328 1 . 1 1 69 69 ILE N N 69 122.602 122.602 123.548 -0.946 25447
329 1 . 1 1 69 69 ILE HA H 69 3.676 3.676 3.763 -0.087 25447
330 1 . 1 1 69 69 ILE CA C 69 66.754 66.754 65.149 1.605 25447
331 1 . 1 1 69 69 ILE CB C 69 37.296 37.296 37.472 -0.176 25447
332 1 . 1 1 69 69 ILE H H 69 9.775 9.775 9.118 0.657 25447
333 1 . 1 1 70 70 ARG N N 70 118.764 118.764 119.051 -0.287 25447
334 1 . 1 1 70 70 ARG HA H 70 3.955 3.955 3.979 -0.024 25447
335 1 . 1 1 70 70 ARG CA C 70 60.533 60.533 59.728 0.805 25447
336 1 . 1 1 70 70 ARG CB C 70 30.418 30.418 29.461 0.957 25447
337 1 . 1 1 70 70 ARG H H 70 8.910 8.910 8.100 0.810 25447
338 1 . 1 1 71 71 SER N N 71 117.670 117.670 115.448 2.222 25447
339 1 . 1 1 71 71 SER HA H 71 4.330 4.330 4.248 0.082 25447
340 1 . 1 1 71 71 SER CA C 71 62.287 62.287 61.343 0.944 25447
341 1 . 1 1 71 71 SER CB C 71 63.278 63.278 62.634 0.644 25447
342 1 . 1 1 71 71 SER H H 71 8.518 8.518 7.581 0.936 25447
343 1 . 1 1 72 72 ILE N N 72 127.447 127.447 123.442 4.005 25447
344 1 . 1 1 72 72 ILE HA H 72 3.910 3.910 3.596 0.314 25447
345 1 . 1 1 72 72 ILE CA C 72 66.811 66.811 65.308 1.503 25447
346 1 . 1 1 72 72 ILE CB C 72 38.398 38.398 37.541 0.857 25447
347 1 . 1 1 72 72 ILE H H 72 8.762 8.762 7.550 1.212 25447
348 1 . 1 1 73 73 ASP N N 73 121.636 121.636 120.114 1.522 25447
349 1 . 1 1 73 73 ASP HA H 73 4.013 4.013 4.346 -0.333 25447
350 1 . 1 1 73 73 ASP CA C 73 59.148 59.148 57.343 1.805 25447
351 1 . 1 1 73 73 ASP CB C 73 43.540 43.540 40.564 2.976 25447
352 1 . 1 1 73 73 ASP H H 73 8.677 8.677 8.095 0.582 25447
353 1 . 1 1 74 74 ALA N N 74 118.793 118.793 122.117 -3.324 25447
354 1 . 1 1 74 74 ALA HA H 74 4.044 4.044 4.033 0.011 25447
355 1 . 1 1 74 74 ALA CA C 74 55.321 55.321 55.087 0.234 25447
356 1 . 1 1 74 74 ALA CB C 74 17.945 17.945 18.451 -0.506 25447
357 1 . 1 1 74 74 ALA H H 74 8.005 8.005 7.788 0.217 25447
358 1 . 1 1 75 75 PHE N N 75 121.235 121.235 119.924 1.311 25447
359 1 . 1 1 75 75 PHE HA H 75 4.038 4.038 4.027 0.011 25447
360 1 . 1 1 75 75 PHE CA C 75 61.015 61.015 61.863 -0.847 25447
361 1 . 1 1 75 75 PHE CB C 75 38.837 38.837 39.338 -0.501 25447
362 1 . 1 1 75 75 PHE H H 75 8.353 8.353 8.459 -0.106 25447
363 1 . 1 1 76 76 VAL N N 76 120.866 120.866 118.939 1.927 25447
364 1 . 1 1 76 76 VAL HA H 76 2.943 2.943 3.356 -0.413 25447
365 1 . 1 1 76 76 VAL CA C 76 66.901 66.901 66.858 0.043 25447
366 1 . 1 1 76 76 VAL CB C 76 31.247 31.247 31.284 -0.037 25447
367 1 . 1 1 76 76 VAL H H 76 8.544 8.544 8.189 0.355 25447
368 1 . 1 1 77 77 VAL N N 77 121.408 121.408 119.732 1.676 25447
369 1 . 1 1 77 77 VAL HA H 77 3.495 3.495 3.722 -0.227 25447
370 1 . 1 1 77 77 VAL CA C 77 66.833 66.833 66.081 0.752 25447
371 1 . 1 1 77 77 VAL CB C 77 31.930 31.930 31.220 0.710 25447
372 1 . 1 1 77 77 VAL H H 77 8.708 8.708 8.205 0.503 25447
373 1 . 1 1 78 78 GLY N N 78 106.402 106.402 106.957 -0.555 25447
374 1 . 1 1 78 78 GLY CA C 78 46.840 46.840 46.950 -0.110 25447
375 1 . 1 1 78 78 GLY H H 78 7.945 7.945 8.525 -0.580 25447
376 1 . 1 1 79 79 ALA N N 79 121.146 121.146 122.496 -1.350 25447
377 1 . 1 1 79 79 ALA HA H 79 4.207 4.207 3.942 0.265 25447
378 1 . 1 1 79 79 ALA CA C 79 52.929 52.929 54.260 -1.331 25447
379 1 . 1 1 79 79 ALA CB C 79 19.261 19.261 18.342 0.918 25447
380 1 . 1 1 79 79 ALA H H 79 7.639 7.639 7.504 0.135 25447
381 1 . 1 1 80 80 THR N N 80 107.668 107.668 109.297 -1.629 25447
382 1 . 1 1 80 80 THR HA H 80 4.443 4.443 4.272 0.171 25447
383 1 . 1 1 80 80 THR CA C 80 61.406 61.406 63.027 -1.621 25447
384 1 . 1 1 80 80 THR CB C 80 70.767 70.767 69.750 1.017 25447
385 1 . 1 1 80 80 THR H H 80 7.449 7.449 7.695 -0.246 25447
386 1 . 1 1 81 81 THR N N 81 119.953 119.953 116.582 3.371 25447
387 1 . 1 1 81 81 THR HA H 81 4.665 4.665 4.814 -0.149 25447
388 1 . 1 1 81 81 THR CA C 81 60.412 60.412 59.053 1.359 25447
389 1 . 1 1 81 81 THR CB C 81 70.113 70.113 69.707 0.406 25447
390 1 . 1 1 81 81 THR H H 81 7.685 7.685 7.920 -0.235 25447
391 1 . 1 1 82 82 PRO HA H 82 4.689 4.689 4.518 0.171 25447
392 1 . 1 1 82 82 PRO CA C 82 61.688 61.688 62.187 -0.499 25447
393 1 . 1 1 82 82 PRO CB C 82 30.969 30.969 30.818 0.151 25447
394 1 . 1 1 83 83 PRO HA H 83 4.481 4.481 4.410 0.071 25447
395 1 . 1 1 83 83 PRO CA C 83 62.931 62.931 62.489 0.442 25447
396 1 . 1 1 83 83 PRO CB C 83 32.193 32.193 32.471 -0.278 25447
397 1 . 1 1 84 84 VAL N N 84 120.691 120.691 120.904 -0.213 25447
398 1 . 1 1 84 84 VAL HA H 84 4.093 4.093 4.192 -0.099 25447
399 1 . 1 1 84 84 VAL CA C 84 62.339 62.339 61.498 0.841 25447
400 1 . 1 1 84 84 VAL CB C 84 32.851 32.851 32.934 -0.083 25447
401 1 . 1 1 84 84 VAL H H 84 8.257 8.257 8.100 0.157 25447
402 1 . 1 1 85 85 GLU N N 85 127.655 127.655 123.413 4.242 25447
403 1 . 1 1 85 85 GLU HA H 85 4.284 4.284 3.879 0.405 25447
404 1 . 1 1 85 85 GLU CA C 85 56.754 56.754 56.496 0.258 25447
405 1 . 1 1 85 85 GLU CB C 85 30.559 30.559 28.422 2.137 25447
406 1 . 1 1 85 85 GLU H H 85 8.202 8.202 8.720 -0.518 25447
407 1 . 1 1 86 86 ALA N N 86 126.437 126.437 121.392 5.045 25447
408 1 . 1 1 86 86 ALA HA H 86 4.051 4.051 4.131 -0.080 25447
409 1 . 1 1 86 86 ALA CA C 86 52.148 52.148 52.592 -0.444 25447
410 1 . 1 1 86 86 ALA CB C 86 19.460 19.460 19.493 -0.033 25447
411 1 . 1 1 86 86 ALA H H 86 8.323 8.323 8.051 0.272 25447
412 1 . 1 1 87 87 LYS N N 87 121.796 121.796 121.202 0.594 25447
413 1 . 1 1 87 87 LYS HA H 87 4.347 4.347 4.061 0.286 25447
414 1 . 1 1 87 87 LYS CA C 87 56.297 56.297 57.647 -1.350 25447
415 1 . 1 1 87 87 LYS CB C 87 33.276 33.276 32.590 0.686 25447
416 1 . 1 1 87 87 LYS H H 87 8.333 8.333 8.456 -0.123 25447
417 1 . 1 1 88 88 LEU N N 88 125.576 125.576 120.368 5.208 25447
418 1 . 1 1 88 88 LEU HA H 88 3.907 3.907 4.309 -0.402 25447
419 1 . 1 1 88 88 LEU CA C 88 55.772 55.772 55.121 0.651 25447
420 1 . 1 1 88 88 LEU CB C 88 42.472 42.472 42.080 0.392 25447
421 1 . 1 1 88 88 LEU H H 88 8.444 8.444 7.894 0.550 25447
stop_
save_