data_25068
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25068
_Entry.PDB_ID 2MRC
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 25068
_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 14 14 PRO HA H 14 4.322 4.322 4.354 -0.032 25068
2 1 1 . 1 1 14 14 PRO C C 14 176.783 176.783 176.549 0.234 25068
3 1 1 . 1 1 14 14 PRO CA C 14 64.643 64.643 63.714 0.929 25068
4 1 1 . 1 1 14 14 PRO CB C 14 33.114 33.114 32.144 0.970 25068
5 1 1 . 1 1 15 15 LEU N N 15 120.158 120.158 120.514 -0.356 25068
6 1 1 . 1 1 15 15 LEU HA H 15 4.238 4.238 4.526 -0.288 25068
7 1 1 . 1 1 15 15 LEU C C 15 176.361 176.361 176.005 0.356 25068
8 1 1 . 1 1 15 15 LEU CA C 15 55.395 55.395 53.939 1.456 25068
9 1 1 . 1 1 15 15 LEU CB C 15 42.619 42.619 41.481 1.138 25068
10 1 1 . 1 1 15 15 LEU H H 15 8.189 8.189 7.570 0.619 25068
11 1 1 . 1 1 16 16 ALA N N 16 124.269 124.269 122.154 2.115 25068
12 1 1 . 1 1 16 16 ALA HA H 16 3.496 3.496 4.904 -1.408 25068
13 1 1 . 1 1 16 16 ALA C C 16 175.124 175.124 175.027 0.097 25068
14 1 1 . 1 1 16 16 ALA CA C 16 51.457 51.457 49.762 1.695 25068
15 1 1 . 1 1 16 16 ALA CB C 16 18.105 18.105 19.720 -1.615 25068
16 1 1 . 1 1 16 16 ALA H H 16 7.500 7.500 7.278 0.222 25068
17 1 1 . 1 1 17 17 PRO HA H 17 4.157 4.157 4.525 -0.368 25068
18 1 1 . 1 1 17 17 PRO C C 17 176.396 176.396 175.909 0.487 25068
19 1 1 . 1 1 17 17 PRO CA C 17 63.588 63.588 62.270 1.318 25068
20 1 1 . 1 1 17 17 PRO CB C 17 32.850 32.850 32.416 0.434 25068
21 1 1 . 1 1 18 18 LYS N N 18 124.070 124.070 121.427 2.643 25068
22 1 1 . 1 1 18 18 LYS HA H 18 4.147 4.147 4.189 -0.042 25068
23 1 1 . 1 1 18 18 LYS C C 18 177.543 177.543 176.297 1.246 25068
24 1 1 . 1 1 18 18 LYS CA C 18 57.081 57.081 56.927 0.154 25068
25 1 1 . 1 1 18 18 LYS CB C 18 33.573 33.573 32.579 0.994 25068
26 1 1 . 1 1 18 18 LYS H H 18 8.886 8.886 8.304 0.582 25068
27 1 1 . 1 1 19 19 ARG N N 19 122.242 122.242 121.671 0.571 25068
28 1 1 . 1 1 19 19 ARG HA H 19 3.437 3.437 4.487 -1.050 25068
29 1 1 . 1 1 19 19 ARG C C 19 175.409 175.409 174.395 1.014 25068
30 1 1 . 1 1 19 19 ARG CA C 19 57.545 57.545 55.702 1.843 25068
31 1 1 . 1 1 19 19 ARG CB C 19 31.149 31.149 30.506 0.643 25068
32 1 1 . 1 1 19 19 ARG H H 19 8.286 8.286 8.319 -0.033 25068
33 1 1 . 1 1 20 20 ALA N N 20 123.176 123.176 123.962 -0.786 25068
34 1 1 . 1 1 20 20 ALA HA H 20 4.139 4.139 4.574 -0.435 25068
35 1 1 . 1 1 20 20 ALA C C 20 177.843 177.843 176.824 1.019 25068
36 1 1 . 1 1 20 20 ALA CA C 20 52.391 52.391 51.299 1.092 25068
37 1 1 . 1 1 20 20 ALA CB C 20 19.397 19.397 20.151 -0.754 25068
38 1 1 . 1 1 20 20 ALA H H 20 7.348 7.348 8.286 -0.938 25068
39 1 1 . 1 1 21 21 LEU N N 21 125.680 125.680 121.099 4.581 25068
40 1 1 . 1 1 21 21 LEU HA H 21 4.194 4.194 3.979 0.215 25068
41 1 1 . 1 1 21 21 LEU C C 21 177.091 177.091 176.494 0.597 25068
42 1 1 . 1 1 21 21 LEU CA C 21 55.472 55.472 54.589 0.883 25068
43 1 1 . 1 1 21 21 LEU CB C 21 43.931 43.931 42.449 1.482 25068
44 1 1 . 1 1 21 21 LEU H H 21 9.055 9.055 8.187 0.868 25068
45 1 1 . 1 1 22 22 SER N N 22 116.686 116.686 113.466 3.220 25068
46 1 1 . 1 1 22 22 SER HA H 22 4.427 4.427 4.811 -0.384 25068
47 1 1 . 1 1 22 22 SER C C 22 174.241 174.241 175.870 -1.629 25068
48 1 1 . 1 1 22 22 SER CA C 22 57.564 57.564 56.306 1.258 25068
49 1 1 . 1 1 22 22 SER CB C 22 66.568 66.568 65.487 1.081 25068
50 1 1 . 1 1 22 22 SER H H 22 7.549 7.549 7.800 -0.251 25068
51 1 1 . 1 1 23 23 ALA N N 23 123.382 123.382 126.477 -3.095 25068
52 1 1 . 1 1 23 23 ALA HA H 23 4.163 4.163 4.245 -0.082 25068
53 1 1 . 1 1 23 23 ALA C C 23 178.863 178.863 178.863 0.000 25068
54 1 1 . 1 1 23 23 ALA CA C 23 57.124 57.124 55.293 1.831 25068
55 1 1 . 1 1 23 23 ALA CB C 23 19.441 19.441 18.390 1.051 25068
56 1 1 . 1 1 23 23 ALA H H 23 9.035 9.035 8.937 0.098 25068
57 1 1 . 1 1 24 24 TYR N N 24 115.979 115.979 120.079 -4.100 25068
58 1 1 . 1 1 24 24 TYR HA H 24 2.590 2.590 4.217 -1.627 25068
59 1 1 . 1 1 24 24 TYR C C 24 176.257 176.257 177.628 -1.371 25068
60 1 1 . 1 1 24 24 TYR CA C 24 60.940 60.940 61.378 -0.438 25068
61 1 1 . 1 1 24 24 TYR CB C 24 39.106 39.106 38.067 1.039 25068
62 1 1 . 1 1 24 24 TYR H H 24 8.206 8.206 7.987 0.219 25068
63 1 1 . 1 1 25 25 MET N N 25 116.391 116.391 117.517 -1.126 25068
64 1 1 . 1 1 25 25 MET HA H 25 3.643 3.643 3.876 -0.233 25068
65 1 1 . 1 1 25 25 MET C C 25 180.177 180.177 178.473 1.704 25068
66 1 1 . 1 1 25 25 MET CA C 25 59.161 59.161 59.645 -0.484 25068
67 1 1 . 1 1 25 25 MET CB C 25 32.748 32.748 32.419 0.329 25068
68 1 1 . 1 1 25 25 MET H H 25 7.433 7.433 7.587 -0.154 25068
69 1 1 . 1 1 26 26 PHE N N 26 118.699 118.699 119.575 -0.876 25068
70 1 1 . 1 1 26 26 PHE HA H 26 4.063 4.063 4.130 -0.067 25068
71 1 1 . 1 1 26 26 PHE C C 26 178.055 178.055 178.208 -0.153 25068
72 1 1 . 1 1 26 26 PHE CA C 26 64.840 64.840 61.908 2.932 25068
73 1 1 . 1 1 26 26 PHE CB C 26 40.437 40.437 38.117 2.320 25068
74 1 1 . 1 1 26 26 PHE H H 26 7.982 7.982 8.677 -0.695 25068
75 1 1 . 1 1 27 27 TYR N N 27 123.888 123.888 119.771 4.117 25068
76 1 1 . 1 1 27 27 TYR HA H 27 3.576 3.576 4.137 -0.561 25068
77 1 1 . 1 1 27 27 TYR C C 27 176.691 176.691 177.397 -0.706 25068
78 1 1 . 1 1 27 27 TYR CA C 27 62.831 62.831 61.705 1.126 25068
79 1 1 . 1 1 27 27 TYR CB C 27 39.238 39.238 38.102 1.136 25068
80 1 1 . 1 1 27 27 TYR H H 27 7.843 7.843 8.654 -0.811 25068
81 1 1 . 1 1 28 28 VAL N N 28 119.501 119.501 119.457 0.044 25068
82 1 1 . 1 1 28 28 VAL HA H 28 2.912 2.912 3.269 -0.357 25068
83 1 1 . 1 1 28 28 VAL C C 28 177.067 177.067 177.753 -0.686 25068
84 1 1 . 1 1 28 28 VAL CA C 28 67.149 67.149 67.339 -0.190 25068
85 1 1 . 1 1 28 28 VAL CB C 28 32.599 32.599 31.160 1.439 25068
86 1 1 . 1 1 28 28 VAL H H 28 8.370 8.370 8.061 0.309 25068
87 1 1 . 1 1 29 29 LYS N N 29 114.512 114.512 118.699 -4.187 25068
88 1 1 . 1 1 29 29 LYS HA H 29 3.676 3.676 3.835 -0.159 25068
89 1 1 . 1 1 29 29 LYS C C 29 178.627 178.627 178.737 -0.110 25068
90 1 1 . 1 1 29 29 LYS CA C 29 60.349 60.349 59.695 0.654 25068
91 1 1 . 1 1 29 29 LYS CB C 29 33.278 33.278 31.690 1.588 25068
92 1 1 . 1 1 29 29 LYS H H 29 6.821 6.821 8.464 -1.643 25068
93 1 1 . 1 1 30 30 ASP N N 30 116.793 116.793 121.365 -4.572 25068
94 1 1 . 1 1 30 30 ASP HA H 30 4.466 4.466 4.418 0.048 25068
95 1 1 . 1 1 30 30 ASP C C 30 178.615 178.615 178.467 0.148 25068
96 1 1 . 1 1 30 30 ASP CA C 30 57.223 57.223 57.244 -0.021 25068
97 1 1 . 1 1 30 30 ASP CB C 30 42.066 42.066 40.407 1.659 25068
98 1 1 . 1 1 30 30 ASP H H 30 6.875 6.875 8.284 -1.409 25068
99 1 1 . 1 1 31 31 LYS N N 31 122.423 122.423 119.761 2.662 25068
100 1 1 . 1 1 31 31 LYS HA H 31 3.813 3.813 3.865 -0.052 25068
101 1 1 . 1 1 31 31 LYS C C 31 178.443 178.443 178.760 -0.317 25068
102 1 1 . 1 1 31 31 LYS CA C 31 57.494 57.494 58.805 -1.311 25068
103 1 1 . 1 1 31 31 LYS CB C 31 32.539 32.539 32.255 0.284 25068
104 1 1 . 1 1 31 31 LYS H H 31 8.910 8.910 8.105 0.805 25068
105 1 1 . 1 1 32 32 ARG N N 32 117.823 117.823 119.591 -1.768 25068
106 1 1 . 1 1 32 32 ARG HA H 32 3.540 3.540 4.021 -0.481 25068
107 1 1 . 1 1 32 32 ARG C C 32 176.951 176.951 178.521 -1.570 25068
108 1 1 . 1 1 32 32 ARG CA C 32 61.259 61.259 59.508 1.751 25068
109 1 1 . 1 1 32 32 ARG CB C 32 30.668 30.668 29.987 0.681 25068
110 1 1 . 1 1 32 32 ARG H H 32 8.501 8.501 7.906 0.595 25068
111 1 1 . 1 1 33 33 LEU N N 33 114.878 114.878 119.545 -4.667 25068
112 1 1 . 1 1 33 33 LEU HA H 33 3.871 3.871 3.870 0.001 25068
113 1 1 . 1 1 33 33 LEU C C 33 179.180 179.180 179.478 -0.298 25068
114 1 1 . 1 1 33 33 LEU CA C 33 58.377 58.377 58.014 0.362 25068
115 1 1 . 1 1 33 33 LEU CB C 33 42.429 42.429 41.448 0.981 25068
116 1 1 . 1 1 33 33 LEU H H 33 6.549 6.549 8.368 -1.819 25068
117 1 1 . 1 1 34 34 GLU N N 34 118.637 118.637 119.152 -0.515 25068
118 1 1 . 1 1 34 34 GLU HA H 34 3.866 3.866 4.054 -0.188 25068
119 1 1 . 1 1 34 34 GLU C C 34 178.988 178.988 179.304 -0.316 25068
120 1 1 . 1 1 34 34 GLU CA C 34 60.248 60.248 59.282 0.966 25068
121 1 1 . 1 1 34 34 GLU CB C 34 31.325 31.325 29.475 1.850 25068
122 1 1 . 1 1 34 34 GLU H H 34 7.135 7.135 8.079 -0.944 25068
123 1 1 . 1 1 35 35 ILE N N 35 119.142 119.142 119.841 -0.699 25068
124 1 1 . 1 1 35 35 ILE HA H 35 3.693 3.693 4.057 -0.364 25068
125 1 1 . 1 1 35 35 ILE C C 35 177.789 177.789 178.875 -1.086 25068
126 1 1 . 1 1 35 35 ILE CA C 35 65.753 65.753 64.868 0.885 25068
127 1 1 . 1 1 35 35 ILE CB C 35 38.940 38.940 37.856 1.083 25068
128 1 1 . 1 1 35 35 ILE H H 35 8.076 8.076 8.027 0.049 25068
129 1 1 . 1 1 36 36 ILE N N 36 116.296 116.296 119.264 -2.968 25068
130 1 1 . 1 1 36 36 ILE HA H 36 3.640 3.640 3.960 -0.320 25068
131 1 1 . 1 1 36 36 ILE C C 36 177.270 177.270 177.266 0.004 25068
132 1 1 . 1 1 36 36 ILE CA C 36 64.633 64.633 63.978 0.655 25068
133 1 1 . 1 1 36 36 ILE CB C 36 38.718 38.718 38.362 0.356 25068
134 1 1 . 1 1 36 36 ILE H H 36 7.754 7.754 7.963 -0.209 25068
135 1 1 . 1 1 37 37 LYS N N 37 119.626 119.626 118.471 1.155 25068
136 1 1 . 1 1 37 37 LYS HA H 37 3.922 3.922 4.104 -0.182 25068
137 1 1 . 1 1 37 37 LYS C C 37 178.129 178.129 177.899 0.230 25068
138 1 1 . 1 1 37 37 LYS CA C 37 59.996 59.996 58.562 1.434 25068
139 1 1 . 1 1 37 37 LYS CB C 37 33.487 33.487 32.558 0.929 25068
140 1 1 . 1 1 37 37 LYS H H 37 7.413 7.413 8.027 -0.614 25068
141 1 1 . 1 1 38 38 GLU N N 38 116.708 116.708 117.850 -1.142 25068
142 1 1 . 1 1 38 38 GLU HA H 38 4.060 4.060 4.278 -0.218 25068
143 1 1 . 1 1 38 38 GLU C C 38 177.004 177.004 176.889 0.115 25068
144 1 1 . 1 1 38 38 GLU CA C 38 59.070 59.070 57.402 1.668 25068
145 1 1 . 1 1 38 38 GLU CB C 38 31.665 31.665 30.620 1.045 25068
146 1 1 . 1 1 38 38 GLU H H 38 7.354 7.354 8.106 -0.752 25068
147 1 1 . 1 1 39 39 LYS N N 39 118.621 118.621 119.806 -1.185 25068
148 1 1 . 1 1 39 39 LYS HA H 39 4.690 4.690 4.839 -0.149 25068
149 1 1 . 1 1 39 39 LYS C C 39 172.792 172.792 174.892 -2.100 25068
150 1 1 . 1 1 39 39 LYS CA C 39 54.596 54.596 53.217 1.379 25068
151 1 1 . 1 1 39 39 LYS CB C 39 33.945 33.945 34.441 -0.496 25068
152 1 1 . 1 1 39 39 LYS H H 39 8.176 8.176 7.616 0.560 25068
153 1 1 . 1 1 40 40 PRO HA H 40 4.429 4.429 4.317 0.112 25068
154 1 1 . 1 1 40 40 PRO C C 40 179.829 179.829 177.582 2.247 25068
155 1 1 . 1 1 40 40 PRO CA C 40 66.040 66.040 64.368 1.671 25068
156 1 1 . 1 1 40 40 PRO CB C 40 32.606 32.606 32.056 0.550 25068
157 1 1 . 1 1 41 41 GLU N N 41 119.150 119.150 119.149 0.001 25068
158 1 1 . 1 1 41 41 GLU HA H 41 4.143 4.143 4.188 -0.045 25068
159 1 1 . 1 1 41 41 GLU C C 41 178.502 178.502 178.233 0.269 25068
160 1 1 . 1 1 41 41 GLU CA C 41 59.485 59.485 58.705 0.780 25068
161 1 1 . 1 1 41 41 GLU CB C 41 28.574 28.574 29.393 -0.819 25068
162 1 1 . 1 1 41 41 GLU H H 41 9.789 9.789 8.653 1.136 25068
163 1 1 . 1 1 42 42 LEU N N 42 121.443 121.443 120.153 1.290 25068
164 1 1 . 1 1 42 42 LEU HA H 42 4.185 4.185 4.680 -0.495 25068
165 1 1 . 1 1 42 42 LEU C C 42 177.815 177.815 178.037 -0.222 25068
166 1 1 . 1 1 42 42 LEU CA C 42 56.730 56.730 54.745 1.985 25068
167 1 1 . 1 1 42 42 LEU CB C 42 42.013 42.013 41.861 0.152 25068
168 1 1 . 1 1 42 42 LEU H H 42 8.312 8.312 7.588 0.724 25068
169 1 1 . 1 1 43 43 ALA N N 43 119.949 119.949 121.713 -1.764 25068
170 1 1 . 1 1 43 43 ALA HA H 43 3.746 3.746 3.997 -0.251 25068
171 1 1 . 1 1 43 43 ALA C C 43 178.635 178.635 177.871 0.764 25068
172 1 1 . 1 1 43 43 ALA CA C 43 56.164 56.164 54.335 1.829 25068
173 1 1 . 1 1 43 43 ALA CB C 43 19.670 19.670 18.353 1.317 25068
174 1 1 . 1 1 43 43 ALA H H 43 7.554 7.554 7.903 -0.349 25068
175 1 1 . 1 1 44 44 LYS N N 44 112.690 112.690 116.590 -3.900 25068
176 1 1 . 1 1 44 44 LYS HA H 44 4.232 4.232 4.404 -0.172 25068
177 1 1 . 1 1 44 44 LYS C C 44 175.949 175.949 175.714 0.235 25068
178 1 1 . 1 1 44 44 LYS CA C 44 56.987 56.987 55.719 1.268 25068
179 1 1 . 1 1 44 44 LYS CB C 44 33.345 33.345 32.156 1.189 25068
180 1 1 . 1 1 44 44 LYS H H 44 7.560 7.560 7.878 -0.319 25068
181 1 1 . 1 1 45 45 ASP N N 45 122.529 122.529 122.021 0.508 25068
182 1 1 . 1 1 45 45 ASP HA H 45 4.749 4.749 4.883 -0.134 25068
183 1 1 . 1 1 45 45 ASP C C 45 174.677 174.677 176.080 -1.403 25068
184 1 1 . 1 1 45 45 ASP CA C 45 53.030 53.030 52.986 0.044 25068
185 1 1 . 1 1 45 45 ASP CB C 45 41.549 41.549 40.457 1.092 25068
186 1 1 . 1 1 45 45 ASP H H 45 7.672 7.672 8.123 -0.451 25068
187 1 1 . 1 1 46 46 VAL N N 46 121.529 121.529 122.451 -0.922 25068
188 1 1 . 1 1 46 46 VAL HA H 46 3.639 3.639 3.561 0.078 25068
189 1 1 . 1 1 46 46 VAL C C 46 179.102 179.102 177.722 1.380 25068
190 1 1 . 1 1 46 46 VAL CA C 46 66.430 66.430 66.519 -0.089 25068
191 1 1 . 1 1 46 46 VAL CB C 46 32.650 32.650 31.687 0.963 25068
192 1 1 . 1 1 46 46 VAL H H 46 7.808 7.808 8.245 -0.437 25068
193 1 1 . 1 1 47 47 ALA N N 47 123.933 123.933 120.785 3.148 25068
194 1 1 . 1 1 47 47 ALA HA H 47 4.112 4.112 3.959 0.153 25068
195 1 1 . 1 1 47 47 ALA C C 47 180.665 180.665 179.599 1.066 25068
196 1 1 . 1 1 47 47 ALA CA C 47 55.822 55.822 55.174 0.648 25068
197 1 1 . 1 1 47 47 ALA CB C 47 19.129 19.129 18.195 0.934 25068
198 1 1 . 1 1 47 47 ALA H H 47 8.505 8.505 8.215 0.290 25068
199 1 1 . 1 1 48 48 GLN N N 48 120.047 120.047 118.833 1.214 25068
200 1 1 . 1 1 48 48 GLN HA H 48 4.033 4.033 4.091 -0.058 25068
201 1 1 . 1 1 48 48 GLN C C 48 178.486 178.486 178.110 0.376 25068
202 1 1 . 1 1 48 48 GLN CA C 48 59.436 59.436 58.376 1.060 25068
203 1 1 . 1 1 48 48 GLN CB C 48 29.436 29.436 28.179 1.257 25068
204 1 1 . 1 1 48 48 GLN H H 48 7.852 7.852 7.612 0.240 25068
205 1 1 . 1 1 49 49 VAL N N 49 119.185 119.185 116.839 2.346 25068
206 1 1 . 1 1 49 49 VAL HA H 49 3.424 3.424 3.564 -0.140 25068
207 1 1 . 1 1 49 49 VAL C C 49 177.519 177.519 177.982 -0.463 25068
208 1 1 . 1 1 49 49 VAL CA C 49 68.854 68.854 66.428 2.426 25068
209 1 1 . 1 1 49 49 VAL CB C 49 32.454 32.454 31.090 1.364 25068
210 1 1 . 1 1 49 49 VAL H H 49 7.984 7.984 7.958 0.026 25068
211 1 1 . 1 1 50 50 GLY N N 50 104.919 104.919 107.813 -2.894 25068
212 1 1 . 1 1 50 50 GLY C C 50 176.825 176.825 175.937 0.888 25068
213 1 1 . 1 1 50 50 GLY CA C 50 48.398 48.398 47.329 1.069 25068
214 1 1 . 1 1 50 50 GLY H H 50 8.020 8.020 8.329 -0.309 25068
215 1 1 . 1 1 51 51 LYS N N 51 123.422 123.422 122.502 0.920 25068
216 1 1 . 1 1 51 51 LYS HA H 51 4.032 4.032 4.096 -0.064 25068
217 1 1 . 1 1 51 51 LYS C C 51 179.332 179.332 179.143 0.189 25068
218 1 1 . 1 1 51 51 LYS CA C 51 60.246 60.246 58.946 1.300 25068
219 1 1 . 1 1 51 51 LYS CB C 51 33.626 33.626 32.009 1.617 25068
220 1 1 . 1 1 51 51 LYS H H 51 7.699 7.699 7.930 -0.231 25068
221 1 1 . 1 1 52 52 LEU N N 52 120.442 120.442 120.580 -0.138 25068
222 1 1 . 1 1 52 52 LEU HA H 52 4.041 4.041 4.005 0.036 25068
223 1 1 . 1 1 52 52 LEU C C 52 180.984 180.984 179.063 1.921 25068
224 1 1 . 1 1 52 52 LEU CA C 52 58.855 58.855 57.908 0.947 25068
225 1 1 . 1 1 52 52 LEU CB C 52 43.046 43.046 41.617 1.429 25068
226 1 1 . 1 1 52 52 LEU H H 52 8.088 8.088 7.879 0.209 25068
227 1 1 . 1 1 53 53 ILE N N 53 121.249 121.249 119.233 2.016 25068
228 1 1 . 1 1 53 53 ILE HA H 53 3.557 3.557 3.791 -0.234 25068
229 1 1 . 1 1 53 53 ILE C C 53 177.945 177.945 178.705 -0.760 25068
230 1 1 . 1 1 53 53 ILE CA C 53 67.431 67.431 62.912 4.519 25068
231 1 1 . 1 1 53 53 ILE CB C 53 38.887 38.887 36.016 2.871 25068
232 1 1 . 1 1 53 53 ILE H H 53 8.475 8.475 8.141 0.334 25068
233 1 1 . 1 1 54 54 GLY N N 54 107.755 107.755 108.075 -0.320 25068
234 1 1 . 1 1 54 54 GLY C C 54 177.691 177.691 176.498 1.193 25068
235 1 1 . 1 1 54 54 GLY CA C 54 48.997 48.997 47.707 1.290 25068
236 1 1 . 1 1 54 54 GLY H H 54 8.130 8.130 8.517 -0.387 25068
237 1 1 . 1 1 55 55 GLU N N 55 122.138 122.138 122.644 -0.506 25068
238 1 1 . 1 1 55 55 GLU HA H 55 4.032 4.032 3.968 0.064 25068
239 1 1 . 1 1 55 55 GLU C C 55 179.146 179.146 179.107 0.039 25068
240 1 1 . 1 1 55 55 GLU CA C 55 59.958 59.958 58.937 1.021 25068
241 1 1 . 1 1 55 55 GLU CB C 55 30.551 30.551 29.215 1.337 25068
242 1 1 . 1 1 55 55 GLU H H 55 8.089 8.089 8.188 -0.099 25068
243 1 1 . 1 1 56 56 ALA N N 56 122.985 122.985 121.400 1.585 25068
244 1 1 . 1 1 56 56 ALA HA H 56 4.107 4.107 4.125 -0.018 25068
245 1 1 . 1 1 56 56 ALA C C 56 181.177 181.177 179.532 1.645 25068
246 1 1 . 1 1 56 56 ALA CA C 56 56.414 56.414 54.734 1.680 25068
247 1 1 . 1 1 56 56 ALA CB C 56 19.948 19.948 18.395 1.552 25068
248 1 1 . 1 1 56 56 ALA H H 56 7.947 7.947 8.034 -0.087 25068
249 1 1 . 1 1 57 57 TRP N N 57 120.485 120.485 121.746 -1.261 25068
250 1 1 . 1 1 57 57 TRP HA H 57 3.940 3.940 4.410 -0.470 25068
251 1 1 . 1 1 57 57 TRP C C 57 178.537 178.537 178.817 -0.280 25068
252 1 1 . 1 1 57 57 TRP CA C 57 60.633 60.633 60.221 0.412 25068
253 1 1 . 1 1 57 57 TRP CB C 57 31.681 31.681 29.880 1.801 25068
254 1 1 . 1 1 57 57 TRP H H 57 8.910 8.910 8.085 0.825 25068
255 1 1 . 1 1 58 58 GLY N N 58 102.004 102.004 107.389 -5.385 25068
256 1 1 . 1 1 58 58 GLY C C 58 174.723 174.723 175.068 -0.345 25068
257 1 1 . 1 1 58 58 GLY CA C 58 47.091 47.091 46.141 0.950 25068
258 1 1 . 1 1 58 58 GLY H H 58 7.668 7.668 8.349 -0.681 25068
259 1 1 . 1 1 59 59 GLN N N 59 116.202 116.202 117.389 -1.187 25068
260 1 1 . 1 1 59 59 GLN HA H 59 4.259 4.259 4.328 -0.069 25068
261 1 1 . 1 1 59 59 GLN C C 59 176.221 176.221 175.567 0.654 25068
262 1 1 . 1 1 59 59 GLN CA C 59 55.967 55.967 54.679 1.288 25068
263 1 1 . 1 1 59 59 GLN CB C 59 30.741 30.741 29.066 1.675 25068
264 1 1 . 1 1 59 59 GLN H H 59 7.189 7.189 7.802 -0.613 25068
265 1 1 . 1 1 60 60 LEU N N 60 120.776 120.776 122.155 -1.379 25068
266 1 1 . 1 1 60 60 LEU HA H 60 4.185 4.185 4.410 -0.225 25068
267 1 1 . 1 1 60 60 LEU C C 60 177.372 177.372 176.669 0.703 25068
268 1 1 . 1 1 60 60 LEU CA C 60 56.061 56.061 55.130 0.930 25068
269 1 1 . 1 1 60 60 LEU CB C 60 43.696 43.696 43.021 0.675 25068
270 1 1 . 1 1 60 60 LEU H H 60 6.968 6.968 7.634 -0.666 25068
271 1 1 . 1 1 61 61 SER N N 61 120.432 120.432 116.749 3.683 25068
272 1 1 . 1 1 61 61 SER HA H 61 4.582 4.582 4.870 -0.288 25068
273 1 1 . 1 1 61 61 SER C C 61 173.500 173.500 174.333 -0.833 25068
274 1 1 . 1 1 61 61 SER CA C 61 57.204 57.204 55.973 1.231 25068
275 1 1 . 1 1 61 61 SER CB C 61 63.980 63.980 63.701 0.279 25068
276 1 1 . 1 1 61 61 SER H H 61 8.885 8.885 8.332 0.553 25068
277 1 1 . 1 1 63 63 ALA HA H 63 4.089 4.089 4.155 -0.066 25068
278 1 1 . 1 1 63 63 ALA C C 63 180.570 180.570 178.895 1.675 25068
279 1 1 . 1 1 63 63 ALA CA C 63 56.005 56.005 54.693 1.312 25068
280 1 1 . 1 1 63 63 ALA CB C 63 19.317 19.317 18.279 1.038 25068
281 1 1 . 1 1 64 64 GLN N N 64 116.774 116.774 116.789 -0.015 25068
282 1 1 . 1 1 64 64 GLN HA H 64 4.122 4.122 4.294 -0.172 25068
283 1 1 . 1 1 64 64 GLN C C 64 178.275 178.275 178.371 -0.096 25068
284 1 1 . 1 1 64 64 GLN CA C 64 58.622 58.622 57.938 0.684 25068
285 1 1 . 1 1 64 64 GLN CB C 64 31.350 31.350 28.858 2.492 25068
286 1 1 . 1 1 64 64 GLN H H 64 7.603 7.603 8.060 -0.457 25068
287 1 1 . 1 1 65 65 LYS N N 65 117.203 117.203 120.153 -2.950 25068
288 1 1 . 1 1 65 65 LYS HA H 65 4.129 4.129 4.222 -0.093 25068
289 1 1 . 1 1 65 65 LYS C C 65 178.449 178.449 178.732 -0.283 25068
290 1 1 . 1 1 65 65 LYS CA C 65 59.891 59.891 58.496 1.395 25068
291 1 1 . 1 1 65 65 LYS CB C 65 34.351 34.351 32.119 2.232 25068
292 1 1 . 1 1 65 65 LYS H H 65 7.810 7.810 8.066 -0.256 25068
293 1 1 . 1 1 66 66 ALA N N 66 122.218 122.218 122.473 -0.255 25068
294 1 1 . 1 1 66 66 ALA HA H 66 4.290 4.290 4.218 0.072 25068
295 1 1 . 1 1 66 66 ALA C C 66 176.135 176.135 176.778 -0.643 25068
296 1 1 . 1 1 66 66 ALA CA C 66 57.745 57.745 56.904 0.841 25068
297 1 1 . 1 1 66 66 ALA CB C 66 17.033 17.033 16.354 0.679 25068
298 1 1 . 1 1 66 66 ALA H H 66 7.469 7.469 8.152 -0.683 25068
299 1 1 . 1 1 67 67 PRO HA H 67 4.142 4.142 4.307 -0.165 25068
300 1 1 . 1 1 67 67 PRO C C 67 179.591 179.591 178.651 0.940 25068
301 1 1 . 1 1 67 67 PRO CA C 67 66.960 66.960 65.612 1.347 25068
302 1 1 . 1 1 67 67 PRO CB C 67 32.014 32.014 31.403 0.611 25068
303 1 1 . 1 1 68 68 TYR N N 68 117.140 117.140 120.669 -3.529 25068
304 1 1 . 1 1 68 68 TYR HA H 68 3.940 3.940 4.034 -0.094 25068
305 1 1 . 1 1 68 68 TYR C C 68 177.733 177.733 177.847 -0.114 25068
306 1 1 . 1 1 68 68 TYR CA C 68 63.505 63.505 62.048 1.457 25068
307 1 1 . 1 1 68 68 TYR CB C 68 38.503 38.503 38.514 -0.011 25068
308 1 1 . 1 1 68 68 TYR H H 68 7.268 7.268 8.340 -1.072 25068
309 1 1 . 1 1 69 69 GLU N N 69 120.747 120.747 118.289 2.458 25068
310 1 1 . 1 1 69 69 GLU HA H 69 4.253 4.253 3.883 0.370 25068
311 1 1 . 1 1 69 69 GLU C C 69 179.805 179.805 179.079 0.726 25068
312 1 1 . 1 1 69 69 GLU CA C 69 60.145 60.145 59.469 0.675 25068
313 1 1 . 1 1 69 69 GLU CB C 69 29.808 29.808 29.341 0.467 25068
314 1 1 . 1 1 69 69 GLU H H 69 8.048 8.048 8.518 -0.470 25068
315 1 1 . 1 1 70 70 LYS N N 70 120.938 120.938 119.935 1.003 25068
316 1 1 . 1 1 70 70 LYS HA H 70 4.020 4.020 3.982 0.038 25068
317 1 1 . 1 1 70 70 LYS C C 70 178.740 178.740 179.309 -0.569 25068
318 1 1 . 1 1 70 70 LYS CA C 70 60.202 60.202 59.179 1.023 25068
319 1 1 . 1 1 70 70 LYS CB C 70 32.419 32.419 32.120 0.299 25068
320 1 1 . 1 1 70 70 LYS H H 70 8.301 8.301 8.126 0.175 25068
321 1 1 . 1 1 71 71 LYS N N 71 118.427 118.427 118.585 -0.158 25068
322 1 1 . 1 1 71 71 LYS HA H 71 3.528 3.528 4.111 -0.583 25068
323 1 1 . 1 1 71 71 LYS C C 71 179.280 179.280 178.862 0.418 25068
324 1 1 . 1 1 71 71 LYS CA C 71 61.146 61.146 58.687 2.459 25068
325 1 1 . 1 1 71 71 LYS CB C 71 32.196 32.196 32.080 0.116 25068
326 1 1 . 1 1 71 71 LYS H H 71 7.234 7.234 8.360 -1.126 25068
327 1 1 . 1 1 72 72 ALA N N 72 122.126 122.126 122.259 -0.133 25068
328 1 1 . 1 1 72 72 ALA HA H 72 4.357 4.357 3.953 0.404 25068
329 1 1 . 1 1 72 72 ALA C C 72 180.468 180.468 179.970 0.498 25068
330 1 1 . 1 1 72 72 ALA CA C 72 56.457 56.457 55.092 1.365 25068
331 1 1 . 1 1 72 72 ALA CB C 72 19.562 19.562 17.728 1.834 25068
332 1 1 . 1 1 72 72 ALA H H 72 7.890 7.890 7.870 0.020 25068
333 1 1 . 1 1 73 73 GLN N N 73 121.659 121.659 119.008 2.651 25068
334 1 1 . 1 1 73 73 GLN HA H 73 4.029 4.029 4.026 0.003 25068
335 1 1 . 1 1 73 73 GLN C C 73 179.576 179.576 178.255 1.321 25068
336 1 1 . 1 1 73 73 GLN CA C 73 60.427 60.427 58.927 1.500 25068
337 1 1 . 1 1 73 73 GLN CB C 73 28.732 28.732 28.832 -0.100 25068
338 1 1 . 1 1 73 73 GLN H H 73 8.353 8.353 8.238 0.115 25068
339 1 1 . 1 1 74 74 LEU N N 74 119.752 119.752 120.691 -0.939 25068
340 1 1 . 1 1 74 74 LEU HA H 74 4.046 4.046 3.833 0.213 25068
341 1 1 . 1 1 74 74 LEU C C 74 180.424 180.424 179.117 1.307 25068
342 1 1 . 1 1 74 74 LEU CA C 74 58.675 58.675 58.001 0.674 25068
343 1 1 . 1 1 74 74 LEU CB C 74 42.376 42.376 41.564 0.812 25068
344 1 1 . 1 1 74 74 LEU H H 74 8.160 8.160 8.252 -0.092 25068
345 1 1 . 1 1 75 75 ASP N N 75 122.159 122.159 118.928 3.231 25068
346 1 1 . 1 1 75 75 ASP HA H 75 4.988 4.988 4.397 0.591 25068
347 1 1 . 1 1 75 75 ASP C C 75 178.046 178.046 178.470 -0.424 25068
348 1 1 . 1 1 75 75 ASP CA C 75 58.191 58.191 57.675 0.516 25068
349 1 1 . 1 1 75 75 ASP CB C 75 42.958 42.958 40.817 2.141 25068
350 1 1 . 1 1 75 75 ASP H H 75 8.361 8.361 8.507 -0.146 25068
351 1 1 . 1 1 76 76 LYS N N 76 119.861 119.861 120.383 -0.522 25068
352 1 1 . 1 1 76 76 LYS HA H 76 3.988 3.988 4.116 -0.128 25068
353 1 1 . 1 1 76 76 LYS C C 76 179.668 179.668 179.266 0.402 25068
354 1 1 . 1 1 76 76 LYS CA C 76 60.984 60.984 59.346 1.638 25068
355 1 1 . 1 1 76 76 LYS CB C 76 33.124 33.124 32.519 0.605 25068
356 1 1 . 1 1 76 76 LYS H H 76 7.940 7.940 7.726 0.214 25068
357 1 1 . 1 1 77 77 VAL N N 77 121.485 121.485 119.846 1.639 25068
358 1 1 . 1 1 77 77 VAL HA H 77 3.687 3.687 3.558 0.129 25068
359 1 1 . 1 1 77 77 VAL C C 77 178.070 178.070 177.765 0.305 25068
360 1 1 . 1 1 77 77 VAL CA C 77 67.359 67.359 66.644 0.715 25068
361 1 1 . 1 1 77 77 VAL CB C 77 32.645 32.645 31.703 0.942 25068
362 1 1 . 1 1 77 77 VAL H H 77 7.401 7.401 8.518 -1.117 25068
363 1 1 . 1 1 78 78 ARG N N 78 121.960 121.960 119.607 2.353 25068
364 1 1 . 1 1 78 78 ARG HA H 78 4.010 4.010 3.911 0.099 25068
365 1 1 . 1 1 78 78 ARG C C 78 179.144 179.144 178.838 0.306 25068
366 1 1 . 1 1 78 78 ARG CA C 78 60.598 60.598 59.823 0.775 25068
367 1 1 . 1 1 78 78 ARG CB C 78 28.352 28.352 30.073 -1.722 25068
368 1 1 . 1 1 78 78 ARG H H 78 7.813 7.813 8.096 -0.283 25068
369 1 1 . 1 1 79 79 TYR N N 79 120.411 120.411 120.092 0.319 25068
370 1 1 . 1 1 79 79 TYR HA H 79 3.878 3.878 4.141 -0.263 25068
371 1 1 . 1 1 79 79 TYR C C 79 176.080 176.080 177.232 -1.152 25068
372 1 1 . 1 1 79 79 TYR CA C 79 63.669 63.669 60.050 3.619 25068
373 1 1 . 1 1 79 79 TYR CB C 79 39.758 39.758 38.064 1.694 25068
374 1 1 . 1 1 79 79 TYR H H 79 8.608 8.608 8.727 -0.119 25068
375 1 1 . 1 1 80 80 SER N N 80 113.726 113.726 114.242 -0.516 25068
376 1 1 . 1 1 80 80 SER HA H 80 3.880 3.880 3.710 0.170 25068
377 1 1 . 1 1 80 80 SER C C 80 176.794 176.794 176.841 -0.047 25068
378 1 1 . 1 1 80 80 SER CA C 80 62.969 62.969 61.843 1.126 25068
379 1 1 . 1 1 80 80 SER CB C 80 63.605 63.605 62.884 0.721 25068
380 1 1 . 1 1 80 80 SER H H 80 8.234 8.234 7.980 0.254 25068
381 1 1 . 1 1 81 81 LYS N N 81 121.920 121.920 120.146 1.774 25068
382 1 1 . 1 1 81 81 LYS HA H 81 4.029 4.029 4.210 -0.181 25068
383 1 1 . 1 1 81 81 LYS C C 81 179.342 179.342 179.239 0.103 25068
384 1 1 . 1 1 81 81 LYS CA C 81 60.138 60.138 59.005 1.133 25068
385 1 1 . 1 1 81 81 LYS CB C 81 33.238 33.238 31.981 1.257 25068
386 1 1 . 1 1 81 81 LYS H H 81 7.958 7.958 8.171 -0.213 25068
387 1 1 . 1 1 82 82 GLU N N 82 119.515 119.515 119.786 -0.271 25068
388 1 1 . 1 1 82 82 GLU HA H 82 3.945 3.945 4.072 -0.127 25068
389 1 1 . 1 1 82 82 GLU C C 82 180.689 180.689 179.088 1.601 25068
390 1 1 . 1 1 82 82 GLU CA C 82 60.920 60.920 59.530 1.390 25068
391 1 1 . 1 1 82 82 GLU CB C 82 30.885 30.885 29.428 1.457 25068
392 1 1 . 1 1 82 82 GLU H H 82 8.310 8.310 7.890 0.420 25068
393 1 1 . 1 1 83 83 ILE N N 83 121.362 121.362 120.132 1.230 25068
394 1 1 . 1 1 83 83 ILE HA H 83 3.889 3.889 3.682 0.207 25068
395 1 1 . 1 1 83 83 ILE C C 83 177.207 177.207 177.790 -0.583 25068
396 1 1 . 1 1 83 83 ILE CA C 83 62.754 62.754 63.480 -0.726 25068
397 1 1 . 1 1 83 83 ILE CB C 83 37.651 37.651 37.894 -0.243 25068
398 1 1 . 1 1 83 83 ILE H H 83 8.887 8.887 8.118 0.769 25068
399 1 1 . 1 1 84 84 GLU N N 84 122.327 122.327 120.406 1.921 25068
400 1 1 . 1 1 84 84 GLU HA H 84 4.028 4.028 3.853 0.175 25068
401 1 1 . 1 1 84 84 GLU C C 84 179.047 179.047 179.093 -0.046 25068
402 1 1 . 1 1 84 84 GLU CA C 84 60.045 60.045 60.213 -0.168 25068
403 1 1 . 1 1 84 84 GLU CB C 84 30.099 30.099 29.326 0.773 25068
404 1 1 . 1 1 84 84 GLU H H 84 7.289 7.289 8.145 -0.856 25068
405 1 1 . 1 1 85 85 GLU N N 85 118.046 118.046 119.042 -0.996 25068
406 1 1 . 1 1 85 85 GLU HA H 85 3.966 3.966 4.076 -0.110 25068
407 1 1 . 1 1 85 85 GLU C C 85 178.614 178.614 179.399 -0.785 25068
408 1 1 . 1 1 85 85 GLU CA C 85 59.997 59.997 59.289 0.708 25068
409 1 1 . 1 1 85 85 GLU CB C 85 30.453 30.453 29.553 0.900 25068
410 1 1 . 1 1 85 85 GLU H H 85 7.545 7.545 8.122 -0.577 25068
411 1 1 . 1 1 86 86 TYR N N 86 121.050 121.050 119.199 1.851 25068
412 1 1 . 1 1 86 86 TYR HA H 86 4.094 4.094 4.260 -0.166 25068
413 1 1 . 1 1 86 86 TYR C C 86 177.815 177.815 178.135 -0.320 25068
414 1 1 . 1 1 86 86 TYR CA C 86 62.072 62.072 61.829 0.243 25068
415 1 1 . 1 1 86 86 TYR CB C 86 39.954 39.954 38.308 1.646 25068
416 1 1 . 1 1 86 86 TYR H H 86 8.277 8.277 8.400 -0.123 25068
417 1 1 . 1 1 87 87 ARG N N 87 118.353 118.353 118.697 -0.344 25068
418 1 1 . 1 1 87 87 ARG HA H 87 3.877 3.877 3.976 -0.099 25068
419 1 1 . 1 1 87 87 ARG C C 87 178.067 178.067 178.601 -0.534 25068
420 1 1 . 1 1 87 87 ARG CA C 87 59.513 59.513 59.389 0.124 25068
421 1 1 . 1 1 87 87 ARG CB C 87 31.053 31.053 30.302 0.751 25068
422 1 1 . 1 1 87 87 ARG H H 87 8.249 8.249 8.485 -0.236 25068
423 1 1 . 1 1 88 88 LYS N N 88 118.205 118.205 120.332 -2.127 25068
424 1 1 . 1 1 88 88 LYS HA H 88 3.982 3.982 4.122 -0.140 25068
425 1 1 . 1 1 88 88 LYS C C 88 178.050 178.050 177.548 0.502 25068
426 1 1 . 1 1 88 88 LYS CA C 88 59.265 59.265 58.592 0.673 25068
427 1 1 . 1 1 88 88 LYS CB C 88 33.499 33.499 32.628 0.871 25068
428 1 1 . 1 1 88 88 LYS H H 88 7.465 7.465 7.909 -0.444 25068
429 1 1 . 1 1 89 89 LYS N N 89 118.341 118.341 115.809 2.532 25068
430 1 1 . 1 1 89 89 LYS HA H 89 4.084 4.084 4.492 -0.408 25068
431 1 1 . 1 1 89 89 LYS C C 89 176.691 176.691 175.944 0.747 25068
432 1 1 . 1 1 89 89 LYS CA C 89 58.188 58.188 55.382 2.806 25068
433 1 1 . 1 1 89 89 LYS CB C 89 33.809 33.809 32.343 1.466 25068
434 1 1 . 1 1 89 89 LYS H H 89 7.580 7.580 7.753 -0.173 25068
435 1 1 . 1 1 90 90 ASN N N 90 117.604 117.604 119.681 -2.077 25068
436 1 1 . 1 1 90 90 ASN HA H 90 4.563 4.563 4.752 -0.189 25068
437 1 1 . 1 1 90 90 ASN C C 90 174.419 174.419 174.822 -0.403 25068
438 1 1 . 1 1 90 90 ASN CA C 90 54.433 54.433 52.392 2.041 25068
439 1 1 . 1 1 90 90 ASN CB C 90 40.182 40.182 39.623 0.559 25068
440 1 1 . 1 1 90 90 ASN H H 90 7.741 7.741 7.713 0.028 25068
441 1 1 . 1 1 91 91 GLN N N 91 111.990 111.990 117.921 -5.931 25068
442 1 1 . 1 1 91 91 GLN HA H 91 4.213 4.213 4.066 0.147 25068
443 1 1 . 1 1 91 91 GLN C C 91 174.970 174.970 175.215 -0.245 25068
444 1 1 . 1 1 91 91 GLN CA C 91 57.011 57.011 56.913 0.098 25068
445 1 1 . 1 1 91 91 GLN CB C 91 30.358 30.358 28.207 2.151 25068
446 1 1 . 1 1 91 91 GLN H H 91 7.925 7.925 8.513 -0.588 25068
447 1 2 . 1 1 14 14 PRO HA H 14 4.322 4.322 4.330 -0.008 25068
448 1 2 . 1 1 14 14 PRO C C 14 176.783 176.783 176.861 -0.078 25068
449 1 2 . 1 1 14 14 PRO CA C 14 64.643 64.643 63.950 0.693 25068
450 1 2 . 1 1 14 14 PRO CB C 14 33.114 33.114 32.072 1.042 25068
451 1 2 . 1 1 15 15 LEU N N 15 120.158 120.158 119.008 1.150 25068
452 1 2 . 1 1 15 15 LEU HA H 15 4.238 4.238 4.658 -0.420 25068
453 1 2 . 1 1 15 15 LEU C C 15 176.361 176.361 175.803 0.558 25068
454 1 2 . 1 1 15 15 LEU CA C 15 55.395 55.395 54.160 1.234 25068
455 1 2 . 1 1 15 15 LEU CB C 15 42.619 42.619 41.097 1.522 25068
456 1 2 . 1 1 15 15 LEU H H 15 8.189 8.189 7.770 0.419 25068
457 1 2 . 1 1 16 16 ALA N N 16 124.269 124.269 122.801 1.468 25068
458 1 2 . 1 1 16 16 ALA HA H 16 3.496 3.496 4.749 -1.253 25068
459 1 2 . 1 1 16 16 ALA C C 16 175.124 175.124 175.495 -0.371 25068
460 1 2 . 1 1 16 16 ALA CA C 16 51.457 51.457 50.167 1.290 25068
461 1 2 . 1 1 16 16 ALA CB C 16 18.105 18.105 19.038 -0.933 25068
462 1 2 . 1 1 16 16 ALA H H 16 7.500 7.500 7.307 0.193 25068
463 1 2 . 1 1 17 17 PRO HA H 17 4.157 4.157 4.433 -0.276 25068
464 1 2 . 1 1 17 17 PRO C C 17 176.396 176.396 175.954 0.442 25068
465 1 2 . 1 1 17 17 PRO CA C 17 63.588 63.588 62.368 1.220 25068
466 1 2 . 1 1 17 17 PRO CB C 17 32.850 32.850 32.041 0.809 25068
467 1 2 . 1 1 18 18 LYS N N 18 124.070 124.070 120.582 3.488 25068
468 1 2 . 1 1 18 18 LYS HA H 18 4.147 4.147 4.285 -0.138 25068
469 1 2 . 1 1 18 18 LYS C C 18 177.543 177.543 175.689 1.854 25068
470 1 2 . 1 1 18 18 LYS CA C 18 57.081 57.081 56.546 0.535 25068
471 1 2 . 1 1 18 18 LYS CB C 18 33.573 33.573 33.133 0.440 25068
472 1 2 . 1 1 18 18 LYS H H 18 8.886 8.886 8.310 0.576 25068
473 1 2 . 1 1 19 19 ARG N N 19 122.242 122.242 119.197 3.045 25068
474 1 2 . 1 1 19 19 ARG HA H 19 3.437 3.437 4.506 -1.069 25068
475 1 2 . 1 1 19 19 ARG C C 19 175.409 175.409 174.240 1.169 25068
476 1 2 . 1 1 19 19 ARG CA C 19 57.545 57.545 55.399 2.146 25068
477 1 2 . 1 1 19 19 ARG CB C 19 31.149 31.149 30.715 0.434 25068
478 1 2 . 1 1 19 19 ARG H H 19 8.286 8.286 8.181 0.105 25068
479 1 2 . 1 1 20 20 ALA N N 20 123.176 123.176 123.747 -0.571 25068
480 1 2 . 1 1 20 20 ALA HA H 20 4.139 4.139 4.614 -0.475 25068
481 1 2 . 1 1 20 20 ALA C C 20 177.843 177.843 175.909 1.934 25068
482 1 2 . 1 1 20 20 ALA CA C 20 52.391 52.391 51.452 0.939 25068
483 1 2 . 1 1 20 20 ALA CB C 20 19.397 19.397 20.405 -1.008 25068
484 1 2 . 1 1 20 20 ALA H H 20 7.348 7.348 8.140 -0.792 25068
485 1 2 . 1 1 21 21 LEU N N 21 125.680 125.680 121.077 4.603 25068
486 1 2 . 1 1 21 21 LEU HA H 21 4.194 4.194 4.532 -0.338 25068
487 1 2 . 1 1 21 21 LEU C C 21 177.091 177.091 176.510 0.581 25068
488 1 2 . 1 1 21 21 LEU CA C 21 55.472 55.472 54.253 1.219 25068
489 1 2 . 1 1 21 21 LEU CB C 21 43.931 43.931 43.391 0.540 25068
490 1 2 . 1 1 21 21 LEU H H 21 9.055 9.055 8.257 0.798 25068
491 1 2 . 1 1 22 22 SER N N 22 116.686 116.686 114.713 1.973 25068
492 1 2 . 1 1 22 22 SER HA H 22 4.427 4.427 4.619 -0.192 25068
493 1 2 . 1 1 22 22 SER C C 22 174.241 174.241 175.213 -0.972 25068
494 1 2 . 1 1 22 22 SER CA C 22 57.564 57.564 57.120 0.444 25068
495 1 2 . 1 1 22 22 SER CB C 22 66.568 66.568 65.185 1.383 25068
496 1 2 . 1 1 22 22 SER H H 22 7.549 7.549 8.053 -0.504 25068
497 1 2 . 1 1 23 23 ALA N N 23 123.382 123.382 123.659 -0.277 25068
498 1 2 . 1 1 23 23 ALA HA H 23 4.163 4.163 3.808 0.355 25068
499 1 2 . 1 1 23 23 ALA C C 23 178.863 178.863 178.770 0.093 25068
500 1 2 . 1 1 23 23 ALA CA C 23 57.124 57.124 54.337 2.787 25068
501 1 2 . 1 1 23 23 ALA CB C 23 19.441 19.441 18.046 1.395 25068
502 1 2 . 1 1 23 23 ALA H H 23 9.035 9.035 8.819 0.216 25068
503 1 2 . 1 1 24 24 TYR N N 24 115.979 115.979 116.909 -0.930 25068
504 1 2 . 1 1 24 24 TYR HA H 24 2.590 2.590 4.265 -1.675 25068
505 1 2 . 1 1 24 24 TYR C C 24 176.257 176.257 177.784 -1.527 25068
506 1 2 . 1 1 24 24 TYR CA C 24 60.940 60.940 61.482 -0.542 25068
507 1 2 . 1 1 24 24 TYR CB C 24 39.106 39.106 38.232 0.874 25068
508 1 2 . 1 1 24 24 TYR H H 24 8.206 8.206 8.184 0.022 25068
509 1 2 . 1 1 25 25 MET N N 25 116.391 116.391 118.571 -2.180 25068
510 1 2 . 1 1 25 25 MET HA H 25 3.643 3.643 4.072 -0.429 25068
511 1 2 . 1 1 25 25 MET C C 25 180.177 180.177 178.397 1.780 25068
512 1 2 . 1 1 25 25 MET CA C 25 59.161 59.161 58.449 0.712 25068
513 1 2 . 1 1 25 25 MET CB C 25 32.748 32.748 31.758 0.990 25068
514 1 2 . 1 1 25 25 MET H H 25 7.433 7.433 7.683 -0.250 25068
515 1 2 . 1 1 26 26 PHE N N 26 118.699 118.699 120.173 -1.474 25068
516 1 2 . 1 1 26 26 PHE HA H 26 4.063 4.063 4.099 -0.036 25068
517 1 2 . 1 1 26 26 PHE C C 26 178.055 178.055 177.577 0.478 25068
518 1 2 . 1 1 26 26 PHE CA C 26 64.840 64.840 62.700 2.140 25068
519 1 2 . 1 1 26 26 PHE CB C 26 40.437 40.437 38.789 1.648 25068
520 1 2 . 1 1 26 26 PHE H H 26 7.982 7.982 7.753 0.229 25068
521 1 2 . 1 1 27 27 TYR N N 27 123.888 123.888 117.566 6.322 25068
522 1 2 . 1 1 27 27 TYR HA H 27 3.576 3.576 4.147 -0.571 25068
523 1 2 . 1 1 27 27 TYR C C 27 176.691 176.691 178.044 -1.353 25068
524 1 2 . 1 1 27 27 TYR CA C 27 62.831 62.831 61.054 1.776 25068
525 1 2 . 1 1 27 27 TYR CB C 27 39.238 39.238 37.819 1.419 25068
526 1 2 . 1 1 27 27 TYR H H 27 7.843 7.843 7.670 0.173 25068
527 1 2 . 1 1 28 28 VAL N N 28 119.501 119.501 119.815 -0.314 25068
528 1 2 . 1 1 28 28 VAL HA H 28 2.912 2.912 3.491 -0.579 25068
529 1 2 . 1 1 28 28 VAL C C 28 177.067 177.067 177.847 -0.780 25068
530 1 2 . 1 1 28 28 VAL CA C 28 67.149 67.149 67.129 0.020 25068
531 1 2 . 1 1 28 28 VAL CB C 28 32.599 32.599 31.477 1.122 25068
532 1 2 . 1 1 28 28 VAL H H 28 8.370 8.370 7.969 0.401 25068
533 1 2 . 1 1 29 29 LYS N N 29 114.512 114.512 118.717 -4.205 25068
534 1 2 . 1 1 29 29 LYS HA H 29 3.676 3.676 3.902 -0.226 25068
535 1 2 . 1 1 29 29 LYS C C 29 178.627 178.627 178.764 -0.137 25068
536 1 2 . 1 1 29 29 LYS CA C 29 60.349 60.349 59.622 0.727 25068
537 1 2 . 1 1 29 29 LYS CB C 29 33.278 33.278 31.768 1.510 25068
538 1 2 . 1 1 29 29 LYS H H 29 6.821 6.821 8.267 -1.446 25068
539 1 2 . 1 1 30 30 ASP N N 30 116.793 116.793 121.417 -4.624 25068
540 1 2 . 1 1 30 30 ASP HA H 30 4.466 4.466 4.197 0.269 25068
541 1 2 . 1 1 30 30 ASP C C 30 178.615 178.615 178.255 0.360 25068
542 1 2 . 1 1 30 30 ASP CA C 30 57.223 57.223 58.037 -0.814 25068
543 1 2 . 1 1 30 30 ASP CB C 30 42.066 42.066 40.436 1.630 25068
544 1 2 . 1 1 30 30 ASP H H 30 6.875 6.875 8.098 -1.224 25068
545 1 2 . 1 1 31 31 LYS N N 31 122.423 122.423 119.949 2.474 25068
546 1 2 . 1 1 31 31 LYS HA H 31 3.813 3.813 3.854 -0.041 25068
547 1 2 . 1 1 31 31 LYS C C 31 178.443 178.443 178.941 -0.498 25068
548 1 2 . 1 1 31 31 LYS CA C 31 57.494 57.494 59.372 -1.878 25068
549 1 2 . 1 1 31 31 LYS CB C 31 32.539 32.539 32.389 0.151 25068
550 1 2 . 1 1 31 31 LYS H H 31 8.910 8.910 8.014 0.896 25068
551 1 2 . 1 1 32 32 ARG N N 32 117.823 117.823 118.964 -1.141 25068
552 1 2 . 1 1 32 32 ARG HA H 32 3.540 3.540 3.972 -0.432 25068
553 1 2 . 1 1 32 32 ARG C C 32 176.951 176.951 178.871 -1.920 25068
554 1 2 . 1 1 32 32 ARG CA C 32 61.259 61.259 59.457 1.802 25068
555 1 2 . 1 1 32 32 ARG CB C 32 30.668 30.668 30.130 0.538 25068
556 1 2 . 1 1 32 32 ARG H H 32 8.501 8.501 8.033 0.468 25068
557 1 2 . 1 1 33 33 LEU N N 33 114.878 114.878 120.811 -5.933 25068
558 1 2 . 1 1 33 33 LEU HA H 33 3.871 3.871 3.820 0.051 25068
559 1 2 . 1 1 33 33 LEU C C 33 179.180 179.180 179.204 -0.024 25068
560 1 2 . 1 1 33 33 LEU CA C 33 58.377 58.377 58.076 0.301 25068
561 1 2 . 1 1 33 33 LEU CB C 33 42.429 42.429 41.609 0.820 25068
562 1 2 . 1 1 33 33 LEU H H 33 6.549 6.549 8.164 -1.615 25068
563 1 2 . 1 1 34 34 GLU N N 34 118.637 118.637 119.086 -0.449 25068
564 1 2 . 1 1 34 34 GLU HA H 34 3.866 3.866 3.956 -0.090 25068
565 1 2 . 1 1 34 34 GLU C C 34 178.988 178.988 179.310 -0.322 25068
566 1 2 . 1 1 34 34 GLU CA C 34 60.248 60.248 59.586 0.662 25068
567 1 2 . 1 1 34 34 GLU CB C 34 31.325 31.325 29.476 1.849 25068
568 1 2 . 1 1 34 34 GLU H H 34 7.135 7.135 7.971 -0.836 25068
569 1 2 . 1 1 35 35 ILE N N 35 119.142 119.142 119.671 -0.529 25068
570 1 2 . 1 1 35 35 ILE HA H 35 3.693 3.693 3.916 -0.223 25068
571 1 2 . 1 1 35 35 ILE C C 35 177.789 177.789 178.988 -1.199 25068
572 1 2 . 1 1 35 35 ILE CA C 35 65.753 65.753 65.302 0.451 25068
573 1 2 . 1 1 35 35 ILE CB C 35 38.940 38.940 37.900 1.040 25068
574 1 2 . 1 1 35 35 ILE H H 35 8.076 8.076 8.268 -0.192 25068
575 1 2 . 1 1 36 36 ILE N N 36 116.296 116.296 118.651 -2.355 25068
576 1 2 . 1 1 36 36 ILE HA H 36 3.640 3.640 4.036 -0.396 25068
577 1 2 . 1 1 36 36 ILE C C 36 177.270 177.270 177.523 -0.253 25068
578 1 2 . 1 1 36 36 ILE CA C 36 64.633 64.633 63.969 0.664 25068
579 1 2 . 1 1 36 36 ILE CB C 36 38.718 38.718 37.983 0.735 25068
580 1 2 . 1 1 36 36 ILE H H 36 7.754 7.754 8.203 -0.449 25068
581 1 2 . 1 1 37 37 LYS N N 37 119.626 119.626 120.056 -0.430 25068
582 1 2 . 1 1 37 37 LYS HA H 37 3.922 3.922 4.133 -0.211 25068
583 1 2 . 1 1 37 37 LYS C C 37 178.129 178.129 178.129 0.000 25068
584 1 2 . 1 1 37 37 LYS CA C 37 59.996 59.996 58.632 1.364 25068
585 1 2 . 1 1 37 37 LYS CB C 37 33.487 33.487 32.664 0.823 25068
586 1 2 . 1 1 37 37 LYS H H 37 7.413 7.413 7.798 -0.385 25068
587 1 2 . 1 1 38 38 GLU N N 38 116.708 116.708 116.457 0.251 25068
588 1 2 . 1 1 38 38 GLU HA H 38 4.060 4.060 4.324 -0.264 25068
589 1 2 . 1 1 38 38 GLU C C 38 177.004 177.004 177.228 -0.224 25068
590 1 2 . 1 1 38 38 GLU CA C 38 59.070 59.070 57.489 1.581 25068
591 1 2 . 1 1 38 38 GLU CB C 38 31.665 31.665 30.866 0.799 25068
592 1 2 . 1 1 38 38 GLU H H 38 7.354 7.354 8.087 -0.733 25068
593 1 2 . 1 1 39 39 LYS N N 39 118.621 118.621 120.406 -1.785 25068
594 1 2 . 1 1 39 39 LYS HA H 39 4.690 4.690 4.872 -0.182 25068
595 1 2 . 1 1 39 39 LYS C C 39 172.792 172.792 175.147 -2.355 25068
596 1 2 . 1 1 39 39 LYS CA C 39 54.596 54.596 52.993 1.603 25068
597 1 2 . 1 1 39 39 LYS CB C 39 33.945 33.945 34.059 -0.114 25068
598 1 2 . 1 1 39 39 LYS H H 39 8.176 8.176 7.771 0.405 25068
599 1 2 . 1 1 40 40 PRO HA H 40 4.429 4.429 4.390 0.039 25068
600 1 2 . 1 1 40 40 PRO C C 40 179.829 179.829 178.542 1.287 25068
601 1 2 . 1 1 40 40 PRO CA C 40 66.040 66.040 64.703 1.337 25068
602 1 2 . 1 1 40 40 PRO CB C 40 32.606 32.606 31.897 0.709 25068
603 1 2 . 1 1 41 41 GLU N N 41 119.150 119.150 120.753 -1.603 25068
604 1 2 . 1 1 41 41 GLU HA H 41 4.143 4.143 4.163 -0.020 25068
605 1 2 . 1 1 41 41 GLU C C 41 178.502 178.502 177.913 0.589 25068
606 1 2 . 1 1 41 41 GLU CA C 41 59.485 59.485 59.142 0.343 25068
607 1 2 . 1 1 41 41 GLU CB C 41 28.574 28.574 29.217 -0.643 25068
608 1 2 . 1 1 41 41 GLU H H 41 9.789 9.789 8.818 0.971 25068
609 1 2 . 1 1 42 42 LEU N N 42 121.443 121.443 119.047 2.396 25068
610 1 2 . 1 1 42 42 LEU HA H 42 4.185 4.185 4.742 -0.557 25068
611 1 2 . 1 1 42 42 LEU C C 42 177.815 177.815 177.599 0.216 25068
612 1 2 . 1 1 42 42 LEU CA C 42 56.730 56.730 54.415 2.315 25068
613 1 2 . 1 1 42 42 LEU CB C 42 42.013 42.013 41.699 0.314 25068
614 1 2 . 1 1 42 42 LEU H H 42 8.312 8.312 7.623 0.689 25068
615 1 2 . 1 1 43 43 ALA N N 43 119.949 119.949 122.774 -2.825 25068
616 1 2 . 1 1 43 43 ALA HA H 43 3.746 3.746 3.988 -0.242 25068
617 1 2 . 1 1 43 43 ALA C C 43 178.635 178.635 177.593 1.042 25068
618 1 2 . 1 1 43 43 ALA CA C 43 56.164 56.164 54.502 1.661 25068
619 1 2 . 1 1 43 43 ALA CB C 43 19.670 19.670 18.613 1.057 25068
620 1 2 . 1 1 43 43 ALA H H 43 7.554 7.554 7.550 0.004 25068
621 1 2 . 1 1 44 44 LYS N N 44 112.690 112.690 115.255 -2.565 25068
622 1 2 . 1 1 44 44 LYS HA H 44 4.232 4.232 4.434 -0.203 25068
623 1 2 . 1 1 44 44 LYS C C 44 175.949 175.949 175.740 0.209 25068
624 1 2 . 1 1 44 44 LYS CA C 44 56.987 56.987 55.471 1.516 25068
625 1 2 . 1 1 44 44 LYS CB C 44 33.345 33.345 32.006 1.339 25068
626 1 2 . 1 1 44 44 LYS H H 44 7.560 7.560 7.792 -0.232 25068
627 1 2 . 1 1 45 45 ASP N N 45 122.529 122.529 122.764 -0.235 25068
628 1 2 . 1 1 45 45 ASP HA H 45 4.749 4.749 4.875 -0.126 25068
629 1 2 . 1 1 45 45 ASP C C 45 174.677 174.677 176.074 -1.397 25068
630 1 2 . 1 1 45 45 ASP CA C 45 53.030 53.030 52.799 0.231 25068
631 1 2 . 1 1 45 45 ASP CB C 45 41.549 41.549 40.132 1.417 25068
632 1 2 . 1 1 45 45 ASP H H 45 7.672 7.672 8.094 -0.422 25068
633 1 2 . 1 1 46 46 VAL N N 46 121.529 121.529 122.550 -1.021 25068
634 1 2 . 1 1 46 46 VAL HA H 46 3.639 3.639 3.549 0.090 25068
635 1 2 . 1 1 46 46 VAL C C 46 179.102 179.102 177.640 1.462 25068
636 1 2 . 1 1 46 46 VAL CA C 46 66.430 66.430 66.406 0.023 25068
637 1 2 . 1 1 46 46 VAL CB C 46 32.650 32.650 31.567 1.083 25068
638 1 2 . 1 1 46 46 VAL H H 46 7.808 7.808 7.995 -0.187 25068
639 1 2 . 1 1 47 47 ALA N N 47 123.933 123.933 120.938 2.995 25068
640 1 2 . 1 1 47 47 ALA HA H 47 4.112 4.112 3.946 0.166 25068
641 1 2 . 1 1 47 47 ALA C C 47 180.665 180.665 179.604 1.061 25068
642 1 2 . 1 1 47 47 ALA CA C 47 55.822 55.822 55.217 0.605 25068
643 1 2 . 1 1 47 47 ALA CB C 47 19.129 19.129 18.165 0.964 25068
644 1 2 . 1 1 47 47 ALA H H 47 8.505 8.505 8.208 0.297 25068
645 1 2 . 1 1 48 48 GLN N N 48 120.047 120.047 118.727 1.320 25068
646 1 2 . 1 1 48 48 GLN HA H 48 4.033 4.033 4.106 -0.073 25068
647 1 2 . 1 1 48 48 GLN C C 48 178.486 178.486 178.196 0.290 25068
648 1 2 . 1 1 48 48 GLN CA C 48 59.436 59.436 58.381 1.055 25068
649 1 2 . 1 1 48 48 GLN CB C 48 29.436 29.436 28.106 1.330 25068
650 1 2 . 1 1 48 48 GLN H H 48 7.852 7.852 7.632 0.220 25068
651 1 2 . 1 1 49 49 VAL N N 49 119.185 119.185 117.213 1.972 25068
652 1 2 . 1 1 49 49 VAL HA H 49 3.424 3.424 3.629 -0.205 25068
653 1 2 . 1 1 49 49 VAL C C 49 177.519 177.519 178.075 -0.556 25068
654 1 2 . 1 1 49 49 VAL CA C 49 68.854 68.854 66.195 2.659 25068
655 1 2 . 1 1 49 49 VAL CB C 49 32.454 32.454 30.741 1.713 25068
656 1 2 . 1 1 49 49 VAL H H 49 7.984 7.984 7.974 0.010 25068
657 1 2 . 1 1 50 50 GLY N N 50 104.919 104.919 108.113 -3.194 25068
658 1 2 . 1 1 50 50 GLY C C 50 176.825 176.825 175.973 0.852 25068
659 1 2 . 1 1 50 50 GLY CA C 50 48.398 48.398 47.401 0.997 25068
660 1 2 . 1 1 50 50 GLY H H 50 8.020 8.020 8.341 -0.321 25068
661 1 2 . 1 1 51 51 LYS N N 51 123.422 123.422 122.849 0.573 25068
662 1 2 . 1 1 51 51 LYS HA H 51 4.032 4.032 4.080 -0.048 25068
663 1 2 . 1 1 51 51 LYS C C 51 179.332 179.332 179.038 0.294 25068
664 1 2 . 1 1 51 51 LYS CA C 51 60.246 60.246 58.989 1.256 25068
665 1 2 . 1 1 51 51 LYS CB C 51 33.626 33.626 32.060 1.566 25068
666 1 2 . 1 1 51 51 LYS H H 51 7.699 7.699 7.891 -0.192 25068
667 1 2 . 1 1 52 52 LEU N N 52 120.442 120.442 120.618 -0.176 25068
668 1 2 . 1 1 52 52 LEU HA H 52 4.041 4.041 4.367 -0.327 25068
669 1 2 . 1 1 52 52 LEU C C 52 180.984 180.984 179.304 1.680 25068
670 1 2 . 1 1 52 52 LEU CA C 52 58.855 58.855 57.689 1.166 25068
671 1 2 . 1 1 52 52 LEU CB C 52 43.046 43.046 41.693 1.353 25068
672 1 2 . 1 1 52 52 LEU H H 52 8.088 8.088 7.872 0.216 25068
673 1 2 . 1 1 53 53 ILE N N 53 121.249 121.249 118.995 2.254 25068
674 1 2 . 1 1 53 53 ILE HA H 53 3.557 3.557 3.955 -0.398 25068
675 1 2 . 1 1 53 53 ILE C C 53 177.945 177.945 178.818 -0.873 25068
676 1 2 . 1 1 53 53 ILE CA C 53 67.431 67.431 62.600 4.831 25068
677 1 2 . 1 1 53 53 ILE CB C 53 38.887 38.887 36.046 2.841 25068
678 1 2 . 1 1 53 53 ILE H H 53 8.475 8.475 8.070 0.405 25068
679 1 2 . 1 1 54 54 GLY N N 54 107.755 107.755 108.383 -0.628 25068
680 1 2 . 1 1 54 54 GLY C C 54 177.691 177.691 176.092 1.599 25068
681 1 2 . 1 1 54 54 GLY CA C 54 48.997 48.997 47.457 1.540 25068
682 1 2 . 1 1 54 54 GLY H H 54 8.130 8.130 8.492 -0.362 25068
683 1 2 . 1 1 55 55 GLU N N 55 122.138 122.138 122.391 -0.253 25068
684 1 2 . 1 1 55 55 GLU HA H 55 4.032 4.032 3.957 0.075 25068
685 1 2 . 1 1 55 55 GLU C C 55 179.146 179.146 179.025 0.121 25068
686 1 2 . 1 1 55 55 GLU CA C 55 59.958 59.958 59.280 0.678 25068
687 1 2 . 1 1 55 55 GLU CB C 55 30.551 30.551 29.279 1.272 25068
688 1 2 . 1 1 55 55 GLU H H 55 8.089 8.089 8.327 -0.238 25068
689 1 2 . 1 1 56 56 ALA N N 56 122.985 122.985 121.961 1.024 25068
690 1 2 . 1 1 56 56 ALA HA H 56 4.107 4.107 4.162 -0.055 25068
691 1 2 . 1 1 56 56 ALA C C 56 181.177 181.177 179.834 1.343 25068
692 1 2 . 1 1 56 56 ALA CA C 56 56.414 56.414 54.751 1.663 25068
693 1 2 . 1 1 56 56 ALA CB C 56 19.948 19.948 18.204 1.744 25068
694 1 2 . 1 1 56 56 ALA H H 56 7.947 7.947 8.270 -0.323 25068
695 1 2 . 1 1 57 57 TRP N N 57 120.485 120.485 121.992 -1.507 25068
696 1 2 . 1 1 57 57 TRP HA H 57 3.940 3.940 4.500 -0.560 25068
697 1 2 . 1 1 57 57 TRP C C 57 178.537 178.537 178.986 -0.449 25068
698 1 2 . 1 1 57 57 TRP CA C 57 60.633 60.633 59.916 0.717 25068
699 1 2 . 1 1 57 57 TRP CB C 57 31.681 31.681 29.291 2.390 25068
700 1 2 . 1 1 57 57 TRP H H 57 8.910 8.910 8.281 0.629 25068
701 1 2 . 1 1 58 58 GLY N N 58 102.004 102.004 107.569 -5.565 25068
702 1 2 . 1 1 58 58 GLY C C 58 174.723 174.723 175.169 -0.446 25068
703 1 2 . 1 1 58 58 GLY CA C 58 47.091 47.091 46.459 0.632 25068
704 1 2 . 1 1 58 58 GLY H H 58 7.668 7.668 8.149 -0.481 25068
705 1 2 . 1 1 59 59 GLN N N 59 116.202 116.202 118.210 -2.008 25068
706 1 2 . 1 1 59 59 GLN HA H 59 4.259 4.259 4.086 0.173 25068
707 1 2 . 1 1 59 59 GLN C C 59 176.221 176.221 176.736 -0.515 25068
708 1 2 . 1 1 59 59 GLN CA C 59 55.967 55.967 56.352 -0.385 25068
709 1 2 . 1 1 59 59 GLN CB C 59 30.741 30.741 28.645 2.096 25068
710 1 2 . 1 1 59 59 GLN H H 59 7.189 7.189 7.891 -0.702 25068
711 1 2 . 1 1 60 60 LEU N N 60 120.776 120.776 121.277 -0.501 25068
712 1 2 . 1 1 60 60 LEU HA H 60 4.185 4.185 4.118 0.067 25068
713 1 2 . 1 1 60 60 LEU C C 60 177.372 177.372 176.211 1.161 25068
714 1 2 . 1 1 60 60 LEU CA C 60 56.061 56.061 55.940 0.122 25068
715 1 2 . 1 1 60 60 LEU CB C 60 43.696 43.696 42.607 1.089 25068
716 1 2 . 1 1 60 60 LEU H H 60 6.968 6.968 7.413 -0.445 25068
717 1 2 . 1 1 61 61 SER N N 61 120.432 120.432 114.876 5.556 25068
718 1 2 . 1 1 61 61 SER HA H 61 4.582 4.582 4.775 -0.193 25068
719 1 2 . 1 1 61 61 SER C C 61 173.500 173.500 173.697 -0.197 25068
720 1 2 . 1 1 61 61 SER CA C 61 57.204 57.204 55.918 1.286 25068
721 1 2 . 1 1 61 61 SER CB C 61 63.980 63.980 64.175 -0.195 25068
722 1 2 . 1 1 61 61 SER H H 61 8.885 8.885 8.183 0.702 25068
723 1 2 . 1 1 63 63 ALA HA H 63 4.089 4.089 4.130 -0.041 25068
724 1 2 . 1 1 63 63 ALA C C 63 180.570 180.570 178.867 1.703 25068
725 1 2 . 1 1 63 63 ALA CA C 63 56.005 56.005 54.680 1.325 25068
726 1 2 . 1 1 63 63 ALA CB C 63 19.317 19.317 18.257 1.060 25068
727 1 2 . 1 1 64 64 GLN N N 64 116.774 116.774 117.159 -0.385 25068
728 1 2 . 1 1 64 64 GLN HA H 64 4.122 4.122 4.127 -0.005 25068
729 1 2 . 1 1 64 64 GLN C C 64 178.275 178.275 178.049 0.226 25068
730 1 2 . 1 1 64 64 GLN CA C 64 58.622 58.622 57.772 0.850 25068
731 1 2 . 1 1 64 64 GLN CB C 64 31.350 31.350 28.652 2.698 25068
732 1 2 . 1 1 64 64 GLN H H 64 7.603 7.603 8.052 -0.449 25068
733 1 2 . 1 1 65 65 LYS N N 65 117.203 117.203 120.629 -3.426 25068
734 1 2 . 1 1 65 65 LYS HA H 65 4.129 4.129 4.063 0.066 25068
735 1 2 . 1 1 65 65 LYS C C 65 178.449 178.449 178.765 -0.316 25068
736 1 2 . 1 1 65 65 LYS CA C 65 59.891 59.891 59.518 0.373 25068
737 1 2 . 1 1 65 65 LYS CB C 65 34.351 34.351 32.462 1.889 25068
738 1 2 . 1 1 65 65 LYS H H 65 7.810 7.810 7.835 -0.025 25068
739 1 2 . 1 1 66 66 ALA N N 66 122.218 122.218 122.400 -0.182 25068
740 1 2 . 1 1 66 66 ALA HA H 66 4.290 4.290 4.234 0.056 25068
741 1 2 . 1 1 66 66 ALA C C 66 176.135 176.135 176.641 -0.506 25068
742 1 2 . 1 1 66 66 ALA CA C 66 57.745 57.745 56.816 0.929 25068
743 1 2 . 1 1 66 66 ALA CB C 66 17.033 17.033 16.330 0.703 25068
744 1 2 . 1 1 66 66 ALA H H 66 7.469 7.469 8.229 -0.760 25068
745 1 2 . 1 1 67 67 PRO HA H 67 4.142 4.142 4.365 -0.223 25068
746 1 2 . 1 1 67 67 PRO C C 67 179.591 179.591 179.021 0.570 25068
747 1 2 . 1 1 67 67 PRO CA C 67 66.960 66.960 65.685 1.275 25068
748 1 2 . 1 1 67 67 PRO CB C 67 32.014 32.014 31.483 0.531 25068
749 1 2 . 1 1 68 68 TYR N N 68 117.140 117.140 119.459 -2.319 25068
750 1 2 . 1 1 68 68 TYR HA H 68 3.940 3.940 3.934 0.006 25068
751 1 2 . 1 1 68 68 TYR C C 68 177.733 177.733 178.812 -1.079 25068
752 1 2 . 1 1 68 68 TYR CA C 68 63.505 63.505 61.233 2.272 25068
753 1 2 . 1 1 68 68 TYR CB C 68 38.503 38.503 37.222 1.281 25068
754 1 2 . 1 1 68 68 TYR H H 68 7.268 7.268 8.361 -1.093 25068
755 1 2 . 1 1 69 69 GLU N N 69 120.747 120.747 118.637 2.110 25068
756 1 2 . 1 1 69 69 GLU HA H 69 4.253 4.253 4.320 -0.067 25068
757 1 2 . 1 1 69 69 GLU C C 69 179.805 179.805 179.221 0.584 25068
758 1 2 . 1 1 69 69 GLU CA C 69 60.145 60.145 59.460 0.685 25068
759 1 2 . 1 1 69 69 GLU CB C 69 29.808 29.808 29.390 0.418 25068
760 1 2 . 1 1 69 69 GLU H H 69 8.048 8.048 8.663 -0.615 25068
761 1 2 . 1 1 70 70 LYS N N 70 120.938 120.938 120.787 0.151 25068
762 1 2 . 1 1 70 70 LYS HA H 70 4.020 4.020 3.968 0.052 25068
763 1 2 . 1 1 70 70 LYS C C 70 178.740 178.740 179.325 -0.585 25068
764 1 2 . 1 1 70 70 LYS CA C 70 60.202 60.202 59.978 0.224 25068
765 1 2 . 1 1 70 70 LYS CB C 70 32.419 32.419 32.435 -0.016 25068
766 1 2 . 1 1 70 70 LYS H H 70 8.301 8.301 8.159 0.142 25068
767 1 2 . 1 1 71 71 LYS N N 71 118.427 118.427 118.426 0.001 25068
768 1 2 . 1 1 71 71 LYS HA H 71 3.528 3.528 4.095 -0.567 25068
769 1 2 . 1 1 71 71 LYS C C 71 179.280 179.280 178.729 0.551 25068
770 1 2 . 1 1 71 71 LYS CA C 71 61.146 61.146 59.002 2.144 25068
771 1 2 . 1 1 71 71 LYS CB C 71 32.196 32.196 31.859 0.337 25068
772 1 2 . 1 1 71 71 LYS H H 71 7.234 7.234 8.332 -1.098 25068
773 1 2 . 1 1 72 72 ALA N N 72 122.126 122.126 122.201 -0.075 25068
774 1 2 . 1 1 72 72 ALA HA H 72 4.357 4.357 4.020 0.337 25068
775 1 2 . 1 1 72 72 ALA C C 72 180.468 180.468 179.898 0.570 25068
776 1 2 . 1 1 72 72 ALA CA C 72 56.457 56.457 55.258 1.199 25068
777 1 2 . 1 1 72 72 ALA CB C 72 19.562 19.562 18.142 1.420 25068
778 1 2 . 1 1 72 72 ALA H H 72 7.890 7.890 7.929 -0.039 25068
779 1 2 . 1 1 73 73 GLN N N 73 121.659 121.659 119.032 2.627 25068
780 1 2 . 1 1 73 73 GLN HA H 73 4.029 4.029 4.051 -0.022 25068
781 1 2 . 1 1 73 73 GLN C C 73 179.576 179.576 178.306 1.270 25068
782 1 2 . 1 1 73 73 GLN CA C 73 60.427 60.427 59.060 1.367 25068
783 1 2 . 1 1 73 73 GLN CB C 73 28.732 28.732 28.806 -0.074 25068
784 1 2 . 1 1 73 73 GLN H H 73 8.353 8.353 8.223 0.130 25068
785 1 2 . 1 1 74 74 LEU N N 74 119.752 119.752 120.444 -0.692 25068
786 1 2 . 1 1 74 74 LEU HA H 74 4.046 4.046 3.851 0.195 25068
787 1 2 . 1 1 74 74 LEU C C 74 180.424 180.424 179.404 1.020 25068
788 1 2 . 1 1 74 74 LEU CA C 74 58.675 58.675 57.916 0.759 25068
789 1 2 . 1 1 74 74 LEU CB C 74 42.376 42.376 41.663 0.713 25068
790 1 2 . 1 1 74 74 LEU H H 74 8.160 8.160 8.242 -0.082 25068
791 1 2 . 1 1 75 75 ASP N N 75 122.159 122.159 118.373 3.786 25068
792 1 2 . 1 1 75 75 ASP HA H 75 4.988 4.988 4.389 0.599 25068
793 1 2 . 1 1 75 75 ASP C C 75 178.046 178.046 178.508 -0.462 25068
794 1 2 . 1 1 75 75 ASP CA C 75 58.191 58.191 57.533 0.658 25068
795 1 2 . 1 1 75 75 ASP CB C 75 42.958 42.958 40.143 2.815 25068
796 1 2 . 1 1 75 75 ASP H H 75 8.361 8.361 8.626 -0.265 25068
797 1 2 . 1 1 76 76 LYS N N 76 119.861 119.861 121.437 -1.576 25068
798 1 2 . 1 1 76 76 LYS HA H 76 3.988 3.988 4.054 -0.066 25068
799 1 2 . 1 1 76 76 LYS C C 76 179.668 179.668 178.694 0.974 25068
800 1 2 . 1 1 76 76 LYS CA C 76 60.984 60.984 60.058 0.926 25068
801 1 2 . 1 1 76 76 LYS CB C 76 33.124 33.124 32.562 0.562 25068
802 1 2 . 1 1 76 76 LYS H H 76 7.940 7.940 7.802 0.138 25068
803 1 2 . 1 1 77 77 VAL N N 77 121.485 121.485 119.141 2.344 25068
804 1 2 . 1 1 77 77 VAL HA H 77 3.687 3.687 3.702 -0.015 25068
805 1 2 . 1 1 77 77 VAL C C 77 178.070 178.070 177.702 0.368 25068
806 1 2 . 1 1 77 77 VAL CA C 77 67.359 67.359 65.558 1.802 25068
807 1 2 . 1 1 77 77 VAL CB C 77 32.645 32.645 31.697 0.948 25068
808 1 2 . 1 1 77 77 VAL H H 77 7.401 7.401 8.457 -1.056 25068
809 1 2 . 1 1 78 78 ARG N N 78 121.960 121.960 120.211 1.749 25068
810 1 2 . 1 1 78 78 ARG HA H 78 4.010 4.010 3.985 0.025 25068
811 1 2 . 1 1 78 78 ARG C C 78 179.144 179.144 178.584 0.560 25068
812 1 2 . 1 1 78 78 ARG CA C 78 60.598 60.598 60.000 0.598 25068
813 1 2 . 1 1 78 78 ARG CB C 78 28.352 28.352 30.053 -1.701 25068
814 1 2 . 1 1 78 78 ARG H H 78 7.813 7.813 8.123 -0.310 25068
815 1 2 . 1 1 79 79 TYR N N 79 120.411 120.411 120.823 -0.412 25068
816 1 2 . 1 1 79 79 TYR HA H 79 3.878 3.878 4.225 -0.347 25068
817 1 2 . 1 1 79 79 TYR C C 79 176.080 176.080 177.356 -1.276 25068
818 1 2 . 1 1 79 79 TYR CA C 79 63.669 63.669 59.608 4.061 25068
819 1 2 . 1 1 79 79 TYR CB C 79 39.758 39.758 38.241 1.517 25068
820 1 2 . 1 1 79 79 TYR H H 79 8.608 8.608 8.598 0.010 25068
821 1 2 . 1 1 80 80 SER N N 80 113.726 113.726 114.300 -0.574 25068
822 1 2 . 1 1 80 80 SER HA H 80 3.880 3.880 3.733 0.147 25068
823 1 2 . 1 1 80 80 SER C C 80 176.794 176.794 176.878 -0.084 25068
824 1 2 . 1 1 80 80 SER CA C 80 62.969 62.969 62.055 0.914 25068
825 1 2 . 1 1 80 80 SER CB C 80 63.605 63.605 62.948 0.657 25068
826 1 2 . 1 1 80 80 SER H H 80 8.234 8.234 8.251 -0.017 25068
827 1 2 . 1 1 81 81 LYS N N 81 121.920 121.920 120.676 1.244 25068
828 1 2 . 1 1 81 81 LYS HA H 81 4.029 4.029 3.979 0.050 25068
829 1 2 . 1 1 81 81 LYS C C 81 179.342 179.342 178.863 0.479 25068
830 1 2 . 1 1 81 81 LYS CA C 81 60.138 60.138 59.091 1.047 25068
831 1 2 . 1 1 81 81 LYS CB C 81 33.238 33.238 32.154 1.084 25068
832 1 2 . 1 1 81 81 LYS H H 81 7.958 7.958 7.922 0.036 25068
833 1 2 . 1 1 82 82 GLU N N 82 119.515 119.515 119.909 -0.394 25068
834 1 2 . 1 1 82 82 GLU HA H 82 3.945 3.945 4.043 -0.098 25068
835 1 2 . 1 1 82 82 GLU C C 82 180.689 180.689 179.046 1.643 25068
836 1 2 . 1 1 82 82 GLU CA C 82 60.920 60.920 59.495 1.425 25068
837 1 2 . 1 1 82 82 GLU CB C 82 30.885 30.885 29.572 1.313 25068
838 1 2 . 1 1 82 82 GLU H H 82 8.310 8.310 7.958 0.352 25068
839 1 2 . 1 1 83 83 ILE N N 83 121.362 121.362 120.047 1.315 25068
840 1 2 . 1 1 83 83 ILE HA H 83 3.889 3.889 3.692 0.197 25068
841 1 2 . 1 1 83 83 ILE C C 83 177.207 177.207 177.698 -0.491 25068
842 1 2 . 1 1 83 83 ILE CA C 83 62.754 62.754 63.847 -1.093 25068
843 1 2 . 1 1 83 83 ILE CB C 83 37.651 37.651 37.783 -0.132 25068
844 1 2 . 1 1 83 83 ILE H H 83 8.887 8.887 7.967 0.920 25068
845 1 2 . 1 1 84 84 GLU N N 84 122.327 122.327 120.089 2.238 25068
846 1 2 . 1 1 84 84 GLU HA H 84 4.028 4.028 3.891 0.137 25068
847 1 2 . 1 1 84 84 GLU C C 84 179.047 179.047 179.309 -0.262 25068
848 1 2 . 1 1 84 84 GLU CA C 84 60.045 60.045 60.097 -0.052 25068
849 1 2 . 1 1 84 84 GLU CB C 84 30.099 30.099 29.069 1.030 25068
850 1 2 . 1 1 84 84 GLU H H 84 7.289 7.289 8.127 -0.838 25068
851 1 2 . 1 1 85 85 GLU N N 85 118.046 118.046 119.567 -1.521 25068
852 1 2 . 1 1 85 85 GLU HA H 85 3.966 3.966 4.060 -0.094 25068
853 1 2 . 1 1 85 85 GLU C C 85 178.614 178.614 179.379 -0.765 25068
854 1 2 . 1 1 85 85 GLU CA C 85 59.997 59.997 59.365 0.632 25068
855 1 2 . 1 1 85 85 GLU CB C 85 30.453 30.453 29.785 0.668 25068
856 1 2 . 1 1 85 85 GLU H H 85 7.545 7.545 8.162 -0.617 25068
857 1 2 . 1 1 86 86 TYR N N 86 121.050 121.050 119.086 1.964 25068
858 1 2 . 1 1 86 86 TYR HA H 86 4.094 4.094 4.268 -0.174 25068
859 1 2 . 1 1 86 86 TYR C C 86 177.815 177.815 178.197 -0.382 25068
860 1 2 . 1 1 86 86 TYR CA C 86 62.072 62.072 61.821 0.251 25068
861 1 2 . 1 1 86 86 TYR CB C 86 39.954 39.954 38.306 1.648 25068
862 1 2 . 1 1 86 86 TYR H H 86 8.277 8.277 8.363 -0.086 25068
863 1 2 . 1 1 87 87 ARG N N 87 118.353 118.353 118.010 0.343 25068
864 1 2 . 1 1 87 87 ARG HA H 87 3.877 3.877 3.983 -0.106 25068
865 1 2 . 1 1 87 87 ARG C C 87 178.067 178.067 178.867 -0.800 25068
866 1 2 . 1 1 87 87 ARG CA C 87 59.513 59.513 59.045 0.468 25068
867 1 2 . 1 1 87 87 ARG CB C 87 31.053 31.053 30.175 0.878 25068
868 1 2 . 1 1 87 87 ARG H H 87 8.249 8.249 8.485 -0.236 25068
869 1 2 . 1 1 88 88 LYS N N 88 118.205 118.205 119.435 -1.230 25068
870 1 2 . 1 1 88 88 LYS HA H 88 3.982 3.982 4.116 -0.134 25068
871 1 2 . 1 1 88 88 LYS C C 88 178.050 178.050 177.834 0.216 25068
872 1 2 . 1 1 88 88 LYS CA C 88 59.265 59.265 58.620 0.645 25068
873 1 2 . 1 1 88 88 LYS CB C 88 33.499 33.499 32.497 1.002 25068
874 1 2 . 1 1 88 88 LYS H H 88 7.465 7.465 7.917 -0.452 25068
875 1 2 . 1 1 89 89 LYS N N 89 118.341 118.341 115.771 2.570 25068
876 1 2 . 1 1 89 89 LYS HA H 89 4.084 4.084 4.467 -0.383 25068
877 1 2 . 1 1 89 89 LYS C C 89 176.691 176.691 175.856 0.835 25068
878 1 2 . 1 1 89 89 LYS CA C 89 58.188 58.188 55.459 2.729 25068
879 1 2 . 1 1 89 89 LYS CB C 89 33.809 33.809 32.414 1.395 25068
880 1 2 . 1 1 89 89 LYS H H 89 7.580 7.580 7.730 -0.150 25068
881 1 2 . 1 1 90 90 ASN N N 90 117.604 117.604 119.659 -2.055 25068
882 1 2 . 1 1 90 90 ASN HA H 90 4.563 4.563 4.898 -0.335 25068
883 1 2 . 1 1 90 90 ASN C C 90 174.419 174.419 174.271 0.148 25068
884 1 2 . 1 1 90 90 ASN CA C 90 54.433 54.433 52.442 1.991 25068
885 1 2 . 1 1 90 90 ASN CB C 90 40.182 40.182 40.713 -0.531 25068
886 1 2 . 1 1 90 90 ASN H H 90 7.741 7.741 7.776 -0.035 25068
887 1 2 . 1 1 91 91 GLN N N 91 111.990 111.990 120.101 -8.111 25068
888 1 2 . 1 1 91 91 GLN HA H 91 4.213 4.213 4.574 -0.361 25068
889 1 2 . 1 1 91 91 GLN C C 91 174.970 174.970 175.784 -0.814 25068
890 1 2 . 1 1 91 91 GLN CA C 91 57.011 57.011 55.540 1.471 25068
891 1 2 . 1 1 91 91 GLN CB C 91 30.358 30.358 29.565 0.793 25068
892 1 2 . 1 1 91 91 GLN H H 91 7.925 7.925 8.431 -0.506 25068
893 1 3 . 1 1 14 14 PRO HA H 14 4.322 4.322 4.411 -0.089 25068
894 1 3 . 1 1 14 14 PRO C C 14 176.783 176.783 177.044 -0.261 25068
895 1 3 . 1 1 14 14 PRO CA C 14 64.643 64.643 63.766 0.877 25068
896 1 3 . 1 1 14 14 PRO CB C 14 33.114 33.114 32.227 0.887 25068
897 1 3 . 1 1 15 15 LEU N N 15 120.158 120.158 117.481 2.677 25068
898 1 3 . 1 1 15 15 LEU HA H 15 4.238 4.238 4.615 -0.377 25068
899 1 3 . 1 1 15 15 LEU C C 15 176.361 176.361 175.792 0.569 25068
900 1 3 . 1 1 15 15 LEU CA C 15 55.395 55.395 53.854 1.541 25068
901 1 3 . 1 1 15 15 LEU CB C 15 42.619 42.619 41.977 0.642 25068
902 1 3 . 1 1 15 15 LEU H H 15 8.189 8.189 7.781 0.408 25068
903 1 3 . 1 1 16 16 ALA N N 16 124.269 124.269 123.162 1.107 25068
904 1 3 . 1 1 16 16 ALA HA H 16 3.496 3.496 4.751 -1.255 25068
905 1 3 . 1 1 16 16 ALA C C 16 175.124 175.124 175.468 -0.344 25068
906 1 3 . 1 1 16 16 ALA CA C 16 51.457 51.457 50.127 1.330 25068
907 1 3 . 1 1 16 16 ALA CB C 16 18.105 18.105 19.076 -0.972 25068
908 1 3 . 1 1 16 16 ALA H H 16 7.500 7.500 7.566 -0.066 25068
909 1 3 . 1 1 17 17 PRO HA H 17 4.157 4.157 4.290 -0.133 25068
910 1 3 . 1 1 17 17 PRO C C 17 176.396 176.396 175.904 0.492 25068
911 1 3 . 1 1 17 17 PRO CA C 17 63.588 63.588 61.981 1.607 25068
912 1 3 . 1 1 17 17 PRO CB C 17 32.850 32.850 32.183 0.667 25068
913 1 3 . 1 1 18 18 LYS N N 18 124.070 124.070 121.737 2.333 25068
914 1 3 . 1 1 18 18 LYS HA H 18 4.147 4.147 4.176 -0.029 25068
915 1 3 . 1 1 18 18 LYS C C 18 177.543 177.543 176.201 1.342 25068
916 1 3 . 1 1 18 18 LYS CA C 18 57.081 57.081 56.942 0.139 25068
917 1 3 . 1 1 18 18 LYS CB C 18 33.573 33.573 32.965 0.608 25068
918 1 3 . 1 1 18 18 LYS H H 18 8.886 8.886 8.446 0.440 25068
919 1 3 . 1 1 19 19 ARG N N 19 122.242 122.242 120.354 1.888 25068
920 1 3 . 1 1 19 19 ARG HA H 19 3.437 3.437 4.580 -1.143 25068
921 1 3 . 1 1 19 19 ARG C C 19 175.409 175.409 174.340 1.069 25068
922 1 3 . 1 1 19 19 ARG CA C 19 57.545 57.545 55.568 1.977 25068
923 1 3 . 1 1 19 19 ARG CB C 19 31.149 31.149 30.718 0.431 25068
924 1 3 . 1 1 19 19 ARG H H 19 8.286 8.286 8.254 0.032 25068
925 1 3 . 1 1 20 20 ALA N N 20 123.176 123.176 123.089 0.087 25068
926 1 3 . 1 1 20 20 ALA HA H 20 4.139 4.139 4.671 -0.532 25068
927 1 3 . 1 1 20 20 ALA C C 20 177.843 177.843 176.751 1.092 25068
928 1 3 . 1 1 20 20 ALA CA C 20 52.391 52.391 51.264 1.127 25068
929 1 3 . 1 1 20 20 ALA CB C 20 19.397 19.397 20.004 -0.607 25068
930 1 3 . 1 1 20 20 ALA H H 20 7.348 7.348 8.402 -1.054 25068
931 1 3 . 1 1 21 21 LEU N N 21 125.680 125.680 122.483 3.197 25068
932 1 3 . 1 1 21 21 LEU HA H 21 4.194 4.194 4.203 -0.009 25068
933 1 3 . 1 1 21 21 LEU C C 21 177.091 177.091 176.684 0.407 25068
934 1 3 . 1 1 21 21 LEU CA C 21 55.472 55.472 54.847 0.625 25068
935 1 3 . 1 1 21 21 LEU CB C 21 43.931 43.931 43.020 0.911 25068
936 1 3 . 1 1 21 21 LEU H H 21 9.055 9.055 8.211 0.844 25068
937 1 3 . 1 1 22 22 SER N N 22 116.686 116.686 114.058 2.628 25068
938 1 3 . 1 1 22 22 SER HA H 22 4.427 4.427 4.568 -0.141 25068
939 1 3 . 1 1 22 22 SER C C 22 174.241 174.241 175.616 -1.375 25068
940 1 3 . 1 1 22 22 SER CA C 22 57.564 57.564 56.588 0.976 25068
941 1 3 . 1 1 22 22 SER CB C 22 66.568 66.568 65.395 1.173 25068
942 1 3 . 1 1 22 22 SER H H 22 7.549 7.549 8.048 -0.499 25068
943 1 3 . 1 1 23 23 ALA N N 23 123.382 123.382 125.309 -1.927 25068
944 1 3 . 1 1 23 23 ALA HA H 23 4.163 4.163 4.160 0.003 25068
945 1 3 . 1 1 23 23 ALA C C 23 178.863 178.863 179.456 -0.593 25068
946 1 3 . 1 1 23 23 ALA CA C 23 57.124 57.124 55.051 2.073 25068
947 1 3 . 1 1 23 23 ALA CB C 23 19.441 19.441 18.262 1.179 25068
948 1 3 . 1 1 23 23 ALA H H 23 9.035 9.035 8.862 0.173 25068
949 1 3 . 1 1 24 24 TYR N N 24 115.979 115.979 118.698 -2.719 25068
950 1 3 . 1 1 24 24 TYR HA H 24 2.590 2.590 4.542 -1.952 25068
951 1 3 . 1 1 24 24 TYR C C 24 176.257 176.257 178.262 -2.005 25068
952 1 3 . 1 1 24 24 TYR CA C 24 60.940 60.940 61.733 -0.793 25068
953 1 3 . 1 1 24 24 TYR CB C 24 39.106 39.106 37.931 1.175 25068
954 1 3 . 1 1 24 24 TYR H H 24 8.206 8.206 8.142 0.064 25068
955 1 3 . 1 1 25 25 MET N N 25 116.391 116.391 117.571 -1.180 25068
956 1 3 . 1 1 25 25 MET HA H 25 3.643 3.643 4.185 -0.542 25068
957 1 3 . 1 1 25 25 MET C C 25 180.177 180.177 178.381 1.796 25068
958 1 3 . 1 1 25 25 MET CA C 25 59.161 59.161 57.969 1.192 25068
959 1 3 . 1 1 25 25 MET CB C 25 32.748 32.748 32.350 0.398 25068
960 1 3 . 1 1 25 25 MET H H 25 7.433 7.433 7.819 -0.386 25068
961 1 3 . 1 1 26 26 PHE N N 26 118.699 118.699 121.122 -2.423 25068
962 1 3 . 1 1 26 26 PHE HA H 26 4.063 4.063 4.109 -0.046 25068
963 1 3 . 1 1 26 26 PHE C C 26 178.055 178.055 177.168 0.887 25068
964 1 3 . 1 1 26 26 PHE CA C 26 64.840 64.840 61.633 3.207 25068
965 1 3 . 1 1 26 26 PHE CB C 26 40.437 40.437 38.861 1.576 25068
966 1 3 . 1 1 26 26 PHE H H 26 7.982 7.982 8.789 -0.807 25068
967 1 3 . 1 1 27 27 TYR N N 27 123.888 123.888 120.063 3.825 25068
968 1 3 . 1 1 27 27 TYR HA H 27 3.576 3.576 3.999 -0.423 25068
969 1 3 . 1 1 27 27 TYR C C 27 176.691 176.691 177.475 -0.784 25068
970 1 3 . 1 1 27 27 TYR CA C 27 62.831 62.831 61.010 1.821 25068
971 1 3 . 1 1 27 27 TYR CB C 27 39.238 39.238 38.289 0.949 25068
972 1 3 . 1 1 27 27 TYR H H 27 7.843 7.843 8.622 -0.779 25068
973 1 3 . 1 1 28 28 VAL N N 28 119.501 119.501 115.310 4.191 25068
974 1 3 . 1 1 28 28 VAL HA H 28 2.912 2.912 3.151 -0.239 25068
975 1 3 . 1 1 28 28 VAL C C 28 177.067 177.067 177.685 -0.618 25068
976 1 3 . 1 1 28 28 VAL CA C 28 67.149 67.149 66.566 0.583 25068
977 1 3 . 1 1 28 28 VAL CB C 28 32.599 32.599 31.181 1.418 25068
978 1 3 . 1 1 28 28 VAL H H 28 8.370 8.370 7.624 0.746 25068
979 1 3 . 1 1 29 29 LYS N N 29 114.512 114.512 120.735 -6.223 25068
980 1 3 . 1 1 29 29 LYS HA H 29 3.676 3.676 3.823 -0.147 25068
981 1 3 . 1 1 29 29 LYS C C 29 178.627 178.627 178.969 -0.342 25068
982 1 3 . 1 1 29 29 LYS CA C 29 60.349 60.349 59.932 0.417 25068
983 1 3 . 1 1 29 29 LYS CB C 29 33.278 33.278 32.058 1.220 25068
984 1 3 . 1 1 29 29 LYS H H 29 6.821 6.821 8.266 -1.445 25068
985 1 3 . 1 1 30 30 ASP N N 30 116.793 116.793 119.685 -2.892 25068
986 1 3 . 1 1 30 30 ASP HA H 30 4.466 4.466 4.257 0.209 25068
987 1 3 . 1 1 30 30 ASP C C 30 178.615 178.615 178.534 0.081 25068
988 1 3 . 1 1 30 30 ASP CA C 30 57.223 57.223 57.089 0.134 25068
989 1 3 . 1 1 30 30 ASP CB C 30 42.066 42.066 40.170 1.896 25068
990 1 3 . 1 1 30 30 ASP H H 30 6.875 6.875 7.975 -1.100 25068
991 1 3 . 1 1 31 31 LYS N N 31 122.423 122.423 119.982 2.441 25068
992 1 3 . 1 1 31 31 LYS HA H 31 3.813 3.813 3.824 -0.011 25068
993 1 3 . 1 1 31 31 LYS C C 31 178.443 178.443 178.850 -0.407 25068
994 1 3 . 1 1 31 31 LYS CA C 31 57.494 57.494 59.354 -1.860 25068
995 1 3 . 1 1 31 31 LYS CB C 31 32.539 32.539 32.249 0.290 25068
996 1 3 . 1 1 31 31 LYS H H 31 8.910 8.910 7.835 1.075 25068
997 1 3 . 1 1 32 32 ARG N N 32 117.823 117.823 119.279 -1.456 25068
998 1 3 . 1 1 32 32 ARG HA H 32 3.540 3.540 3.969 -0.429 25068
999 1 3 . 1 1 32 32 ARG C C 32 176.951 176.951 178.709 -1.758 25068
1000 1 3 . 1 1 32 32 ARG CA C 32 61.259 61.259 59.444 1.815 25068
1001 1 3 . 1 1 32 32 ARG CB C 32 30.668 30.668 30.055 0.613 25068
1002 1 3 . 1 1 32 32 ARG H H 32 8.501 8.501 8.018 0.483 25068
1003 1 3 . 1 1 33 33 LEU N N 33 114.878 114.878 120.080 -5.202 25068
1004 1 3 . 1 1 33 33 LEU HA H 33 3.871 3.871 3.819 0.052 25068
1005 1 3 . 1 1 33 33 LEU C C 33 179.180 179.180 179.311 -0.131 25068
1006 1 3 . 1 1 33 33 LEU CA C 33 58.377 58.377 57.988 0.389 25068
1007 1 3 . 1 1 33 33 LEU CB C 33 42.429 42.429 41.627 0.802 25068
1008 1 3 . 1 1 33 33 LEU H H 33 6.549 6.549 8.223 -1.674 25068
1009 1 3 . 1 1 34 34 GLU N N 34 118.637 118.637 119.268 -0.631 25068
1010 1 3 . 1 1 34 34 GLU HA H 34 3.866 3.866 3.991 -0.125 25068
1011 1 3 . 1 1 34 34 GLU C C 34 178.988 178.988 179.248 -0.260 25068
1012 1 3 . 1 1 34 34 GLU CA C 34 60.248 60.248 59.417 0.831 25068
1013 1 3 . 1 1 34 34 GLU CB C 34 31.325 31.325 29.429 1.896 25068
1014 1 3 . 1 1 34 34 GLU H H 34 7.135 7.135 7.990 -0.855 25068
1015 1 3 . 1 1 35 35 ILE N N 35 119.142 119.142 119.889 -0.747 25068
1016 1 3 . 1 1 35 35 ILE HA H 35 3.693 3.693 3.702 -0.009 25068
1017 1 3 . 1 1 35 35 ILE C C 35 177.789 177.789 178.872 -1.083 25068
1018 1 3 . 1 1 35 35 ILE CA C 35 65.753 65.753 65.499 0.254 25068
1019 1 3 . 1 1 35 35 ILE CB C 35 38.940 38.940 37.847 1.093 25068
1020 1 3 . 1 1 35 35 ILE H H 35 8.076 8.076 8.192 -0.116 25068
1021 1 3 . 1 1 36 36 ILE N N 36 116.296 116.296 117.141 -0.845 25068
1022 1 3 . 1 1 36 36 ILE HA H 36 3.640 3.640 4.017 -0.377 25068
1023 1 3 . 1 1 36 36 ILE C C 36 177.270 177.270 177.223 0.047 25068
1024 1 3 . 1 1 36 36 ILE CA C 36 64.633 64.633 63.299 1.334 25068
1025 1 3 . 1 1 36 36 ILE CB C 36 38.718 38.718 37.939 0.779 25068
1026 1 3 . 1 1 36 36 ILE H H 36 7.754 7.754 8.061 -0.307 25068
1027 1 3 . 1 1 37 37 LYS N N 37 119.626 119.626 119.908 -0.282 25068
1028 1 3 . 1 1 37 37 LYS HA H 37 3.922 3.922 4.134 -0.212 25068
1029 1 3 . 1 1 37 37 LYS C C 37 178.129 178.129 177.470 0.659 25068
1030 1 3 . 1 1 37 37 LYS CA C 37 59.996 59.996 58.680 1.316 25068
1031 1 3 . 1 1 37 37 LYS CB C 37 33.487 33.487 33.033 0.454 25068
1032 1 3 . 1 1 37 37 LYS H H 37 7.413 7.413 7.890 -0.477 25068
1033 1 3 . 1 1 38 38 GLU N N 38 116.708 116.708 116.030 0.678 25068
1034 1 3 . 1 1 38 38 GLU HA H 38 4.060 4.060 4.322 -0.262 25068
1035 1 3 . 1 1 38 38 GLU C C 38 177.004 177.004 177.230 -0.226 25068
1036 1 3 . 1 1 38 38 GLU CA C 38 59.070 59.070 57.251 1.819 25068
1037 1 3 . 1 1 38 38 GLU CB C 38 31.665 31.665 30.828 0.837 25068
1038 1 3 . 1 1 38 38 GLU H H 38 7.354 7.354 8.088 -0.734 25068
1039 1 3 . 1 1 39 39 LYS N N 39 118.621 118.621 119.944 -1.323 25068
1040 1 3 . 1 1 39 39 LYS HA H 39 4.690 4.690 4.767 -0.077 25068
1041 1 3 . 1 1 39 39 LYS C C 39 172.792 172.792 174.753 -1.961 25068
1042 1 3 . 1 1 39 39 LYS CA C 39 54.596 54.596 53.116 1.480 25068
1043 1 3 . 1 1 39 39 LYS CB C 39 33.945 33.945 33.423 0.521 25068
1044 1 3 . 1 1 39 39 LYS H H 39 8.176 8.176 7.796 0.380 25068
1045 1 3 . 1 1 40 40 PRO HA H 40 4.429 4.429 4.323 0.106 25068
1046 1 3 . 1 1 40 40 PRO C C 40 179.829 179.829 178.658 1.171 25068
1047 1 3 . 1 1 40 40 PRO CA C 40 66.040 66.040 64.726 1.314 25068
1048 1 3 . 1 1 40 40 PRO CB C 40 32.606 32.606 31.927 0.678 25068
1049 1 3 . 1 1 41 41 GLU N N 41 119.150 119.150 120.495 -1.345 25068
1050 1 3 . 1 1 41 41 GLU HA H 41 4.143 4.143 4.176 -0.033 25068
1051 1 3 . 1 1 41 41 GLU C C 41 178.502 178.502 177.422 1.080 25068
1052 1 3 . 1 1 41 41 GLU CA C 41 59.485 59.485 58.998 0.487 25068
1053 1 3 . 1 1 41 41 GLU CB C 41 28.574 28.574 29.203 -0.629 25068
1054 1 3 . 1 1 41 41 GLU H H 41 9.789 9.789 8.731 1.058 25068
1055 1 3 . 1 1 42 42 LEU N N 42 121.443 121.443 118.980 2.463 25068
1056 1 3 . 1 1 42 42 LEU HA H 42 4.185 4.185 4.435 -0.250 25068
1057 1 3 . 1 1 42 42 LEU C C 42 177.815 177.815 177.677 0.138 25068
1058 1 3 . 1 1 42 42 LEU CA C 42 56.730 56.730 54.459 2.271 25068
1059 1 3 . 1 1 42 42 LEU CB C 42 42.013 42.013 41.539 0.473 25068
1060 1 3 . 1 1 42 42 LEU H H 42 8.312 8.312 7.614 0.698 25068
1061 1 3 . 1 1 43 43 ALA N N 43 119.949 119.949 122.317 -2.368 25068
1062 1 3 . 1 1 43 43 ALA HA H 43 3.746 3.746 4.069 -0.323 25068
1063 1 3 . 1 1 43 43 ALA C C 43 178.635 178.635 178.041 0.594 25068
1064 1 3 . 1 1 43 43 ALA CA C 43 56.164 56.164 54.278 1.886 25068
1065 1 3 . 1 1 43 43 ALA CB C 43 19.670 19.670 18.705 0.965 25068
1066 1 3 . 1 1 43 43 ALA H H 43 7.554 7.554 7.302 0.252 25068
1067 1 3 . 1 1 44 44 LYS N N 44 112.690 112.690 116.633 -3.943 25068
1068 1 3 . 1 1 44 44 LYS HA H 44 4.232 4.232 4.412 -0.180 25068
1069 1 3 . 1 1 44 44 LYS C C 44 175.949 175.949 175.800 0.149 25068
1070 1 3 . 1 1 44 44 LYS CA C 44 56.987 56.987 55.650 1.337 25068
1071 1 3 . 1 1 44 44 LYS CB C 44 33.345 33.345 32.008 1.337 25068
1072 1 3 . 1 1 44 44 LYS H H 44 7.560 7.560 7.783 -0.223 25068
1073 1 3 . 1 1 45 45 ASP N N 45 122.529 122.529 121.706 0.823 25068
1074 1 3 . 1 1 45 45 ASP HA H 45 4.749 4.749 4.869 -0.120 25068
1075 1 3 . 1 1 45 45 ASP C C 45 174.677 174.677 175.907 -1.230 25068
1076 1 3 . 1 1 45 45 ASP CA C 45 53.030 53.030 52.329 0.701 25068
1077 1 3 . 1 1 45 45 ASP CB C 45 41.549 41.549 40.638 0.911 25068
1078 1 3 . 1 1 45 45 ASP H H 45 7.672 7.672 7.931 -0.259 25068
1079 1 3 . 1 1 46 46 VAL N N 46 121.529 121.529 123.459 -1.930 25068
1080 1 3 . 1 1 46 46 VAL HA H 46 3.639 3.639 3.594 0.045 25068
1081 1 3 . 1 1 46 46 VAL C C 46 179.102 179.102 177.259 1.843 25068
1082 1 3 . 1 1 46 46 VAL CA C 46 66.430 66.430 66.046 0.383 25068
1083 1 3 . 1 1 46 46 VAL CB C 46 32.650 32.650 31.764 0.886 25068
1084 1 3 . 1 1 46 46 VAL H H 46 7.808 7.808 8.270 -0.462 25068
1085 1 3 . 1 1 47 47 ALA N N 47 123.933 123.933 121.022 2.911 25068
1086 1 3 . 1 1 47 47 ALA HA H 47 4.112 4.112 4.008 0.104 25068
1087 1 3 . 1 1 47 47 ALA C C 47 180.665 180.665 179.639 1.026 25068
1088 1 3 . 1 1 47 47 ALA CA C 47 55.822 55.822 55.172 0.650 25068
1089 1 3 . 1 1 47 47 ALA CB C 47 19.129 19.129 17.898 1.231 25068
1090 1 3 . 1 1 47 47 ALA H H 47 8.505 8.505 8.181 0.324 25068
1091 1 3 . 1 1 48 48 GLN N N 48 120.047 120.047 118.991 1.056 25068
1092 1 3 . 1 1 48 48 GLN HA H 48 4.033 4.033 4.074 -0.041 25068
1093 1 3 . 1 1 48 48 GLN C C 48 178.486 178.486 178.237 0.249 25068
1094 1 3 . 1 1 48 48 GLN CA C 48 59.436 59.436 58.446 0.990 25068
1095 1 3 . 1 1 48 48 GLN CB C 48 29.436 29.436 28.322 1.114 25068
1096 1 3 . 1 1 48 48 GLN H H 48 7.852 7.852 8.391 -0.539 25068
1097 1 3 . 1 1 49 49 VAL N N 49 119.185 119.185 116.229 2.956 25068
1098 1 3 . 1 1 49 49 VAL HA H 49 3.424 3.424 3.580 -0.156 25068
1099 1 3 . 1 1 49 49 VAL C C 49 177.519 177.519 177.990 -0.471 25068
1100 1 3 . 1 1 49 49 VAL CA C 49 68.854 68.854 66.198 2.656 25068
1101 1 3 . 1 1 49 49 VAL CB C 49 32.454 32.454 30.629 1.825 25068
1102 1 3 . 1 1 49 49 VAL H H 49 7.984 7.984 8.066 -0.082 25068
1103 1 3 . 1 1 50 50 GLY N N 50 104.919 104.919 108.598 -3.679 25068
1104 1 3 . 1 1 50 50 GLY C C 50 176.825 176.825 175.996 0.829 25068
1105 1 3 . 1 1 50 50 GLY CA C 50 48.398 48.398 47.448 0.950 25068
1106 1 3 . 1 1 50 50 GLY H H 50 8.020 8.020 8.398 -0.378 25068
1107 1 3 . 1 1 51 51 LYS N N 51 123.422 123.422 122.829 0.593 25068
1108 1 3 . 1 1 51 51 LYS HA H 51 4.032 4.032 4.067 -0.035 25068
1109 1 3 . 1 1 51 51 LYS C C 51 179.332 179.332 179.013 0.319 25068
1110 1 3 . 1 1 51 51 LYS CA C 51 60.246 60.246 59.070 1.176 25068
1111 1 3 . 1 1 51 51 LYS CB C 51 33.626 33.626 32.080 1.546 25068
1112 1 3 . 1 1 51 51 LYS H H 51 7.699 7.699 7.902 -0.203 25068
1113 1 3 . 1 1 52 52 LEU N N 52 120.442 120.442 120.549 -0.107 25068
1114 1 3 . 1 1 52 52 LEU HA H 52 4.041 4.041 4.319 -0.278 25068
1115 1 3 . 1 1 52 52 LEU C C 52 180.984 180.984 179.247 1.737 25068
1116 1 3 . 1 1 52 52 LEU CA C 52 58.855 58.855 57.658 1.197 25068
1117 1 3 . 1 1 52 52 LEU CB C 52 43.046 43.046 41.621 1.425 25068
1118 1 3 . 1 1 52 52 LEU H H 52 8.088 8.088 7.838 0.250 25068
1119 1 3 . 1 1 53 53 ILE N N 53 121.249 121.249 119.063 2.186 25068
1120 1 3 . 1 1 53 53 ILE HA H 53 3.557 3.557 3.811 -0.254 25068
1121 1 3 . 1 1 53 53 ILE C C 53 177.945 177.945 178.875 -0.930 25068
1122 1 3 . 1 1 53 53 ILE CA C 53 67.431 67.431 61.932 5.499 25068
1123 1 3 . 1 1 53 53 ILE CB C 53 38.887 38.887 35.971 2.916 25068
1124 1 3 . 1 1 53 53 ILE H H 53 8.475 8.475 7.939 0.536 25068
1125 1 3 . 1 1 54 54 GLY N N 54 107.755 107.755 108.328 -0.573 25068
1126 1 3 . 1 1 54 54 GLY C C 54 177.691 177.691 176.095 1.596 25068
1127 1 3 . 1 1 54 54 GLY CA C 54 48.997 48.997 47.487 1.510 25068
1128 1 3 . 1 1 54 54 GLY H H 54 8.130 8.130 8.459 -0.329 25068
1129 1 3 . 1 1 55 55 GLU N N 55 122.138 122.138 122.283 -0.145 25068
1130 1 3 . 1 1 55 55 GLU HA H 55 4.032 4.032 3.941 0.091 25068
1131 1 3 . 1 1 55 55 GLU C C 55 179.146 179.146 178.984 0.162 25068
1132 1 3 . 1 1 55 55 GLU CA C 55 59.958 59.958 59.217 0.741 25068
1133 1 3 . 1 1 55 55 GLU CB C 55 30.551 30.551 29.264 1.287 25068
1134 1 3 . 1 1 55 55 GLU H H 55 8.089 8.089 8.296 -0.207 25068
1135 1 3 . 1 1 56 56 ALA N N 56 122.985 122.985 122.008 0.977 25068
1136 1 3 . 1 1 56 56 ALA HA H 56 4.107 4.107 4.218 -0.111 25068
1137 1 3 . 1 1 56 56 ALA C C 56 181.177 181.177 179.747 1.430 25068
1138 1 3 . 1 1 56 56 ALA CA C 56 56.414 56.414 54.755 1.659 25068
1139 1 3 . 1 1 56 56 ALA CB C 56 19.948 19.948 18.168 1.780 25068
1140 1 3 . 1 1 56 56 ALA H H 56 7.947 7.947 8.214 -0.267 25068
1141 1 3 . 1 1 57 57 TRP N N 57 120.485 120.485 120.975 -0.490 25068
1142 1 3 . 1 1 57 57 TRP HA H 57 3.940 3.940 4.238 -0.298 25068
1143 1 3 . 1 1 57 57 TRP C C 57 178.537 178.537 179.128 -0.591 25068
1144 1 3 . 1 1 57 57 TRP CA C 57 60.633 60.633 59.345 1.288 25068
1145 1 3 . 1 1 57 57 TRP CB C 57 31.681 31.681 29.338 2.343 25068
1146 1 3 . 1 1 57 57 TRP H H 57 8.910 8.910 8.246 0.664 25068
1147 1 3 . 1 1 58 58 GLY N N 58 102.004 102.004 106.944 -4.940 25068
1148 1 3 . 1 1 58 58 GLY C C 58 174.723 174.723 175.174 -0.451 25068
1149 1 3 . 1 1 58 58 GLY CA C 58 47.091 47.091 46.359 0.732 25068
1150 1 3 . 1 1 58 58 GLY H H 58 7.668 7.668 7.975 -0.307 25068
1151 1 3 . 1 1 59 59 GLN N N 59 116.202 116.202 117.453 -1.251 25068
1152 1 3 . 1 1 59 59 GLN HA H 59 4.259 4.259 4.148 0.111 25068
1153 1 3 . 1 1 59 59 GLN C C 59 176.221 176.221 176.477 -0.256 25068
1154 1 3 . 1 1 59 59 GLN CA C 59 55.967 55.967 55.533 0.434 25068
1155 1 3 . 1 1 59 59 GLN CB C 59 30.741 30.741 28.880 1.861 25068
1156 1 3 . 1 1 59 59 GLN H H 59 7.189 7.189 7.827 -0.638 25068
1157 1 3 . 1 1 60 60 LEU N N 60 120.776 120.776 122.121 -1.345 25068
1158 1 3 . 1 1 60 60 LEU HA H 60 4.185 4.185 4.056 0.129 25068
1159 1 3 . 1 1 60 60 LEU C C 60 177.372 177.372 176.224 1.148 25068
1160 1 3 . 1 1 60 60 LEU CA C 60 56.061 56.061 55.911 0.150 25068
1161 1 3 . 1 1 60 60 LEU CB C 60 43.696 43.696 42.519 1.177 25068
1162 1 3 . 1 1 60 60 LEU H H 60 6.968 6.968 7.360 -0.392 25068
1163 1 3 . 1 1 61 61 SER N N 61 120.432 120.432 119.408 1.024 25068
1164 1 3 . 1 1 61 61 SER HA H 61 4.582 4.582 4.707 -0.125 25068
1165 1 3 . 1 1 61 61 SER C C 61 173.500 173.500 173.943 -0.443 25068
1166 1 3 . 1 1 61 61 SER CA C 61 57.204 57.204 56.513 0.691 25068
1167 1 3 . 1 1 61 61 SER CB C 61 63.980 63.980 63.155 0.825 25068
1168 1 3 . 1 1 61 61 SER H H 61 8.885 8.885 8.153 0.732 25068
1169 1 3 . 1 1 63 63 ALA HA H 63 4.089 4.089 4.167 -0.078 25068
1170 1 3 . 1 1 63 63 ALA C C 63 180.570 180.570 179.048 1.522 25068
1171 1 3 . 1 1 63 63 ALA CA C 63 56.005 56.005 54.633 1.372 25068
1172 1 3 . 1 1 63 63 ALA CB C 63 19.317 19.317 18.253 1.064 25068
1173 1 3 . 1 1 64 64 GLN N N 64 116.774 116.774 116.605 0.169 25068
1174 1 3 . 1 1 64 64 GLN HA H 64 4.122 4.122 4.320 -0.198 25068
1175 1 3 . 1 1 64 64 GLN C C 64 178.275 178.275 178.382 -0.107 25068
1176 1 3 . 1 1 64 64 GLN CA C 64 58.622 58.622 57.843 0.779 25068
1177 1 3 . 1 1 64 64 GLN CB C 64 31.350 31.350 29.057 2.293 25068
1178 1 3 . 1 1 64 64 GLN H H 64 7.603 7.603 7.763 -0.160 25068
1179 1 3 . 1 1 65 65 LYS N N 65 117.203 117.203 120.403 -3.200 25068
1180 1 3 . 1 1 65 65 LYS HA H 65 4.129 4.129 4.140 -0.011 25068
1181 1 3 . 1 1 65 65 LYS C C 65 178.449 178.449 178.772 -0.323 25068
1182 1 3 . 1 1 65 65 LYS CA C 65 59.891 59.891 58.845 1.046 25068
1183 1 3 . 1 1 65 65 LYS CB C 65 34.351 34.351 32.109 2.242 25068
1184 1 3 . 1 1 65 65 LYS H H 65 7.810 7.810 7.485 0.325 25068
1185 1 3 . 1 1 66 66 ALA N N 66 122.218 122.218 122.576 -0.358 25068
1186 1 3 . 1 1 66 66 ALA HA H 66 4.290 4.290 4.228 0.062 25068
1187 1 3 . 1 1 66 66 ALA C C 66 176.135 176.135 176.751 -0.616 25068
1188 1 3 . 1 1 66 66 ALA CA C 66 57.745 57.745 56.875 0.870 25068
1189 1 3 . 1 1 66 66 ALA CB C 66 17.033 17.033 16.371 0.662 25068
1190 1 3 . 1 1 66 66 ALA H H 66 7.469 7.469 8.419 -0.950 25068
1191 1 3 . 1 1 67 67 PRO HA H 67 4.142 4.142 4.311 -0.169 25068
1192 1 3 . 1 1 67 67 PRO C C 67 179.591 179.591 178.658 0.933 25068
1193 1 3 . 1 1 67 67 PRO CA C 67 66.960 66.960 65.606 1.354 25068
1194 1 3 . 1 1 67 67 PRO CB C 67 32.014 32.014 31.426 0.588 25068
1195 1 3 . 1 1 68 68 TYR N N 68 117.140 117.140 120.682 -3.542 25068
1196 1 3 . 1 1 68 68 TYR HA H 68 3.940 3.940 4.034 -0.094 25068
1197 1 3 . 1 1 68 68 TYR C C 68 177.733 177.733 177.791 -0.058 25068
1198 1 3 . 1 1 68 68 TYR CA C 68 63.505 63.505 62.151 1.354 25068
1199 1 3 . 1 1 68 68 TYR CB C 68 38.503 38.503 38.589 -0.086 25068
1200 1 3 . 1 1 68 68 TYR H H 68 7.268 7.268 8.347 -1.079 25068
1201 1 3 . 1 1 69 69 GLU N N 69 120.747 120.747 118.216 2.531 25068
1202 1 3 . 1 1 69 69 GLU HA H 69 4.253 4.253 3.994 0.259 25068
1203 1 3 . 1 1 69 69 GLU C C 69 179.805 179.805 178.801 1.004 25068
1204 1 3 . 1 1 69 69 GLU CA C 69 60.145 60.145 59.815 0.330 25068
1205 1 3 . 1 1 69 69 GLU CB C 69 29.808 29.808 29.463 0.345 25068
1206 1 3 . 1 1 69 69 GLU H H 69 8.048 8.048 8.599 -0.551 25068
1207 1 3 . 1 1 70 70 LYS N N 70 120.938 120.938 120.436 0.502 25068
1208 1 3 . 1 1 70 70 LYS HA H 70 4.020 4.020 3.948 0.072 25068
1209 1 3 . 1 1 70 70 LYS C C 70 178.740 178.740 179.066 -0.326 25068
1210 1 3 . 1 1 70 70 LYS CA C 70 60.202 60.202 59.698 0.504 25068
1211 1 3 . 1 1 70 70 LYS CB C 70 32.419 32.419 32.437 -0.018 25068
1212 1 3 . 1 1 70 70 LYS H H 70 8.301 8.301 8.151 0.150 25068
1213 1 3 . 1 1 71 71 LYS N N 71 118.427 118.427 118.241 0.186 25068
1214 1 3 . 1 1 71 71 LYS HA H 71 3.528 3.528 4.042 -0.514 25068
1215 1 3 . 1 1 71 71 LYS C C 71 179.280 179.280 178.862 0.418 25068
1216 1 3 . 1 1 71 71 LYS CA C 71 61.146 61.146 58.695 2.451 25068
1217 1 3 . 1 1 71 71 LYS CB C 71 32.196 32.196 31.965 0.231 25068
1218 1 3 . 1 1 71 71 LYS H H 71 7.234 7.234 8.256 -1.022 25068
1219 1 3 . 1 1 72 72 ALA N N 72 122.126 122.126 122.178 -0.052 25068
1220 1 3 . 1 1 72 72 ALA HA H 72 4.357 4.357 3.933 0.424 25068
1221 1 3 . 1 1 72 72 ALA C C 72 180.468 180.468 180.019 0.449 25068
1222 1 3 . 1 1 72 72 ALA CA C 72 56.457 56.457 55.190 1.267 25068
1223 1 3 . 1 1 72 72 ALA CB C 72 19.562 19.562 17.884 1.678 25068
1224 1 3 . 1 1 72 72 ALA H H 72 7.890 7.890 7.998 -0.108 25068
1225 1 3 . 1 1 73 73 GLN N N 73 121.659 121.659 119.027 2.632 25068
1226 1 3 . 1 1 73 73 GLN HA H 73 4.029 4.029 4.077 -0.048 25068
1227 1 3 . 1 1 73 73 GLN C C 73 179.576 179.576 178.307 1.269 25068
1228 1 3 . 1 1 73 73 GLN CA C 73 60.427 60.427 58.809 1.619 25068
1229 1 3 . 1 1 73 73 GLN CB C 73 28.732 28.732 28.722 0.010 25068
1230 1 3 . 1 1 73 73 GLN H H 73 8.353 8.353 8.161 0.192 25068
1231 1 3 . 1 1 74 74 LEU N N 74 119.752 119.752 120.268 -0.516 25068
1232 1 3 . 1 1 74 74 LEU HA H 74 4.046 4.046 3.883 0.163 25068
1233 1 3 . 1 1 74 74 LEU C C 74 180.424 180.424 179.254 1.170 25068
1234 1 3 . 1 1 74 74 LEU CA C 74 58.675 58.675 57.883 0.792 25068
1235 1 3 . 1 1 74 74 LEU CB C 74 42.376 42.376 41.471 0.904 25068
1236 1 3 . 1 1 74 74 LEU H H 74 8.160 8.160 8.243 -0.083 25068
1237 1 3 . 1 1 75 75 ASP N N 75 122.159 122.159 119.249 2.910 25068
1238 1 3 . 1 1 75 75 ASP HA H 75 4.988 4.988 4.393 0.595 25068
1239 1 3 . 1 1 75 75 ASP C C 75 178.046 178.046 178.399 -0.353 25068
1240 1 3 . 1 1 75 75 ASP CA C 75 58.191 58.191 57.743 0.448 25068
1241 1 3 . 1 1 75 75 ASP CB C 75 42.958 42.958 40.852 2.106 25068
1242 1 3 . 1 1 75 75 ASP H H 75 8.361 8.361 8.598 -0.237 25068
1243 1 3 . 1 1 76 76 LYS N N 76 119.861 119.861 120.420 -0.559 25068
1244 1 3 . 1 1 76 76 LYS HA H 76 3.988 3.988 4.039 -0.051 25068
1245 1 3 . 1 1 76 76 LYS C C 76 179.668 179.668 179.322 0.346 25068
1246 1 3 . 1 1 76 76 LYS CA C 76 60.984 60.984 59.537 1.447 25068
1247 1 3 . 1 1 76 76 LYS CB C 76 33.124 33.124 32.491 0.633 25068
1248 1 3 . 1 1 76 76 LYS H H 76 7.940 7.940 7.687 0.253 25068
1249 1 3 . 1 1 77 77 VAL N N 77 121.485 121.485 119.133 2.352 25068
1250 1 3 . 1 1 77 77 VAL HA H 77 3.687 3.687 3.707 -0.020 25068
1251 1 3 . 1 1 77 77 VAL C C 77 178.070 178.070 177.687 0.383 25068
1252 1 3 . 1 1 77 77 VAL CA C 77 67.359 67.359 65.549 1.810 25068
1253 1 3 . 1 1 77 77 VAL CB C 77 32.645 32.645 31.160 1.485 25068
1254 1 3 . 1 1 77 77 VAL H H 77 7.401 7.401 8.245 -0.844 25068
1255 1 3 . 1 1 78 78 ARG N N 78 121.960 121.960 120.518 1.442 25068
1256 1 3 . 1 1 78 78 ARG HA H 78 4.010 4.010 3.926 0.084 25068
1257 1 3 . 1 1 78 78 ARG C C 78 179.144 179.144 178.500 0.644 25068
1258 1 3 . 1 1 78 78 ARG CA C 78 60.598 60.598 59.831 0.767 25068
1259 1 3 . 1 1 78 78 ARG CB C 78 28.352 28.352 30.187 -1.835 25068
1260 1 3 . 1 1 78 78 ARG H H 78 7.813 7.813 8.052 -0.239 25068
1261 1 3 . 1 1 79 79 TYR N N 79 120.411 120.411 119.745 0.666 25068
1262 1 3 . 1 1 79 79 TYR HA H 79 3.878 3.878 4.293 -0.415 25068
1263 1 3 . 1 1 79 79 TYR C C 79 176.080 176.080 177.458 -1.378 25068
1264 1 3 . 1 1 79 79 TYR CA C 79 63.669 63.669 60.785 2.884 25068
1265 1 3 . 1 1 79 79 TYR CB C 79 39.758 39.758 38.409 1.349 25068
1266 1 3 . 1 1 79 79 TYR H H 79 8.608 8.608 8.714 -0.106 25068
1267 1 3 . 1 1 80 80 SER N N 80 113.726 113.726 114.635 -0.909 25068
1268 1 3 . 1 1 80 80 SER HA H 80 3.880 3.880 3.826 0.054 25068
1269 1 3 . 1 1 80 80 SER C C 80 176.794 176.794 176.625 0.169 25068
1270 1 3 . 1 1 80 80 SER CA C 80 62.969 62.969 62.278 0.691 25068
1271 1 3 . 1 1 80 80 SER CB C 80 63.605 63.605 62.971 0.634 25068
1272 1 3 . 1 1 80 80 SER H H 80 8.234 8.234 8.130 0.104 25068
1273 1 3 . 1 1 81 81 LYS N N 81 121.920 121.920 120.847 1.073 25068
1274 1 3 . 1 1 81 81 LYS HA H 81 4.029 4.029 3.934 0.095 25068
1275 1 3 . 1 1 81 81 LYS C C 81 179.342 179.342 178.515 0.827 25068
1276 1 3 . 1 1 81 81 LYS CA C 81 60.138 60.138 59.067 1.071 25068
1277 1 3 . 1 1 81 81 LYS CB C 81 33.238 33.238 32.208 1.030 25068
1278 1 3 . 1 1 81 81 LYS H H 81 7.958 7.958 8.046 -0.088 25068
1279 1 3 . 1 1 82 82 GLU N N 82 119.515 119.515 119.722 -0.207 25068
1280 1 3 . 1 1 82 82 GLU HA H 82 3.945 3.945 3.948 -0.003 25068
1281 1 3 . 1 1 82 82 GLU C C 82 180.689 180.689 179.105 1.584 25068
1282 1 3 . 1 1 82 82 GLU CA C 82 60.920 60.920 59.673 1.247 25068
1283 1 3 . 1 1 82 82 GLU CB C 82 30.885 30.885 29.668 1.218 25068
1284 1 3 . 1 1 82 82 GLU H H 82 8.310 8.310 7.922 0.388 25068
1285 1 3 . 1 1 83 83 ILE N N 83 121.362 121.362 120.055 1.307 25068
1286 1 3 . 1 1 83 83 ILE HA H 83 3.889 3.889 3.765 0.124 25068
1287 1 3 . 1 1 83 83 ILE C C 83 177.207 177.207 177.675 -0.468 25068
1288 1 3 . 1 1 83 83 ILE CA C 83 62.754 62.754 63.810 -1.056 25068
1289 1 3 . 1 1 83 83 ILE CB C 83 37.651 37.651 37.702 -0.051 25068
1290 1 3 . 1 1 83 83 ILE H H 83 8.887 8.887 8.105 0.782 25068
1291 1 3 . 1 1 84 84 GLU N N 84 122.327 122.327 119.879 2.448 25068
1292 1 3 . 1 1 84 84 GLU HA H 84 4.028 4.028 3.884 0.144 25068
1293 1 3 . 1 1 84 84 GLU C C 84 179.047 179.047 179.014 0.033 25068
1294 1 3 . 1 1 84 84 GLU CA C 84 60.045 60.045 60.099 -0.054 25068
1295 1 3 . 1 1 84 84 GLU CB C 84 30.099 30.099 29.220 0.879 25068
1296 1 3 . 1 1 84 84 GLU H H 84 7.289 7.289 8.117 -0.828 25068
1297 1 3 . 1 1 85 85 GLU N N 85 118.046 118.046 119.232 -1.186 25068
1298 1 3 . 1 1 85 85 GLU HA H 85 3.966 3.966 3.968 -0.002 25068
1299 1 3 . 1 1 85 85 GLU C C 85 178.614 178.614 179.077 -0.463 25068
1300 1 3 . 1 1 85 85 GLU CA C 85 59.997 59.997 59.034 0.963 25068
1301 1 3 . 1 1 85 85 GLU CB C 85 30.453 30.453 29.037 1.416 25068
1302 1 3 . 1 1 85 85 GLU H H 85 7.545 7.545 8.153 -0.608 25068
1303 1 3 . 1 1 86 86 TYR N N 86 121.050 121.050 119.968 1.082 25068
1304 1 3 . 1 1 86 86 TYR HA H 86 4.094 4.094 4.255 -0.161 25068
1305 1 3 . 1 1 86 86 TYR C C 86 177.815 177.815 178.290 -0.475 25068
1306 1 3 . 1 1 86 86 TYR CA C 86 62.072 62.072 61.280 0.792 25068
1307 1 3 . 1 1 86 86 TYR CB C 86 39.954 39.954 38.276 1.678 25068
1308 1 3 . 1 1 86 86 TYR H H 86 8.277 8.277 8.044 0.233 25068
1309 1 3 . 1 1 87 87 ARG N N 87 118.353 118.353 118.408 -0.055 25068
1310 1 3 . 1 1 87 87 ARG HA H 87 3.877 3.877 3.962 -0.085 25068
1311 1 3 . 1 1 87 87 ARG C C 87 178.067 178.067 178.793 -0.726 25068
1312 1 3 . 1 1 87 87 ARG CA C 87 59.513 59.513 59.246 0.267 25068
1313 1 3 . 1 1 87 87 ARG CB C 87 31.053 31.053 30.338 0.715 25068
1314 1 3 . 1 1 87 87 ARG H H 87 8.249 8.249 8.395 -0.146 25068
1315 1 3 . 1 1 88 88 LYS N N 88 118.205 118.205 117.549 0.656 25068
1316 1 3 . 1 1 88 88 LYS HA H 88 3.982 3.982 4.063 -0.081 25068
1317 1 3 . 1 1 88 88 LYS C C 88 178.050 178.050 177.482 0.568 25068
1318 1 3 . 1 1 88 88 LYS CA C 88 59.265 59.265 58.638 0.627 25068
1319 1 3 . 1 1 88 88 LYS CB C 88 33.499 33.499 32.651 0.848 25068
1320 1 3 . 1 1 88 88 LYS H H 88 7.465 7.465 7.948 -0.483 25068
1321 1 3 . 1 1 89 89 LYS N N 89 118.341 118.341 113.879 4.462 25068
1322 1 3 . 1 1 89 89 LYS HA H 89 4.084 4.084 4.475 -0.391 25068
1323 1 3 . 1 1 89 89 LYS C C 89 176.691 176.691 176.049 0.642 25068
1324 1 3 . 1 1 89 89 LYS CA C 89 58.188 58.188 55.756 2.432 25068
1325 1 3 . 1 1 89 89 LYS CB C 89 33.809 33.809 32.103 1.706 25068
1326 1 3 . 1 1 89 89 LYS H H 89 7.580 7.580 7.794 -0.214 25068
1327 1 3 . 1 1 90 90 ASN N N 90 117.604 117.604 118.939 -1.335 25068
1328 1 3 . 1 1 90 90 ASN HA H 90 4.563 4.563 4.859 -0.296 25068
1329 1 3 . 1 1 90 90 ASN C C 90 174.419 174.419 175.357 -0.938 25068
1330 1 3 . 1 1 90 90 ASN CA C 90 54.433 54.433 54.341 0.092 25068
1331 1 3 . 1 1 90 90 ASN CB C 90 40.182 40.182 40.172 0.010 25068
1332 1 3 . 1 1 90 90 ASN H H 90 7.741 7.741 7.932 -0.191 25068
1333 1 3 . 1 1 91 91 GLN N N 91 111.990 111.990 120.973 -8.983 25068
1334 1 3 . 1 1 91 91 GLN HA H 91 4.213 4.213 4.534 -0.321 25068
1335 1 3 . 1 1 91 91 GLN C C 91 174.970 174.970 175.530 -0.560 25068
1336 1 3 . 1 1 91 91 GLN CA C 91 57.011 57.011 55.423 1.588 25068
1337 1 3 . 1 1 91 91 GLN CB C 91 30.358 30.358 29.967 0.391 25068
1338 1 3 . 1 1 91 91 GLN H H 91 7.925 7.925 7.994 -0.069 25068
1339 1 4 . 1 1 14 14 PRO HA H 14 4.322 4.322 4.394 -0.072 25068
1340 1 4 . 1 1 14 14 PRO C C 14 176.783 176.783 176.511 0.272 25068
1341 1 4 . 1 1 14 14 PRO CA C 14 64.643 64.643 63.869 0.774 25068
1342 1 4 . 1 1 14 14 PRO CB C 14 33.114 33.114 31.994 1.120 25068
1343 1 4 . 1 1 15 15 LEU N N 15 120.158 120.158 120.396 -0.238 25068
1344 1 4 . 1 1 15 15 LEU HA H 15 4.238 4.238 4.437 -0.199 25068
1345 1 4 . 1 1 15 15 LEU C C 15 176.361 176.361 175.700 0.661 25068
1346 1 4 . 1 1 15 15 LEU CA C 15 55.395 55.395 54.320 1.075 25068
1347 1 4 . 1 1 15 15 LEU CB C 15 42.619 42.619 40.754 1.865 25068
1348 1 4 . 1 1 15 15 LEU H H 15 8.189 8.189 7.829 0.360 25068
1349 1 4 . 1 1 16 16 ALA N N 16 124.269 124.269 121.459 2.810 25068
1350 1 4 . 1 1 16 16 ALA HA H 16 3.496 3.496 4.877 -1.381 25068
1351 1 4 . 1 1 16 16 ALA C C 16 175.124 175.124 175.091 0.033 25068
1352 1 4 . 1 1 16 16 ALA CA C 16 51.457 51.457 50.071 1.386 25068
1353 1 4 . 1 1 16 16 ALA CB C 16 18.105 18.105 19.819 -1.714 25068
1354 1 4 . 1 1 16 16 ALA H H 16 7.500 7.500 7.289 0.211 25068
1355 1 4 . 1 1 17 17 PRO HA H 17 4.157 4.157 4.368 -0.211 25068
1356 1 4 . 1 1 17 17 PRO C C 17 176.396 176.396 176.050 0.346 25068
1357 1 4 . 1 1 17 17 PRO CA C 17 63.588 63.588 62.227 1.361 25068
1358 1 4 . 1 1 17 17 PRO CB C 17 32.850 32.850 32.005 0.845 25068
1359 1 4 . 1 1 18 18 LYS N N 18 124.070 124.070 120.227 3.843 25068
1360 1 4 . 1 1 18 18 LYS HA H 18 4.147 4.147 4.287 -0.140 25068
1361 1 4 . 1 1 18 18 LYS C C 18 177.543 177.543 176.233 1.310 25068
1362 1 4 . 1 1 18 18 LYS CA C 18 57.081 57.081 56.304 0.777 25068
1363 1 4 . 1 1 18 18 LYS CB C 18 33.573 33.573 33.087 0.486 25068
1364 1 4 . 1 1 18 18 LYS H H 18 8.886 8.886 8.266 0.620 25068
1365 1 4 . 1 1 19 19 ARG N N 19 122.242 122.242 120.520 1.722 25068
1366 1 4 . 1 1 19 19 ARG HA H 19 3.437 3.437 4.588 -1.151 25068
1367 1 4 . 1 1 19 19 ARG C C 19 175.409 175.409 174.857 0.552 25068
1368 1 4 . 1 1 19 19 ARG CA C 19 57.545 57.545 55.687 1.858 25068
1369 1 4 . 1 1 19 19 ARG CB C 19 31.149 31.149 31.337 -0.188 25068
1370 1 4 . 1 1 19 19 ARG H H 19 8.286 8.286 8.449 -0.163 25068
1371 1 4 . 1 1 20 20 ALA N N 20 123.176 123.176 125.956 -2.780 25068
1372 1 4 . 1 1 20 20 ALA HA H 20 4.139 4.139 4.503 -0.364 25068
1373 1 4 . 1 1 20 20 ALA C C 20 177.843 177.843 176.021 1.822 25068
1374 1 4 . 1 1 20 20 ALA CA C 20 52.391 52.391 51.499 0.892 25068
1375 1 4 . 1 1 20 20 ALA CB C 20 19.397 19.397 20.388 -0.991 25068
1376 1 4 . 1 1 20 20 ALA H H 20 7.348 7.348 8.057 -0.709 25068
1377 1 4 . 1 1 21 21 LEU N N 21 125.680 125.680 121.169 4.511 25068
1378 1 4 . 1 1 21 21 LEU HA H 21 4.194 4.194 4.620 -0.426 25068
1379 1 4 . 1 1 21 21 LEU C C 21 177.091 177.091 175.947 1.144 25068
1380 1 4 . 1 1 21 21 LEU CA C 21 55.472 55.472 54.496 0.976 25068
1381 1 4 . 1 1 21 21 LEU CB C 21 43.931 43.931 43.877 0.054 25068
1382 1 4 . 1 1 21 21 LEU H H 21 9.055 9.055 8.360 0.695 25068
1383 1 4 . 1 1 22 22 SER N N 22 116.686 116.686 114.644 2.042 25068
1384 1 4 . 1 1 22 22 SER HA H 22 4.427 4.427 4.920 -0.493 25068
1385 1 4 . 1 1 22 22 SER C C 22 174.241 174.241 175.086 -0.845 25068
1386 1 4 . 1 1 22 22 SER CA C 22 57.564 57.564 56.129 1.435 25068
1387 1 4 . 1 1 22 22 SER CB C 22 66.568 66.568 65.425 1.143 25068
1388 1 4 . 1 1 22 22 SER H H 22 7.549 7.549 8.017 -0.468 25068
1389 1 4 . 1 1 23 23 ALA N N 23 123.382 123.382 124.759 -1.377 25068
1390 1 4 . 1 1 23 23 ALA HA H 23 4.163 4.163 4.044 0.119 25068
1391 1 4 . 1 1 23 23 ALA C C 23 178.863 178.863 179.635 -0.772 25068
1392 1 4 . 1 1 23 23 ALA CA C 23 57.124 57.124 55.167 1.957 25068
1393 1 4 . 1 1 23 23 ALA CB C 23 19.441 19.441 17.957 1.484 25068
1394 1 4 . 1 1 23 23 ALA H H 23 9.035 9.035 8.866 0.169 25068
1395 1 4 . 1 1 24 24 TYR N N 24 115.979 115.979 117.705 -1.726 25068
1396 1 4 . 1 1 24 24 TYR HA H 24 2.590 2.590 4.345 -1.755 25068
1397 1 4 . 1 1 24 24 TYR C C 24 176.257 176.257 178.545 -2.288 25068
1398 1 4 . 1 1 24 24 TYR CA C 24 60.940 60.940 60.109 0.831 25068
1399 1 4 . 1 1 24 24 TYR CB C 24 39.106 39.106 37.922 1.184 25068
1400 1 4 . 1 1 24 24 TYR H H 24 8.206 8.206 8.358 -0.152 25068
1401 1 4 . 1 1 25 25 MET N N 25 116.391 116.391 117.706 -1.315 25068
1402 1 4 . 1 1 25 25 MET HA H 25 3.643 3.643 4.232 -0.589 25068
1403 1 4 . 1 1 25 25 MET C C 25 180.177 180.177 178.301 1.876 25068
1404 1 4 . 1 1 25 25 MET CA C 25 59.161 59.161 56.074 3.087 25068
1405 1 4 . 1 1 25 25 MET CB C 25 32.748 32.748 31.420 1.328 25068
1406 1 4 . 1 1 25 25 MET H H 25 7.433 7.433 7.828 -0.395 25068
1407 1 4 . 1 1 26 26 PHE N N 26 118.699 118.699 122.494 -3.795 25068
1408 1 4 . 1 1 26 26 PHE HA H 26 4.063 4.063 4.079 -0.016 25068
1409 1 4 . 1 1 26 26 PHE C C 26 178.055 178.055 177.724 0.331 25068
1410 1 4 . 1 1 26 26 PHE CA C 26 64.840 64.840 62.733 2.107 25068
1411 1 4 . 1 1 26 26 PHE CB C 26 40.437 40.437 39.008 1.429 25068
1412 1 4 . 1 1 26 26 PHE H H 26 7.982 7.982 8.504 -0.522 25068
1413 1 4 . 1 1 27 27 TYR N N 27 123.888 123.888 117.035 6.853 25068
1414 1 4 . 1 1 27 27 TYR HA H 27 3.576 3.576 4.158 -0.582 25068
1415 1 4 . 1 1 27 27 TYR C C 27 176.691 176.691 177.932 -1.241 25068
1416 1 4 . 1 1 27 27 TYR CA C 27 62.831 62.831 62.541 0.290 25068
1417 1 4 . 1 1 27 27 TYR CB C 27 39.238 39.238 38.320 0.918 25068
1418 1 4 . 1 1 27 27 TYR H H 27 7.843 7.843 8.196 -0.353 25068
1419 1 4 . 1 1 28 28 VAL N N 28 119.501 119.501 119.656 -0.155 25068
1420 1 4 . 1 1 28 28 VAL HA H 28 2.912 2.912 3.569 -0.657 25068
1421 1 4 . 1 1 28 28 VAL C C 28 177.067 177.067 177.785 -0.718 25068
1422 1 4 . 1 1 28 28 VAL CA C 28 67.149 67.149 66.424 0.725 25068
1423 1 4 . 1 1 28 28 VAL CB C 28 32.599 32.599 31.212 1.387 25068
1424 1 4 . 1 1 28 28 VAL H H 28 8.370 8.370 7.666 0.704 25068
1425 1 4 . 1 1 29 29 LYS N N 29 114.512 114.512 119.359 -4.847 25068
1426 1 4 . 1 1 29 29 LYS HA H 29 3.676 3.676 3.827 -0.151 25068
1427 1 4 . 1 1 29 29 LYS C C 29 178.627 178.627 178.830 -0.203 25068
1428 1 4 . 1 1 29 29 LYS CA C 29 60.349 60.349 59.809 0.540 25068
1429 1 4 . 1 1 29 29 LYS CB C 29 33.278 33.278 31.632 1.646 25068
1430 1 4 . 1 1 29 29 LYS H H 29 6.821 6.821 8.500 -1.679 25068
1431 1 4 . 1 1 30 30 ASP N N 30 116.793 116.793 121.186 -4.393 25068
1432 1 4 . 1 1 30 30 ASP HA H 30 4.466 4.466 4.253 0.213 25068
1433 1 4 . 1 1 30 30 ASP C C 30 178.615 178.615 178.516 0.099 25068
1434 1 4 . 1 1 30 30 ASP CA C 30 57.223 57.223 57.565 -0.341 25068
1435 1 4 . 1 1 30 30 ASP CB C 30 42.066 42.066 40.229 1.837 25068
1436 1 4 . 1 1 30 30 ASP H H 30 6.875 6.875 8.090 -1.215 25068
1437 1 4 . 1 1 31 31 LYS N N 31 122.423 122.423 119.830 2.593 25068
1438 1 4 . 1 1 31 31 LYS HA H 31 3.813 3.813 3.838 -0.025 25068
1439 1 4 . 1 1 31 31 LYS C C 31 178.443 178.443 179.027 -0.584 25068
1440 1 4 . 1 1 31 31 LYS CA C 31 57.494 57.494 59.461 -1.967 25068
1441 1 4 . 1 1 31 31 LYS CB C 31 32.539 32.539 32.163 0.376 25068
1442 1 4 . 1 1 31 31 LYS H H 31 8.910 8.910 8.112 0.798 25068
1443 1 4 . 1 1 32 32 ARG N N 32 117.823 117.823 119.189 -1.366 25068
1444 1 4 . 1 1 32 32 ARG HA H 32 3.540 3.540 4.030 -0.490 25068
1445 1 4 . 1 1 32 32 ARG C C 32 176.951 176.951 178.733 -1.782 25068
1446 1 4 . 1 1 32 32 ARG CA C 32 61.259 61.259 59.240 2.019 25068
1447 1 4 . 1 1 32 32 ARG CB C 32 30.668 30.668 29.957 0.710 25068
1448 1 4 . 1 1 32 32 ARG H H 32 8.501 8.501 8.286 0.215 25068
1449 1 4 . 1 1 33 33 LEU N N 33 114.878 114.878 120.238 -5.360 25068
1450 1 4 . 1 1 33 33 LEU HA H 33 3.871 3.871 3.848 0.023 25068
1451 1 4 . 1 1 33 33 LEU C C 33 179.180 179.180 179.065 0.115 25068
1452 1 4 . 1 1 33 33 LEU CA C 33 58.377 58.377 57.990 0.387 25068
1453 1 4 . 1 1 33 33 LEU CB C 33 42.429 42.429 41.623 0.806 25068
1454 1 4 . 1 1 33 33 LEU H H 33 6.549 6.549 8.065 -1.516 25068
1455 1 4 . 1 1 34 34 GLU N N 34 118.637 118.637 119.211 -0.574 25068
1456 1 4 . 1 1 34 34 GLU HA H 34 3.866 3.866 3.928 -0.062 25068
1457 1 4 . 1 1 34 34 GLU C C 34 178.988 178.988 179.148 -0.160 25068
1458 1 4 . 1 1 34 34 GLU CA C 34 60.248 60.248 59.654 0.594 25068
1459 1 4 . 1 1 34 34 GLU CB C 34 31.325 31.325 29.591 1.734 25068
1460 1 4 . 1 1 34 34 GLU H H 34 7.135 7.135 7.939 -0.804 25068
1461 1 4 . 1 1 35 35 ILE N N 35 119.142 119.142 119.840 -0.698 25068
1462 1 4 . 1 1 35 35 ILE HA H 35 3.693 3.693 3.810 -0.117 25068
1463 1 4 . 1 1 35 35 ILE C C 35 177.789 177.789 178.706 -0.917 25068
1464 1 4 . 1 1 35 35 ILE CA C 35 65.753 65.753 65.472 0.281 25068
1465 1 4 . 1 1 35 35 ILE CB C 35 38.940 38.940 37.857 1.083 25068
1466 1 4 . 1 1 35 35 ILE H H 35 8.076 8.076 8.390 -0.314 25068
1467 1 4 . 1 1 36 36 ILE N N 36 116.296 116.296 118.094 -1.798 25068
1468 1 4 . 1 1 36 36 ILE HA H 36 3.640 3.640 4.082 -0.442 25068
1469 1 4 . 1 1 36 36 ILE C C 36 177.270 177.270 177.135 0.135 25068
1470 1 4 . 1 1 36 36 ILE CA C 36 64.633 64.633 63.510 1.123 25068
1471 1 4 . 1 1 36 36 ILE CB C 36 38.718 38.718 37.983 0.736 25068
1472 1 4 . 1 1 36 36 ILE H H 36 7.754 7.754 8.133 -0.379 25068
1473 1 4 . 1 1 37 37 LYS N N 37 119.626 119.626 118.893 0.733 25068
1474 1 4 . 1 1 37 37 LYS HA H 37 3.922 3.922 4.140 -0.218 25068
1475 1 4 . 1 1 37 37 LYS C C 37 178.129 178.129 177.762 0.367 25068
1476 1 4 . 1 1 37 37 LYS CA C 37 59.996 59.996 58.519 1.477 25068
1477 1 4 . 1 1 37 37 LYS CB C 37 33.487 33.487 32.974 0.513 25068
1478 1 4 . 1 1 37 37 LYS H H 37 7.413 7.413 7.881 -0.468 25068
1479 1 4 . 1 1 38 38 GLU N N 38 116.708 116.708 116.050 0.658 25068
1480 1 4 . 1 1 38 38 GLU HA H 38 4.060 4.060 4.317 -0.257 25068
1481 1 4 . 1 1 38 38 GLU C C 38 177.004 177.004 177.114 -0.110 25068
1482 1 4 . 1 1 38 38 GLU CA C 38 59.070 59.070 57.487 1.583 25068
1483 1 4 . 1 1 38 38 GLU CB C 38 31.665 31.665 30.833 0.832 25068
1484 1 4 . 1 1 38 38 GLU H H 38 7.354 7.354 8.071 -0.717 25068
1485 1 4 . 1 1 39 39 LYS N N 39 118.621 118.621 120.035 -1.414 25068
1486 1 4 . 1 1 39 39 LYS HA H 39 4.690 4.690 4.806 -0.116 25068
1487 1 4 . 1 1 39 39 LYS C C 39 172.792 172.792 174.716 -1.924 25068
1488 1 4 . 1 1 39 39 LYS CA C 39 54.596 54.596 53.170 1.426 25068
1489 1 4 . 1 1 39 39 LYS CB C 39 33.945 33.945 33.000 0.945 25068
1490 1 4 . 1 1 39 39 LYS H H 39 8.176 8.176 7.827 0.349 25068
1491 1 4 . 1 1 40 40 PRO HA H 40 4.429 4.429 4.338 0.091 25068
1492 1 4 . 1 1 40 40 PRO C C 40 179.829 179.829 177.618 2.211 25068
1493 1 4 . 1 1 40 40 PRO CA C 40 66.040 66.040 64.447 1.593 25068
1494 1 4 . 1 1 40 40 PRO CB C 40 32.606 32.606 32.059 0.547 25068
1495 1 4 . 1 1 41 41 GLU N N 41 119.150 119.150 119.179 -0.029 25068
1496 1 4 . 1 1 41 41 GLU HA H 41 4.143 4.143 4.189 -0.046 25068
1497 1 4 . 1 1 41 41 GLU C C 41 178.502 178.502 178.172 0.330 25068
1498 1 4 . 1 1 41 41 GLU CA C 41 59.485 59.485 58.613 0.872 25068
1499 1 4 . 1 1 41 41 GLU CB C 41 28.574 28.574 29.437 -0.863 25068
1500 1 4 . 1 1 41 41 GLU H H 41 9.789 9.789 8.664 1.125 25068
1501 1 4 . 1 1 42 42 LEU N N 42 121.443 121.443 119.318 2.125 25068
1502 1 4 . 1 1 42 42 LEU HA H 42 4.185 4.185 4.460 -0.275 25068
1503 1 4 . 1 1 42 42 LEU C C 42 177.815 177.815 177.961 -0.146 25068
1504 1 4 . 1 1 42 42 LEU CA C 42 56.730 56.730 54.595 2.135 25068
1505 1 4 . 1 1 42 42 LEU CB C 42 42.013 42.013 41.647 0.366 25068
1506 1 4 . 1 1 42 42 LEU H H 42 8.312 8.312 7.609 0.703 25068
1507 1 4 . 1 1 43 43 ALA N N 43 119.949 119.949 123.016 -3.067 25068
1508 1 4 . 1 1 43 43 ALA HA H 43 3.746 3.746 4.029 -0.283 25068
1509 1 4 . 1 1 43 43 ALA C C 43 178.635 178.635 178.009 0.626 25068
1510 1 4 . 1 1 43 43 ALA CA C 43 56.164 56.164 54.662 1.502 25068
1511 1 4 . 1 1 43 43 ALA CB C 43 19.670 19.670 18.591 1.079 25068
1512 1 4 . 1 1 43 43 ALA H H 43 7.554 7.554 7.237 0.317 25068
1513 1 4 . 1 1 44 44 LYS N N 44 112.690 112.690 117.655 -4.965 25068
1514 1 4 . 1 1 44 44 LYS HA H 44 4.232 4.232 4.364 -0.132 25068
1515 1 4 . 1 1 44 44 LYS C C 44 175.949 175.949 175.715 0.234 25068
1516 1 4 . 1 1 44 44 LYS CA C 44 56.987 56.987 55.287 1.700 25068
1517 1 4 . 1 1 44 44 LYS CB C 44 33.345 33.345 32.250 1.095 25068
1518 1 4 . 1 1 44 44 LYS H H 44 7.560 7.560 8.014 -0.454 25068
1519 1 4 . 1 1 45 45 ASP N N 45 122.529 122.529 121.258 1.271 25068
1520 1 4 . 1 1 45 45 ASP HA H 45 4.749 4.749 4.891 -0.142 25068
1521 1 4 . 1 1 45 45 ASP C C 45 174.677 174.677 176.179 -1.502 25068
1522 1 4 . 1 1 45 45 ASP CA C 45 53.030 53.030 52.502 0.528 25068
1523 1 4 . 1 1 45 45 ASP CB C 45 41.549 41.549 40.979 0.570 25068
1524 1 4 . 1 1 45 45 ASP H H 45 7.672 7.672 8.031 -0.359 25068
1525 1 4 . 1 1 46 46 VAL N N 46 121.529 121.529 124.872 -3.343 25068
1526 1 4 . 1 1 46 46 VAL HA H 46 3.639 3.639 3.537 0.102 25068
1527 1 4 . 1 1 46 46 VAL C C 46 179.102 179.102 177.304 1.798 25068
1528 1 4 . 1 1 46 46 VAL CA C 46 66.430 66.430 66.358 0.072 25068
1529 1 4 . 1 1 46 46 VAL CB C 46 32.650 32.650 31.851 0.799 25068
1530 1 4 . 1 1 46 46 VAL H H 46 7.808 7.808 8.252 -0.444 25068
1531 1 4 . 1 1 47 47 ALA N N 47 123.933 123.933 120.826 3.107 25068
1532 1 4 . 1 1 47 47 ALA HA H 47 4.112 4.112 3.956 0.156 25068
1533 1 4 . 1 1 47 47 ALA C C 47 180.665 180.665 179.595 1.070 25068
1534 1 4 . 1 1 47 47 ALA CA C 47 55.822 55.822 55.128 0.694 25068
1535 1 4 . 1 1 47 47 ALA CB C 47 19.129 19.129 17.839 1.290 25068
1536 1 4 . 1 1 47 47 ALA H H 47 8.505 8.505 8.222 0.283 25068
1537 1 4 . 1 1 48 48 GLN N N 48 120.047 120.047 118.925 1.122 25068
1538 1 4 . 1 1 48 48 GLN HA H 48 4.033 4.033 4.052 -0.019 25068
1539 1 4 . 1 1 48 48 GLN C C 48 178.486 178.486 178.192 0.294 25068
1540 1 4 . 1 1 48 48 GLN CA C 48 59.436 59.436 58.447 0.989 25068
1541 1 4 . 1 1 48 48 GLN CB C 48 29.436 29.436 28.435 1.001 25068
1542 1 4 . 1 1 48 48 GLN H H 48 7.852 7.852 8.235 -0.383 25068
1543 1 4 . 1 1 49 49 VAL N N 49 119.185 119.185 116.211 2.974 25068
1544 1 4 . 1 1 49 49 VAL HA H 49 3.424 3.424 3.641 -0.217 25068
1545 1 4 . 1 1 49 49 VAL C C 49 177.519 177.519 177.881 -0.362 25068
1546 1 4 . 1 1 49 49 VAL CA C 49 68.854 68.854 66.345 2.509 25068
1547 1 4 . 1 1 49 49 VAL CB C 49 32.454 32.454 31.118 1.336 25068
1548 1 4 . 1 1 49 49 VAL H H 49 7.984 7.984 8.019 -0.035 25068
1549 1 4 . 1 1 50 50 GLY N N 50 104.919 104.919 108.341 -3.422 25068
1550 1 4 . 1 1 50 50 GLY C C 50 176.825 176.825 176.122 0.703 25068
1551 1 4 . 1 1 50 50 GLY CA C 50 48.398 48.398 47.332 1.066 25068
1552 1 4 . 1 1 50 50 GLY H H 50 8.020 8.020 8.386 -0.366 25068
1553 1 4 . 1 1 51 51 LYS N N 51 123.422 123.422 122.582 0.840 25068
1554 1 4 . 1 1 51 51 LYS HA H 51 4.032 4.032 4.149 -0.117 25068
1555 1 4 . 1 1 51 51 LYS C C 51 179.332 179.332 179.253 0.079 25068
1556 1 4 . 1 1 51 51 LYS CA C 51 60.246 60.246 58.293 1.953 25068
1557 1 4 . 1 1 51 51 LYS CB C 51 33.626 33.626 31.923 1.703 25068
1558 1 4 . 1 1 51 51 LYS H H 51 7.699 7.699 7.967 -0.268 25068
1559 1 4 . 1 1 52 52 LEU N N 52 120.442 120.442 120.994 -0.552 25068
1560 1 4 . 1 1 52 52 LEU HA H 52 4.041 4.041 3.956 0.085 25068
1561 1 4 . 1 1 52 52 LEU C C 52 180.984 180.984 179.054 1.930 25068
1562 1 4 . 1 1 52 52 LEU CA C 52 58.855 58.855 58.121 0.734 25068
1563 1 4 . 1 1 52 52 LEU CB C 52 43.046 43.046 41.622 1.424 25068
1564 1 4 . 1 1 52 52 LEU H H 52 8.088 8.088 8.217 -0.129 25068
1565 1 4 . 1 1 53 53 ILE N N 53 121.249 121.249 119.232 2.017 25068
1566 1 4 . 1 1 53 53 ILE HA H 53 3.557 3.557 3.776 -0.219 25068
1567 1 4 . 1 1 53 53 ILE C C 53 177.945 177.945 178.168 -0.223 25068
1568 1 4 . 1 1 53 53 ILE CA C 53 67.431 67.431 64.854 2.577 25068
1569 1 4 . 1 1 53 53 ILE CB C 53 38.887 38.887 37.190 1.697 25068
1570 1 4 . 1 1 53 53 ILE H H 53 8.475 8.475 8.275 0.200 25068
1571 1 4 . 1 1 54 54 GLY N N 54 107.755 107.755 107.687 0.068 25068
1572 1 4 . 1 1 54 54 GLY C C 54 177.691 177.691 176.483 1.208 25068
1573 1 4 . 1 1 54 54 GLY CA C 54 48.997 48.997 47.696 1.301 25068
1574 1 4 . 1 1 54 54 GLY H H 54 8.130 8.130 8.491 -0.361 25068
1575 1 4 . 1 1 55 55 GLU N N 55 122.138 122.138 122.587 -0.449 25068
1576 1 4 . 1 1 55 55 GLU HA H 55 4.032 4.032 3.919 0.113 25068
1577 1 4 . 1 1 55 55 GLU C C 55 179.146 179.146 178.967 0.179 25068
1578 1 4 . 1 1 55 55 GLU CA C 55 59.958 59.958 59.179 0.779 25068
1579 1 4 . 1 1 55 55 GLU CB C 55 30.551 30.551 29.466 1.085 25068
1580 1 4 . 1 1 55 55 GLU H H 55 8.089 8.089 8.262 -0.173 25068
1581 1 4 . 1 1 56 56 ALA N N 56 122.985 122.985 122.099 0.886 25068
1582 1 4 . 1 1 56 56 ALA HA H 56 4.107 4.107 4.016 0.091 25068
1583 1 4 . 1 1 56 56 ALA C C 56 181.177 181.177 178.752 2.425 25068
1584 1 4 . 1 1 56 56 ALA CA C 56 56.414 56.414 55.044 1.369 25068
1585 1 4 . 1 1 56 56 ALA CB C 56 19.948 19.948 18.299 1.649 25068
1586 1 4 . 1 1 56 56 ALA H H 56 7.947 7.947 8.240 -0.293 25068
1587 1 4 . 1 1 57 57 TRP N N 57 120.485 120.485 119.089 1.396 25068
1588 1 4 . 1 1 57 57 TRP HA H 57 3.940 3.940 4.119 -0.179 25068
1589 1 4 . 1 1 57 57 TRP C C 57 178.537 178.537 179.136 -0.599 25068
1590 1 4 . 1 1 57 57 TRP CA C 57 60.633 60.633 58.931 1.702 25068
1591 1 4 . 1 1 57 57 TRP CB C 57 31.681 31.681 29.411 2.270 25068
1592 1 4 . 1 1 57 57 TRP H H 57 8.910 8.910 8.400 0.510 25068
1593 1 4 . 1 1 58 58 GLY N N 58 102.004 102.004 107.560 -5.556 25068
1594 1 4 . 1 1 58 58 GLY C C 58 174.723 174.723 174.994 -0.271 25068
1595 1 4 . 1 1 58 58 GLY CA C 58 47.091 47.091 46.237 0.854 25068
1596 1 4 . 1 1 58 58 GLY H H 58 7.668 7.668 8.080 -0.412 25068
1597 1 4 . 1 1 59 59 GLN N N 59 116.202 116.202 116.322 -0.120 25068
1598 1 4 . 1 1 59 59 GLN HA H 59 4.259 4.259 4.447 -0.188 25068
1599 1 4 . 1 1 59 59 GLN C C 59 176.221 176.221 175.605 0.616 25068
1600 1 4 . 1 1 59 59 GLN CA C 59 55.967 55.967 54.588 1.379 25068
1601 1 4 . 1 1 59 59 GLN CB C 59 30.741 30.741 29.132 1.609 25068
1602 1 4 . 1 1 59 59 GLN H H 59 7.189 7.189 7.676 -0.487 25068
1603 1 4 . 1 1 60 60 LEU N N 60 120.776 120.776 123.059 -2.283 25068
1604 1 4 . 1 1 60 60 LEU HA H 60 4.185 4.185 4.328 -0.143 25068
1605 1 4 . 1 1 60 60 LEU C C 60 177.372 177.372 177.010 0.362 25068
1606 1 4 . 1 1 60 60 LEU CA C 60 56.061 56.061 55.522 0.539 25068
1607 1 4 . 1 1 60 60 LEU CB C 60 43.696 43.696 42.263 1.433 25068
1608 1 4 . 1 1 60 60 LEU H H 60 6.968 6.968 7.496 -0.528 25068
1609 1 4 . 1 1 61 61 SER N N 61 120.432 120.432 119.743 0.689 25068
1610 1 4 . 1 1 61 61 SER HA H 61 4.582 4.582 4.476 0.106 25068
1611 1 4 . 1 1 61 61 SER C C 61 173.500 173.500 174.366 -0.866 25068
1612 1 4 . 1 1 61 61 SER CA C 61 57.204 57.204 58.545 -1.341 25068
1613 1 4 . 1 1 61 61 SER CB C 61 63.980 63.980 63.650 0.330 25068
1614 1 4 . 1 1 61 61 SER H H 61 8.885 8.885 8.318 0.567 25068
1615 1 4 . 1 1 63 63 ALA HA H 63 4.089 4.089 4.186 -0.097 25068
1616 1 4 . 1 1 63 63 ALA C C 63 180.570 180.570 179.286 1.284 25068
1617 1 4 . 1 1 63 63 ALA CA C 63 56.005 56.005 54.645 1.360 25068
1618 1 4 . 1 1 63 63 ALA CB C 63 19.317 19.317 18.019 1.298 25068
1619 1 4 . 1 1 64 64 GLN N N 64 116.774 116.774 116.269 0.505 25068
1620 1 4 . 1 1 64 64 GLN HA H 64 4.122 4.122 4.358 -0.236 25068
1621 1 4 . 1 1 64 64 GLN C C 64 178.275 178.275 178.371 -0.096 25068
1622 1 4 . 1 1 64 64 GLN CA C 64 58.622 58.622 57.876 0.746 25068
1623 1 4 . 1 1 64 64 GLN CB C 64 31.350 31.350 28.887 2.463 25068
1624 1 4 . 1 1 64 64 GLN H H 64 7.603 7.603 8.201 -0.598 25068
1625 1 4 . 1 1 65 65 LYS N N 65 117.203 117.203 120.132 -2.929 25068
1626 1 4 . 1 1 65 65 LYS HA H 65 4.129 4.129 4.219 -0.090 25068
1627 1 4 . 1 1 65 65 LYS C C 65 178.449 178.449 178.870 -0.421 25068
1628 1 4 . 1 1 65 65 LYS CA C 65 59.891 59.891 58.647 1.244 25068
1629 1 4 . 1 1 65 65 LYS CB C 65 34.351 34.351 32.078 2.273 25068
1630 1 4 . 1 1 65 65 LYS H H 65 7.810 7.810 7.924 -0.114 25068
1631 1 4 . 1 1 66 66 ALA N N 66 122.218 122.218 122.588 -0.370 25068
1632 1 4 . 1 1 66 66 ALA HA H 66 4.290 4.290 4.239 0.051 25068
1633 1 4 . 1 1 66 66 ALA C C 66 176.135 176.135 176.731 -0.596 25068
1634 1 4 . 1 1 66 66 ALA CA C 66 57.745 57.745 56.949 0.796 25068
1635 1 4 . 1 1 66 66 ALA CB C 66 17.033 17.033 16.404 0.629 25068
1636 1 4 . 1 1 66 66 ALA H H 66 7.469 7.469 8.422 -0.953 25068
1637 1 4 . 1 1 67 67 PRO HA H 67 4.142 4.142 4.311 -0.169 25068
1638 1 4 . 1 1 67 67 PRO C C 67 179.591 179.591 178.651 0.940 25068
1639 1 4 . 1 1 67 67 PRO CA C 67 66.960 66.960 65.594 1.366 25068
1640 1 4 . 1 1 67 67 PRO CB C 67 32.014 32.014 31.435 0.579 25068
1641 1 4 . 1 1 68 68 TYR N N 68 117.140 117.140 120.792 -3.652 25068
1642 1 4 . 1 1 68 68 TYR HA H 68 3.940 3.940 4.055 -0.115 25068
1643 1 4 . 1 1 68 68 TYR C C 68 177.733 177.733 177.750 -0.017 25068
1644 1 4 . 1 1 68 68 TYR CA C 68 63.505 63.505 62.233 1.272 25068
1645 1 4 . 1 1 68 68 TYR CB C 68 38.503 38.503 38.644 -0.141 25068
1646 1 4 . 1 1 68 68 TYR H H 68 7.268 7.268 8.352 -1.084 25068
1647 1 4 . 1 1 69 69 GLU N N 69 120.747 120.747 118.233 2.514 25068
1648 1 4 . 1 1 69 69 GLU HA H 69 4.253 4.253 4.009 0.244 25068
1649 1 4 . 1 1 69 69 GLU C C 69 179.805 179.805 178.982 0.823 25068
1650 1 4 . 1 1 69 69 GLU CA C 69 60.145 60.145 59.425 0.720 25068
1651 1 4 . 1 1 69 69 GLU CB C 69 29.808 29.808 29.246 0.562 25068
1652 1 4 . 1 1 69 69 GLU H H 69 8.048 8.048 8.589 -0.541 25068
1653 1 4 . 1 1 70 70 LYS N N 70 120.938 120.938 120.272 0.666 25068
1654 1 4 . 1 1 70 70 LYS HA H 70 4.020 4.020 3.986 0.034 25068
1655 1 4 . 1 1 70 70 LYS C C 70 178.740 178.740 179.114 -0.374 25068
1656 1 4 . 1 1 70 70 LYS CA C 70 60.202 60.202 59.479 0.723 25068
1657 1 4 . 1 1 70 70 LYS CB C 70 32.419 32.419 32.253 0.166 25068
1658 1 4 . 1 1 70 70 LYS H H 70 8.301 8.301 8.180 0.121 25068
1659 1 4 . 1 1 71 71 LYS N N 71 118.427 118.427 118.552 -0.125 25068
1660 1 4 . 1 1 71 71 LYS HA H 71 3.528 3.528 4.026 -0.498 25068
1661 1 4 . 1 1 71 71 LYS C C 71 179.280 179.280 178.741 0.539 25068
1662 1 4 . 1 1 71 71 LYS CA C 71 61.146 61.146 58.886 2.260 25068
1663 1 4 . 1 1 71 71 LYS CB C 71 32.196 32.196 31.837 0.359 25068
1664 1 4 . 1 1 71 71 LYS H H 71 7.234 7.234 8.245 -1.011 25068
1665 1 4 . 1 1 72 72 ALA N N 72 122.126 122.126 121.850 0.276 25068
1666 1 4 . 1 1 72 72 ALA HA H 72 4.357 4.357 3.934 0.423 25068
1667 1 4 . 1 1 72 72 ALA C C 72 180.468 180.468 179.677 0.791 25068
1668 1 4 . 1 1 72 72 ALA CA C 72 56.457 56.457 55.118 1.339 25068
1669 1 4 . 1 1 72 72 ALA CB C 72 19.562 19.562 17.779 1.783 25068
1670 1 4 . 1 1 72 72 ALA H H 72 7.890 7.890 7.859 0.031 25068
1671 1 4 . 1 1 73 73 GLN N N 73 121.659 121.659 118.913 2.746 25068
1672 1 4 . 1 1 73 73 GLN HA H 73 4.029 4.029 3.963 0.066 25068
1673 1 4 . 1 1 73 73 GLN C C 73 179.576 179.576 178.191 1.385 25068
1674 1 4 . 1 1 73 73 GLN CA C 73 60.427 60.427 58.825 1.602 25068
1675 1 4 . 1 1 73 73 GLN CB C 73 28.732 28.732 28.690 0.042 25068
1676 1 4 . 1 1 73 73 GLN H H 73 8.353 8.353 8.111 0.242 25068
1677 1 4 . 1 1 74 74 LEU N N 74 119.752 119.752 121.138 -1.386 25068
1678 1 4 . 1 1 74 74 LEU HA H 74 4.046 4.046 3.833 0.213 25068
1679 1 4 . 1 1 74 74 LEU C C 74 180.424 180.424 179.186 1.238 25068
1680 1 4 . 1 1 74 74 LEU CA C 74 58.675 58.675 58.681 -0.006 25068
1681 1 4 . 1 1 74 74 LEU CB C 74 42.376 42.376 41.610 0.766 25068
1682 1 4 . 1 1 74 74 LEU H H 74 8.160 8.160 8.193 -0.033 25068
1683 1 4 . 1 1 75 75 ASP N N 75 122.159 122.159 118.709 3.450 25068
1684 1 4 . 1 1 75 75 ASP HA H 75 4.988 4.988 4.293 0.695 25068
1685 1 4 . 1 1 75 75 ASP C C 75 178.046 178.046 178.608 -0.562 25068
1686 1 4 . 1 1 75 75 ASP CA C 75 58.191 58.191 57.588 0.603 25068
1687 1 4 . 1 1 75 75 ASP CB C 75 42.958 42.958 40.217 2.741 25068
1688 1 4 . 1 1 75 75 ASP H H 75 8.361 8.361 8.352 0.009 25068
1689 1 4 . 1 1 76 76 LYS N N 76 119.861 119.861 121.484 -1.623 25068
1690 1 4 . 1 1 76 76 LYS HA H 76 3.988 3.988 3.951 0.037 25068
1691 1 4 . 1 1 76 76 LYS C C 76 179.668 179.668 178.719 0.949 25068
1692 1 4 . 1 1 76 76 LYS CA C 76 60.984 60.984 59.429 1.555 25068
1693 1 4 . 1 1 76 76 LYS CB C 76 33.124 33.124 32.362 0.762 25068
1694 1 4 . 1 1 76 76 LYS H H 76 7.940 7.940 7.760 0.180 25068
1695 1 4 . 1 1 77 77 VAL N N 77 121.485 121.485 118.898 2.587 25068
1696 1 4 . 1 1 77 77 VAL HA H 77 3.687 3.687 3.641 0.046 25068
1697 1 4 . 1 1 77 77 VAL C C 77 178.070 178.070 178.014 0.056 25068
1698 1 4 . 1 1 77 77 VAL CA C 77 67.359 67.359 66.928 0.431 25068
1699 1 4 . 1 1 77 77 VAL CB C 77 32.645 32.645 31.255 1.390 25068
1700 1 4 . 1 1 77 77 VAL H H 77 7.401 7.401 8.329 -0.928 25068
1701 1 4 . 1 1 78 78 ARG N N 78 121.960 121.960 119.845 2.115 25068
1702 1 4 . 1 1 78 78 ARG HA H 78 4.010 4.010 3.874 0.136 25068
1703 1 4 . 1 1 78 78 ARG C C 78 179.144 179.144 178.555 0.589 25068
1704 1 4 . 1 1 78 78 ARG CA C 78 60.598 60.598 60.273 0.326 25068
1705 1 4 . 1 1 78 78 ARG CB C 78 28.352 28.352 30.113 -1.761 25068
1706 1 4 . 1 1 78 78 ARG H H 78 7.813 7.813 8.233 -0.420 25068
1707 1 4 . 1 1 79 79 TYR N N 79 120.411 120.411 119.907 0.504 25068
1708 1 4 . 1 1 79 79 TYR HA H 79 3.878 3.878 4.085 -0.207 25068
1709 1 4 . 1 1 79 79 TYR C C 79 176.080 176.080 177.462 -1.382 25068
1710 1 4 . 1 1 79 79 TYR CA C 79 63.669 63.669 61.157 2.512 25068
1711 1 4 . 1 1 79 79 TYR CB C 79 39.758 39.758 38.163 1.595 25068
1712 1 4 . 1 1 79 79 TYR H H 79 8.608 8.608 8.437 0.171 25068
1713 1 4 . 1 1 80 80 SER N N 80 113.726 113.726 114.596 -0.870 25068
1714 1 4 . 1 1 80 80 SER HA H 80 3.880 3.880 3.788 0.092 25068
1715 1 4 . 1 1 80 80 SER C C 80 176.794 176.794 176.611 0.183 25068
1716 1 4 . 1 1 80 80 SER CA C 80 62.969 62.969 62.245 0.724 25068
1717 1 4 . 1 1 80 80 SER CB C 80 63.605 63.605 62.937 0.668 25068
1718 1 4 . 1 1 80 80 SER H H 80 8.234 8.234 8.241 -0.007 25068
1719 1 4 . 1 1 81 81 LYS N N 81 121.920 121.920 121.400 0.520 25068
1720 1 4 . 1 1 81 81 LYS HA H 81 4.029 4.029 4.188 -0.159 25068
1721 1 4 . 1 1 81 81 LYS C C 81 179.342 179.342 178.814 0.528 25068
1722 1 4 . 1 1 81 81 LYS CA C 81 60.138 60.138 58.888 1.250 25068
1723 1 4 . 1 1 81 81 LYS CB C 81 33.238 33.238 32.197 1.040 25068
1724 1 4 . 1 1 81 81 LYS H H 81 7.958 7.958 8.137 -0.179 25068
1725 1 4 . 1 1 82 82 GLU N N 82 119.515 119.515 119.527 -0.012 25068
1726 1 4 . 1 1 82 82 GLU HA H 82 3.945 3.945 4.027 -0.082 25068
1727 1 4 . 1 1 82 82 GLU C C 82 180.689 180.689 179.178 1.511 25068
1728 1 4 . 1 1 82 82 GLU CA C 82 60.920 60.920 59.561 1.359 25068
1729 1 4 . 1 1 82 82 GLU CB C 82 30.885 30.885 29.343 1.542 25068
1730 1 4 . 1 1 82 82 GLU H H 82 8.310 8.310 7.967 0.343 25068
1731 1 4 . 1 1 83 83 ILE N N 83 121.362 121.362 119.990 1.372 25068
1732 1 4 . 1 1 83 83 ILE HA H 83 3.889 3.889 3.605 0.284 25068
1733 1 4 . 1 1 83 83 ILE C C 83 177.207 177.207 177.755 -0.548 25068
1734 1 4 . 1 1 83 83 ILE CA C 83 62.754 62.754 63.343 -0.589 25068
1735 1 4 . 1 1 83 83 ILE CB C 83 37.651 37.651 37.784 -0.133 25068
1736 1 4 . 1 1 83 83 ILE H H 83 8.887 8.887 7.815 1.072 25068
1737 1 4 . 1 1 84 84 GLU N N 84 122.327 122.327 120.268 2.059 25068
1738 1 4 . 1 1 84 84 GLU HA H 84 4.028 4.028 3.814 0.214 25068
1739 1 4 . 1 1 84 84 GLU C C 84 179.047 179.047 178.845 0.202 25068
1740 1 4 . 1 1 84 84 GLU CA C 84 60.045 60.045 60.620 -0.575 25068
1741 1 4 . 1 1 84 84 GLU CB C 84 30.099 30.099 29.534 0.565 25068
1742 1 4 . 1 1 84 84 GLU H H 84 7.289 7.289 8.076 -0.787 25068
1743 1 4 . 1 1 85 85 GLU N N 85 118.046 118.046 119.202 -1.156 25068
1744 1 4 . 1 1 85 85 GLU HA H 85 3.966 3.966 4.010 -0.044 25068
1745 1 4 . 1 1 85 85 GLU C C 85 178.614 178.614 179.124 -0.510 25068
1746 1 4 . 1 1 85 85 GLU CA C 85 59.997 59.997 59.087 0.910 25068
1747 1 4 . 1 1 85 85 GLU CB C 85 30.453 30.453 29.242 1.211 25068
1748 1 4 . 1 1 85 85 GLU H H 85 7.545 7.545 8.183 -0.638 25068
1749 1 4 . 1 1 86 86 TYR N N 86 121.050 121.050 120.063 0.987 25068
1750 1 4 . 1 1 86 86 TYR HA H 86 4.094 4.094 4.241 -0.147 25068
1751 1 4 . 1 1 86 86 TYR C C 86 177.815 177.815 178.276 -0.461 25068
1752 1 4 . 1 1 86 86 TYR CA C 86 62.072 62.072 61.778 0.294 25068
1753 1 4 . 1 1 86 86 TYR CB C 86 39.954 39.954 38.370 1.584 25068
1754 1 4 . 1 1 86 86 TYR H H 86 8.277 8.277 8.253 0.024 25068
1755 1 4 . 1 1 87 87 ARG N N 87 118.353 118.353 118.487 -0.134 25068
1756 1 4 . 1 1 87 87 ARG HA H 87 3.877 3.877 3.980 -0.103 25068
1757 1 4 . 1 1 87 87 ARG C C 87 178.067 178.067 178.695 -0.628 25068
1758 1 4 . 1 1 87 87 ARG CA C 87 59.513 59.513 59.317 0.196 25068
1759 1 4 . 1 1 87 87 ARG CB C 87 31.053 31.053 30.284 0.769 25068
1760 1 4 . 1 1 87 87 ARG H H 87 8.249 8.249 8.438 -0.189 25068
1761 1 4 . 1 1 88 88 LYS N N 88 118.205 118.205 120.224 -2.019 25068
1762 1 4 . 1 1 88 88 LYS HA H 88 3.982 3.982 4.127 -0.145 25068
1763 1 4 . 1 1 88 88 LYS C C 88 178.050 178.050 177.590 0.460 25068
1764 1 4 . 1 1 88 88 LYS CA C 88 59.265 59.265 58.562 0.703 25068
1765 1 4 . 1 1 88 88 LYS CB C 88 33.499 33.499 32.619 0.880 25068
1766 1 4 . 1 1 88 88 LYS H H 88 7.465 7.465 7.895 -0.430 25068
1767 1 4 . 1 1 89 89 LYS N N 89 118.341 118.341 115.180 3.161 25068
1768 1 4 . 1 1 89 89 LYS HA H 89 4.084 4.084 4.478 -0.394 25068
1769 1 4 . 1 1 89 89 LYS C C 89 176.691 176.691 175.681 1.010 25068
1770 1 4 . 1 1 89 89 LYS CA C 89 58.188 58.188 55.490 2.698 25068
1771 1 4 . 1 1 89 89 LYS CB C 89 33.809 33.809 32.112 1.696 25068
1772 1 4 . 1 1 89 89 LYS H H 89 7.580 7.580 7.780 -0.200 25068
1773 1 4 . 1 1 90 90 ASN N N 90 117.604 117.604 118.994 -1.390 25068
1774 1 4 . 1 1 90 90 ASN HA H 90 4.563 4.563 4.821 -0.258 25068
1775 1 4 . 1 1 90 90 ASN C C 90 174.419 174.419 175.427 -1.008 25068
1776 1 4 . 1 1 90 90 ASN CA C 90 54.433 54.433 54.155 0.278 25068
1777 1 4 . 1 1 90 90 ASN CB C 90 40.182 40.182 40.910 -0.728 25068
1778 1 4 . 1 1 90 90 ASN H H 90 7.741 7.741 7.888 -0.147 25068
1779 1 4 . 1 1 91 91 GLN N N 91 111.990 111.990 120.344 -8.354 25068
1780 1 4 . 1 1 91 91 GLN HA H 91 4.213 4.213 4.504 -0.291 25068
1781 1 4 . 1 1 91 91 GLN C C 91 174.970 174.970 175.595 -0.625 25068
1782 1 4 . 1 1 91 91 GLN CA C 91 57.011 57.011 55.173 1.838 25068
1783 1 4 . 1 1 91 91 GLN CB C 91 30.358 30.358 30.104 0.254 25068
1784 1 4 . 1 1 91 91 GLN H H 91 7.925 7.925 7.805 0.120 25068
1785 1 5 . 1 1 14 14 PRO HA H 14 4.322 4.322 4.351 -0.029 25068
1786 1 5 . 1 1 14 14 PRO C C 14 176.783 176.783 177.203 -0.420 25068
1787 1 5 . 1 1 14 14 PRO CA C 14 64.643 64.643 64.385 0.258 25068
1788 1 5 . 1 1 14 14 PRO CB C 14 33.114 33.114 32.209 0.905 25068
1789 1 5 . 1 1 15 15 LEU N N 15 120.158 120.158 116.229 3.929 25068
1790 1 5 . 1 1 15 15 LEU HA H 15 4.238 4.238 4.687 -0.449 25068
1791 1 5 . 1 1 15 15 LEU C C 15 176.361 176.361 174.995 1.366 25068
1792 1 5 . 1 1 15 15 LEU CA C 15 55.395 55.395 53.816 1.579 25068
1793 1 5 . 1 1 15 15 LEU CB C 15 42.619 42.619 41.580 1.040 25068
1794 1 5 . 1 1 15 15 LEU H H 15 8.189 8.189 7.708 0.481 25068
1795 1 5 . 1 1 16 16 ALA N N 16 124.269 124.269 121.859 2.410 25068
1796 1 5 . 1 1 16 16 ALA HA H 16 3.496 3.496 4.953 -1.457 25068
1797 1 5 . 1 1 16 16 ALA C C 16 175.124 175.124 175.147 -0.023 25068
1798 1 5 . 1 1 16 16 ALA CA C 16 51.457 51.457 49.891 1.566 25068
1799 1 5 . 1 1 16 16 ALA CB C 16 18.105 18.105 20.136 -2.031 25068
1800 1 5 . 1 1 16 16 ALA H H 16 7.500 7.500 7.168 0.332 25068
1801 1 5 . 1 1 17 17 PRO HA H 17 4.157 4.157 4.523 -0.366 25068
1802 1 5 . 1 1 17 17 PRO C C 17 176.396 176.396 175.524 0.872 25068
1803 1 5 . 1 1 17 17 PRO CA C 17 63.588 63.588 62.242 1.346 25068
1804 1 5 . 1 1 17 17 PRO CB C 17 32.850 32.850 32.399 0.451 25068
1805 1 5 . 1 1 18 18 LYS N N 18 124.070 124.070 121.100 2.970 25068
1806 1 5 . 1 1 18 18 LYS HA H 18 4.147 4.147 4.260 -0.113 25068
1807 1 5 . 1 1 18 18 LYS C C 18 177.543 177.543 176.314 1.229 25068
1808 1 5 . 1 1 18 18 LYS CA C 18 57.081 57.081 56.527 0.554 25068
1809 1 5 . 1 1 18 18 LYS CB C 18 33.573 33.573 32.672 0.901 25068
1810 1 5 . 1 1 18 18 LYS H H 18 8.886 8.886 8.307 0.579 25068
1811 1 5 . 1 1 19 19 ARG N N 19 122.242 122.242 123.944 -1.702 25068
1812 1 5 . 1 1 19 19 ARG HA H 19 3.437 3.437 4.416 -0.979 25068
1813 1 5 . 1 1 19 19 ARG C C 19 175.409 175.409 174.380 1.029 25068
1814 1 5 . 1 1 19 19 ARG CA C 19 57.545 57.545 55.416 2.130 25068
1815 1 5 . 1 1 19 19 ARG CB C 19 31.149 31.149 30.583 0.566 25068
1816 1 5 . 1 1 19 19 ARG H H 19 8.286 8.286 8.178 0.108 25068
1817 1 5 . 1 1 20 20 ALA N N 20 123.176 123.176 122.897 0.279 25068
1818 1 5 . 1 1 20 20 ALA HA H 20 4.139 4.139 4.615 -0.476 25068
1819 1 5 . 1 1 20 20 ALA C C 20 177.843 177.843 177.122 0.721 25068
1820 1 5 . 1 1 20 20 ALA CA C 20 52.391 52.391 51.146 1.245 25068
1821 1 5 . 1 1 20 20 ALA CB C 20 19.397 19.397 20.080 -0.683 25068
1822 1 5 . 1 1 20 20 ALA H H 20 7.348 7.348 8.173 -0.825 25068
1823 1 5 . 1 1 21 21 LEU N N 21 125.680 125.680 120.923 4.757 25068
1824 1 5 . 1 1 21 21 LEU HA H 21 4.194 4.194 4.191 0.003 25068
1825 1 5 . 1 1 21 21 LEU C C 21 177.091 177.091 176.331 0.760 25068
1826 1 5 . 1 1 21 21 LEU CA C 21 55.472 55.472 54.779 0.693 25068
1827 1 5 . 1 1 21 21 LEU CB C 21 43.931 43.931 43.060 0.870 25068
1828 1 5 . 1 1 21 21 LEU H H 21 9.055 9.055 8.232 0.823 25068
1829 1 5 . 1 1 22 22 SER N N 22 116.686 116.686 114.386 2.300 25068
1830 1 5 . 1 1 22 22 SER HA H 22 4.427 4.427 4.473 -0.046 25068
1831 1 5 . 1 1 22 22 SER C C 22 174.241 174.241 175.845 -1.604 25068
1832 1 5 . 1 1 22 22 SER CA C 22 57.564 57.564 57.569 -0.005 25068
1833 1 5 . 1 1 22 22 SER CB C 22 66.568 66.568 64.226 2.342 25068
1834 1 5 . 1 1 22 22 SER H H 22 7.549 7.549 8.129 -0.580 25068
1835 1 5 . 1 1 23 23 ALA N N 23 123.382 123.382 125.012 -1.630 25068
1836 1 5 . 1 1 23 23 ALA HA H 23 4.163 4.163 4.088 0.075 25068
1837 1 5 . 1 1 23 23 ALA C C 23 178.863 178.863 178.958 -0.095 25068
1838 1 5 . 1 1 23 23 ALA CA C 23 57.124 57.124 54.868 2.256 25068
1839 1 5 . 1 1 23 23 ALA CB C 23 19.441 19.441 18.503 0.938 25068
1840 1 5 . 1 1 23 23 ALA H H 23 9.035 9.035 8.858 0.177 25068
1841 1 5 . 1 1 24 24 TYR N N 24 115.979 115.979 119.588 -3.609 25068
1842 1 5 . 1 1 24 24 TYR HA H 24 2.590 2.590 4.647 -2.057 25068
1843 1 5 . 1 1 24 24 TYR C C 24 176.257 176.257 177.587 -1.330 25068
1844 1 5 . 1 1 24 24 TYR CA C 24 60.940 60.940 60.741 0.199 25068
1845 1 5 . 1 1 24 24 TYR CB C 24 39.106 39.106 37.954 1.152 25068
1846 1 5 . 1 1 24 24 TYR H H 24 8.206 8.206 8.039 0.167 25068
1847 1 5 . 1 1 25 25 MET N N 25 116.391 116.391 116.841 -0.450 25068
1848 1 5 . 1 1 25 25 MET HA H 25 3.643 3.643 3.824 -0.181 25068
1849 1 5 . 1 1 25 25 MET C C 25 180.177 180.177 178.714 1.463 25068
1850 1 5 . 1 1 25 25 MET CA C 25 59.161 59.161 58.117 1.044 25068
1851 1 5 . 1 1 25 25 MET CB C 25 32.748 32.748 31.111 1.637 25068
1852 1 5 . 1 1 25 25 MET H H 25 7.433 7.433 8.320 -0.887 25068
1853 1 5 . 1 1 26 26 PHE N N 26 118.699 118.699 120.224 -1.525 25068
1854 1 5 . 1 1 26 26 PHE HA H 26 4.063 4.063 4.087 -0.024 25068
1855 1 5 . 1 1 26 26 PHE C C 26 178.055 178.055 177.622 0.433 25068
1856 1 5 . 1 1 26 26 PHE CA C 26 64.840 64.840 62.021 2.819 25068
1857 1 5 . 1 1 26 26 PHE CB C 26 40.437 40.437 38.641 1.796 25068
1858 1 5 . 1 1 26 26 PHE H H 26 7.982 7.982 8.139 -0.157 25068
1859 1 5 . 1 1 27 27 TYR N N 27 123.888 123.888 119.815 4.073 25068
1860 1 5 . 1 1 27 27 TYR HA H 27 3.576 3.576 4.012 -0.436 25068
1861 1 5 . 1 1 27 27 TYR C C 27 176.691 176.691 177.550 -0.859 25068
1862 1 5 . 1 1 27 27 TYR CA C 27 62.831 62.831 62.282 0.549 25068
1863 1 5 . 1 1 27 27 TYR CB C 27 39.238 39.238 38.418 0.820 25068
1864 1 5 . 1 1 27 27 TYR H H 27 7.843 7.843 7.857 -0.014 25068
1865 1 5 . 1 1 28 28 VAL N N 28 119.501 119.501 119.135 0.366 25068
1866 1 5 . 1 1 28 28 VAL HA H 28 2.912 2.912 3.425 -0.513 25068
1867 1 5 . 1 1 28 28 VAL C C 28 177.067 177.067 177.741 -0.674 25068
1868 1 5 . 1 1 28 28 VAL CA C 28 67.149 67.149 67.830 -0.681 25068
1869 1 5 . 1 1 28 28 VAL CB C 28 32.599 32.599 31.238 1.361 25068
1870 1 5 . 1 1 28 28 VAL H H 28 8.370 8.370 8.277 0.093 25068
1871 1 5 . 1 1 29 29 LYS N N 29 114.512 114.512 118.327 -3.815 25068
1872 1 5 . 1 1 29 29 LYS HA H 29 3.676 3.676 3.815 -0.139 25068
1873 1 5 . 1 1 29 29 LYS C C 29 178.627 178.627 178.535 0.092 25068
1874 1 5 . 1 1 29 29 LYS CA C 29 60.349 60.349 59.625 0.724 25068
1875 1 5 . 1 1 29 29 LYS CB C 29 33.278 33.278 31.592 1.686 25068
1876 1 5 . 1 1 29 29 LYS H H 29 6.821 6.821 8.043 -1.222 25068
1877 1 5 . 1 1 30 30 ASP N N 30 116.793 116.793 121.061 -4.268 25068
1878 1 5 . 1 1 30 30 ASP HA H 30 4.466 4.466 4.144 0.322 25068
1879 1 5 . 1 1 30 30 ASP C C 30 178.615 178.615 178.431 0.184 25068
1880 1 5 . 1 1 30 30 ASP CA C 30 57.223 57.223 57.148 0.075 25068
1881 1 5 . 1 1 30 30 ASP CB C 30 42.066 42.066 40.230 1.836 25068
1882 1 5 . 1 1 30 30 ASP H H 30 6.875 6.875 7.997 -1.122 25068
1883 1 5 . 1 1 31 31 LYS N N 31 122.423 122.423 119.388 3.035 25068
1884 1 5 . 1 1 31 31 LYS HA H 31 3.813 3.813 3.942 -0.129 25068
1885 1 5 . 1 1 31 31 LYS C C 31 178.443 178.443 179.156 -0.713 25068
1886 1 5 . 1 1 31 31 LYS CA C 31 57.494 57.494 59.187 -1.693 25068
1887 1 5 . 1 1 31 31 LYS CB C 31 32.539 32.539 32.348 0.191 25068
1888 1 5 . 1 1 31 31 LYS H H 31 8.910 8.910 8.121 0.789 25068
1889 1 5 . 1 1 32 32 ARG N N 32 117.823 117.823 120.010 -2.187 25068
1890 1 5 . 1 1 32 32 ARG HA H 32 3.540 3.540 3.997 -0.457 25068
1891 1 5 . 1 1 32 32 ARG C C 32 176.951 176.951 178.682 -1.731 25068
1892 1 5 . 1 1 32 32 ARG CA C 32 61.259 61.259 59.723 1.536 25068
1893 1 5 . 1 1 32 32 ARG CB C 32 30.668 30.668 30.122 0.546 25068
1894 1 5 . 1 1 32 32 ARG H H 32 8.501 8.501 7.960 0.541 25068
1895 1 5 . 1 1 33 33 LEU N N 33 114.878 114.878 119.298 -4.420 25068
1896 1 5 . 1 1 33 33 LEU HA H 33 3.871 3.871 3.849 0.022 25068
1897 1 5 . 1 1 33 33 LEU C C 33 179.180 179.180 179.054 0.126 25068
1898 1 5 . 1 1 33 33 LEU CA C 33 58.377 58.377 58.448 -0.071 25068
1899 1 5 . 1 1 33 33 LEU CB C 33 42.429 42.429 41.726 0.703 25068
1900 1 5 . 1 1 33 33 LEU H H 33 6.549 6.549 8.074 -1.525 25068
1901 1 5 . 1 1 34 34 GLU N N 34 118.637 118.637 119.541 -0.904 25068
1902 1 5 . 1 1 34 34 GLU HA H 34 3.866 3.866 3.870 -0.004 25068
1903 1 5 . 1 1 34 34 GLU C C 34 178.988 178.988 179.081 -0.093 25068
1904 1 5 . 1 1 34 34 GLU CA C 34 60.248 60.248 59.724 0.524 25068
1905 1 5 . 1 1 34 34 GLU CB C 34 31.325 31.325 29.511 1.814 25068
1906 1 5 . 1 1 34 34 GLU H H 34 7.135 7.135 7.874 -0.739 25068
1907 1 5 . 1 1 35 35 ILE N N 35 119.142 119.142 119.492 -0.350 25068
1908 1 5 . 1 1 35 35 ILE HA H 35 3.693 3.693 3.733 -0.040 25068
1909 1 5 . 1 1 35 35 ILE C C 35 177.789 177.789 178.773 -0.984 25068
1910 1 5 . 1 1 35 35 ILE CA C 35 65.753 65.753 65.330 0.423 25068
1911 1 5 . 1 1 35 35 ILE CB C 35 38.940 38.940 37.907 1.033 25068
1912 1 5 . 1 1 35 35 ILE H H 35 8.076 8.076 8.320 -0.244 25068
1913 1 5 . 1 1 36 36 ILE N N 36 116.296 116.296 118.699 -2.403 25068
1914 1 5 . 1 1 36 36 ILE HA H 36 3.640 3.640 3.958 -0.318 25068
1915 1 5 . 1 1 36 36 ILE C C 36 177.270 177.270 177.645 -0.375 25068
1916 1 5 . 1 1 36 36 ILE CA C 36 64.633 64.633 64.364 0.270 25068
1917 1 5 . 1 1 36 36 ILE CB C 36 38.718 38.718 37.750 0.968 25068
1918 1 5 . 1 1 36 36 ILE H H 36 7.754 7.754 8.026 -0.272 25068
1919 1 5 . 1 1 37 37 LYS N N 37 119.626 119.626 120.534 -0.908 25068
1920 1 5 . 1 1 37 37 LYS HA H 37 3.922 3.922 4.103 -0.181 25068
1921 1 5 . 1 1 37 37 LYS C C 37 178.129 178.129 178.292 -0.163 25068
1922 1 5 . 1 1 37 37 LYS CA C 37 59.996 59.996 58.940 1.056 25068
1923 1 5 . 1 1 37 37 LYS CB C 37 33.487 33.487 32.775 0.712 25068
1924 1 5 . 1 1 37 37 LYS H H 37 7.413 7.413 7.839 -0.426 25068
1925 1 5 . 1 1 38 38 GLU N N 38 116.708 116.708 116.651 0.057 25068
1926 1 5 . 1 1 38 38 GLU HA H 38 4.060 4.060 4.251 -0.191 25068
1927 1 5 . 1 1 38 38 GLU C C 38 177.004 177.004 177.234 -0.230 25068
1928 1 5 . 1 1 38 38 GLU CA C 38 59.070 59.070 57.731 1.339 25068
1929 1 5 . 1 1 38 38 GLU CB C 38 31.665 31.665 30.513 1.152 25068
1930 1 5 . 1 1 38 38 GLU H H 38 7.354 7.354 8.043 -0.689 25068
1931 1 5 . 1 1 39 39 LYS N N 39 118.621 118.621 119.588 -0.967 25068
1932 1 5 . 1 1 39 39 LYS HA H 39 4.690 4.690 4.843 -0.153 25068
1933 1 5 . 1 1 39 39 LYS C C 39 172.792 172.792 174.999 -2.207 25068
1934 1 5 . 1 1 39 39 LYS CA C 39 54.596 54.596 53.319 1.277 25068
1935 1 5 . 1 1 39 39 LYS CB C 39 33.945 33.945 34.129 -0.184 25068
1936 1 5 . 1 1 39 39 LYS H H 39 8.176 8.176 7.723 0.453 25068
1937 1 5 . 1 1 40 40 PRO HA H 40 4.429 4.429 4.387 0.042 25068
1938 1 5 . 1 1 40 40 PRO C C 40 179.829 179.829 177.198 2.631 25068
1939 1 5 . 1 1 40 40 PRO CA C 40 66.040 66.040 64.603 1.437 25068
1940 1 5 . 1 1 40 40 PRO CB C 40 32.606 32.606 31.991 0.615 25068
1941 1 5 . 1 1 41 41 GLU N N 41 119.150 119.150 118.867 0.283 25068
1942 1 5 . 1 1 41 41 GLU HA H 41 4.143 4.143 4.225 -0.082 25068
1943 1 5 . 1 1 41 41 GLU C C 41 178.502 178.502 178.344 0.158 25068
1944 1 5 . 1 1 41 41 GLU CA C 41 59.485 59.485 58.445 1.040 25068
1945 1 5 . 1 1 41 41 GLU CB C 41 28.574 28.574 29.524 -0.950 25068
1946 1 5 . 1 1 41 41 GLU H H 41 9.789 9.789 8.668 1.121 25068
1947 1 5 . 1 1 42 42 LEU N N 42 121.443 121.443 120.039 1.404 25068
1948 1 5 . 1 1 42 42 LEU HA H 42 4.185 4.185 4.666 -0.481 25068
1949 1 5 . 1 1 42 42 LEU C C 42 177.815 177.815 177.721 0.094 25068
1950 1 5 . 1 1 42 42 LEU CA C 42 56.730 56.730 54.522 2.208 25068
1951 1 5 . 1 1 42 42 LEU CB C 42 42.013 42.013 41.915 0.098 25068
1952 1 5 . 1 1 42 42 LEU H H 42 8.312 8.312 7.589 0.723 25068
1953 1 5 . 1 1 43 43 ALA N N 43 119.949 119.949 121.525 -1.576 25068
1954 1 5 . 1 1 43 43 ALA HA H 43 3.746 3.746 4.049 -0.303 25068
1955 1 5 . 1 1 43 43 ALA C C 43 178.635 178.635 177.961 0.674 25068
1956 1 5 . 1 1 43 43 ALA CA C 43 56.164 56.164 54.154 2.010 25068
1957 1 5 . 1 1 43 43 ALA CB C 43 19.670 19.670 18.517 1.153 25068
1958 1 5 . 1 1 43 43 ALA H H 43 7.554 7.554 7.426 0.128 25068
1959 1 5 . 1 1 44 44 LYS N N 44 112.690 112.690 116.564 -3.874 25068
1960 1 5 . 1 1 44 44 LYS HA H 44 4.232 4.232 4.443 -0.211 25068
1961 1 5 . 1 1 44 44 LYS C C 44 175.949 175.949 175.710 0.239 25068
1962 1 5 . 1 1 44 44 LYS CA C 44 56.987 56.987 55.555 1.432 25068
1963 1 5 . 1 1 44 44 LYS CB C 44 33.345 33.345 32.228 1.117 25068
1964 1 5 . 1 1 44 44 LYS H H 44 7.560 7.560 7.850 -0.290 25068
1965 1 5 . 1 1 45 45 ASP N N 45 122.529 122.529 122.511 0.018 25068
1966 1 5 . 1 1 45 45 ASP HA H 45 4.749 4.749 4.886 -0.137 25068
1967 1 5 . 1 1 45 45 ASP C C 45 174.677 174.677 176.083 -1.406 25068
1968 1 5 . 1 1 45 45 ASP CA C 45 53.030 53.030 52.852 0.178 25068
1969 1 5 . 1 1 45 45 ASP CB C 45 41.549 41.549 40.103 1.446 25068
1970 1 5 . 1 1 45 45 ASP H H 45 7.672 7.672 8.109 -0.437 25068
1971 1 5 . 1 1 46 46 VAL N N 46 121.529 121.529 122.387 -0.858 25068
1972 1 5 . 1 1 46 46 VAL HA H 46 3.639 3.639 3.571 0.068 25068
1973 1 5 . 1 1 46 46 VAL C C 46 179.102 179.102 177.651 1.451 25068
1974 1 5 . 1 1 46 46 VAL CA C 46 66.430 66.430 66.587 -0.157 25068
1975 1 5 . 1 1 46 46 VAL CB C 46 32.650 32.650 31.668 0.982 25068
1976 1 5 . 1 1 46 46 VAL H H 46 7.808 7.808 8.031 -0.223 25068
1977 1 5 . 1 1 47 47 ALA N N 47 123.933 123.933 120.827 3.106 25068
1978 1 5 . 1 1 47 47 ALA HA H 47 4.112 4.112 3.967 0.145 25068
1979 1 5 . 1 1 47 47 ALA C C 47 180.665 180.665 179.622 1.043 25068
1980 1 5 . 1 1 47 47 ALA CA C 47 55.822 55.822 55.191 0.631 25068
1981 1 5 . 1 1 47 47 ALA CB C 47 19.129 19.129 18.166 0.963 25068
1982 1 5 . 1 1 47 47 ALA H H 47 8.505 8.505 8.241 0.264 25068
1983 1 5 . 1 1 48 48 GLN N N 48 120.047 120.047 118.817 1.230 25068
1984 1 5 . 1 1 48 48 GLN HA H 48 4.033 4.033 4.130 -0.097 25068
1985 1 5 . 1 1 48 48 GLN C C 48 178.486 178.486 178.235 0.251 25068
1986 1 5 . 1 1 48 48 GLN CA C 48 59.436 59.436 58.473 0.963 25068
1987 1 5 . 1 1 48 48 GLN CB C 48 29.436 29.436 28.033 1.403 25068
1988 1 5 . 1 1 48 48 GLN H H 48 7.852 7.852 7.567 0.285 25068
1989 1 5 . 1 1 49 49 VAL N N 49 119.185 119.185 116.969 2.216 25068
1990 1 5 . 1 1 49 49 VAL HA H 49 3.424 3.424 3.652 -0.228 25068
1991 1 5 . 1 1 49 49 VAL C C 49 177.519 177.519 178.192 -0.673 25068
1992 1 5 . 1 1 49 49 VAL CA C 49 68.854 68.854 66.021 2.833 25068
1993 1 5 . 1 1 49 49 VAL CB C 49 32.454 32.454 30.232 2.222 25068
1994 1 5 . 1 1 49 49 VAL H H 49 7.984 7.984 8.026 -0.042 25068
1995 1 5 . 1 1 50 50 GLY N N 50 104.919 104.919 108.581 -3.662 25068
1996 1 5 . 1 1 50 50 GLY C C 50 176.825 176.825 175.753 1.072 25068
1997 1 5 . 1 1 50 50 GLY CA C 50 48.398 48.398 47.417 0.981 25068
1998 1 5 . 1 1 50 50 GLY H H 50 8.020 8.020 8.425 -0.405 25068
1999 1 5 . 1 1 51 51 LYS N N 51 123.422 123.422 122.923 0.499 25068
2000 1 5 . 1 1 51 51 LYS HA H 51 4.032 4.032 4.089 -0.057 25068
2001 1 5 . 1 1 51 51 LYS C C 51 179.332 179.332 178.970 0.362 25068
2002 1 5 . 1 1 51 51 LYS CA C 51 60.246 60.246 59.104 1.142 25068
2003 1 5 . 1 1 51 51 LYS CB C 51 33.626 33.626 32.247 1.379 25068
2004 1 5 . 1 1 51 51 LYS H H 51 7.699 7.699 7.894 -0.195 25068
2005 1 5 . 1 1 52 52 LEU N N 52 120.442 120.442 119.936 0.506 25068
2006 1 5 . 1 1 52 52 LEU HA H 52 4.041 4.041 3.976 0.065 25068
2007 1 5 . 1 1 52 52 LEU C C 52 180.984 180.984 178.800 2.184 25068
2008 1 5 . 1 1 52 52 LEU CA C 52 58.855 58.855 58.176 0.679 25068
2009 1 5 . 1 1 52 52 LEU CB C 52 43.046 43.046 41.677 1.369 25068
2010 1 5 . 1 1 52 52 LEU H H 52 8.088 8.088 7.850 0.238 25068
2011 1 5 . 1 1 53 53 ILE N N 53 121.249 121.249 119.428 1.821 25068
2012 1 5 . 1 1 53 53 ILE HA H 53 3.557 3.557 3.892 -0.335 25068
2013 1 5 . 1 1 53 53 ILE C C 53 177.945 177.945 178.668 -0.723 25068
2014 1 5 . 1 1 53 53 ILE CA C 53 67.431 67.431 62.984 4.447 25068
2015 1 5 . 1 1 53 53 ILE CB C 53 38.887 38.887 36.085 2.802 25068
2016 1 5 . 1 1 53 53 ILE H H 53 8.475 8.475 8.200 0.275 25068
2017 1 5 . 1 1 54 54 GLY N N 54 107.755 107.755 107.907 -0.152 25068
2018 1 5 . 1 1 54 54 GLY C C 54 177.691 177.691 176.462 1.229 25068
2019 1 5 . 1 1 54 54 GLY CA C 54 48.997 48.997 47.616 1.381 25068
2020 1 5 . 1 1 54 54 GLY H H 54 8.130 8.130 8.496 -0.366 25068
2021 1 5 . 1 1 55 55 GLU N N 55 122.138 122.138 122.205 -0.067 25068
2022 1 5 . 1 1 55 55 GLU HA H 55 4.032 4.032 3.994 0.038 25068
2023 1 5 . 1 1 55 55 GLU C C 55 179.146 179.146 179.038 0.108 25068
2024 1 5 . 1 1 55 55 GLU CA C 55 59.958 59.958 59.385 0.573 25068
2025 1 5 . 1 1 55 55 GLU CB C 55 30.551 30.551 29.502 1.049 25068
2026 1 5 . 1 1 55 55 GLU H H 55 8.089 8.089 8.181 -0.092 25068
2027 1 5 . 1 1 56 56 ALA N N 56 122.985 122.985 122.269 0.716 25068
2028 1 5 . 1 1 56 56 ALA HA H 56 4.107 4.107 4.099 0.008 25068
2029 1 5 . 1 1 56 56 ALA C C 56 181.177 181.177 179.491 1.686 25068
2030 1 5 . 1 1 56 56 ALA CA C 56 56.414 56.414 55.178 1.236 25068
2031 1 5 . 1 1 56 56 ALA CB C 56 19.948 19.948 18.517 1.431 25068
2032 1 5 . 1 1 56 56 ALA H H 56 7.947 7.947 8.410 -0.463 25068
2033 1 5 . 1 1 57 57 TRP N N 57 120.485 120.485 120.519 -0.034 25068
2034 1 5 . 1 1 57 57 TRP HA H 57 3.940 3.940 4.225 -0.285 25068
2035 1 5 . 1 1 57 57 TRP C C 57 178.537 178.537 179.145 -0.608 25068
2036 1 5 . 1 1 57 57 TRP CA C 57 60.633 60.633 59.131 1.502 25068
2037 1 5 . 1 1 57 57 TRP CB C 57 31.681 31.681 29.336 2.345 25068
2038 1 5 . 1 1 57 57 TRP H H 57 8.910 8.910 8.160 0.750 25068
2039 1 5 . 1 1 58 58 GLY N N 58 102.004 102.004 106.551 -4.547 25068
2040 1 5 . 1 1 58 58 GLY C C 58 174.723 174.723 175.173 -0.450 25068
2041 1 5 . 1 1 58 58 GLY CA C 58 47.091 47.091 46.286 0.805 25068
2042 1 5 . 1 1 58 58 GLY H H 58 7.668 7.668 7.956 -0.288 25068
2043 1 5 . 1 1 59 59 GLN N N 59 116.202 116.202 117.273 -1.071 25068
2044 1 5 . 1 1 59 59 GLN HA H 59 4.259 4.259 4.251 0.008 25068
2045 1 5 . 1 1 59 59 GLN C C 59 176.221 176.221 176.414 -0.193 25068
2046 1 5 . 1 1 59 59 GLN CA C 59 55.967 55.967 54.974 0.993 25068
2047 1 5 . 1 1 59 59 GLN CB C 59 30.741 30.741 29.219 1.522 25068
2048 1 5 . 1 1 59 59 GLN H H 59 7.189 7.189 7.828 -0.639 25068
2049 1 5 . 1 1 60 60 LEU N N 60 120.776 120.776 121.252 -0.476 25068
2050 1 5 . 1 1 60 60 LEU HA H 60 4.185 4.185 4.100 0.085 25068
2051 1 5 . 1 1 60 60 LEU C C 60 177.372 177.372 177.009 0.363 25068
2052 1 5 . 1 1 60 60 LEU CA C 60 56.061 56.061 55.896 0.165 25068
2053 1 5 . 1 1 60 60 LEU CB C 60 43.696 43.696 42.739 0.957 25068
2054 1 5 . 1 1 60 60 LEU H H 60 6.968 6.968 7.446 -0.478 25068
2055 1 5 . 1 1 61 61 SER N N 61 120.432 120.432 118.214 2.218 25068
2056 1 5 . 1 1 61 61 SER HA H 61 4.582 4.582 4.838 -0.256 25068
2057 1 5 . 1 1 61 61 SER C C 61 173.500 173.500 173.649 -0.149 25068
2058 1 5 . 1 1 61 61 SER CA C 61 57.204 57.204 56.191 1.013 25068
2059 1 5 . 1 1 61 61 SER CB C 61 63.980 63.980 63.871 0.109 25068
2060 1 5 . 1 1 61 61 SER H H 61 8.885 8.885 8.217 0.668 25068
2061 1 5 . 1 1 63 63 ALA HA H 63 4.089 4.089 4.142 -0.053 25068
2062 1 5 . 1 1 63 63 ALA C C 63 180.570 180.570 179.191 1.379 25068
2063 1 5 . 1 1 63 63 ALA CA C 63 56.005 56.005 54.845 1.160 25068
2064 1 5 . 1 1 63 63 ALA CB C 63 19.317 19.317 18.192 1.125 25068
2065 1 5 . 1 1 64 64 GLN N N 64 116.774 116.774 116.530 0.244 25068
2066 1 5 . 1 1 64 64 GLN HA H 64 4.122 4.122 4.404 -0.282 25068
2067 1 5 . 1 1 64 64 GLN C C 64 178.275 178.275 178.376 -0.101 25068
2068 1 5 . 1 1 64 64 GLN CA C 64 58.622 58.622 58.265 0.357 25068
2069 1 5 . 1 1 64 64 GLN CB C 64 31.350 31.350 28.722 2.628 25068
2070 1 5 . 1 1 64 64 GLN H H 64 7.603 7.603 7.909 -0.306 25068
2071 1 5 . 1 1 65 65 LYS N N 65 117.203 117.203 120.835 -3.632 25068
2072 1 5 . 1 1 65 65 LYS HA H 65 4.129 4.129 4.221 -0.092 25068
2073 1 5 . 1 1 65 65 LYS C C 65 178.449 178.449 178.775 -0.326 25068
2074 1 5 . 1 1 65 65 LYS CA C 65 59.891 59.891 58.670 1.221 25068
2075 1 5 . 1 1 65 65 LYS CB C 65 34.351 34.351 32.150 2.201 25068
2076 1 5 . 1 1 65 65 LYS H H 65 7.810 7.810 7.910 -0.100 25068
2077 1 5 . 1 1 66 66 ALA N N 66 122.218 122.218 122.627 -0.409 25068
2078 1 5 . 1 1 66 66 ALA HA H 66 4.290 4.290 4.230 0.060 25068
2079 1 5 . 1 1 66 66 ALA C C 66 176.135 176.135 176.733 -0.598 25068
2080 1 5 . 1 1 66 66 ALA CA C 66 57.745 57.745 56.951 0.794 25068
2081 1 5 . 1 1 66 66 ALA CB C 66 17.033 17.033 16.387 0.645 25068
2082 1 5 . 1 1 66 66 ALA H H 66 7.469 7.469 8.547 -1.078 25068
2083 1 5 . 1 1 67 67 PRO HA H 67 4.142 4.142 4.321 -0.179 25068
2084 1 5 . 1 1 67 67 PRO C C 67 179.591 179.591 178.672 0.919 25068
2085 1 5 . 1 1 67 67 PRO CA C 67 66.960 66.960 65.612 1.348 25068
2086 1 5 . 1 1 67 67 PRO CB C 67 32.014 32.014 31.434 0.580 25068
2087 1 5 . 1 1 68 68 TYR N N 68 117.140 117.140 120.607 -3.467 25068
2088 1 5 . 1 1 68 68 TYR HA H 68 3.940 3.940 4.028 -0.088 25068
2089 1 5 . 1 1 68 68 TYR C C 68 177.733 177.733 177.579 0.154 25068
2090 1 5 . 1 1 68 68 TYR CA C 68 63.505 63.505 62.070 1.435 25068
2091 1 5 . 1 1 68 68 TYR CB C 68 38.503 38.503 38.453 0.050 25068
2092 1 5 . 1 1 68 68 TYR H H 68 7.268 7.268 8.410 -1.142 25068
2093 1 5 . 1 1 69 69 GLU N N 69 120.747 120.747 118.423 2.324 25068
2094 1 5 . 1 1 69 69 GLU HA H 69 4.253 4.253 3.851 0.402 25068
2095 1 5 . 1 1 69 69 GLU C C 69 179.805 179.805 178.700 1.105 25068
2096 1 5 . 1 1 69 69 GLU CA C 69 60.145 60.145 59.773 0.372 25068
2097 1 5 . 1 1 69 69 GLU CB C 69 29.808 29.808 29.504 0.304 25068
2098 1 5 . 1 1 69 69 GLU H H 69 8.048 8.048 8.636 -0.588 25068
2099 1 5 . 1 1 70 70 LYS N N 70 120.938 120.938 120.788 0.150 25068
2100 1 5 . 1 1 70 70 LYS HA H 70 4.020 4.020 4.018 0.002 25068
2101 1 5 . 1 1 70 70 LYS C C 70 178.740 178.740 179.064 -0.324 25068
2102 1 5 . 1 1 70 70 LYS CA C 70 60.202 60.202 59.130 1.072 25068
2103 1 5 . 1 1 70 70 LYS CB C 70 32.419 32.419 32.000 0.419 25068
2104 1 5 . 1 1 70 70 LYS H H 70 8.301 8.301 8.156 0.145 25068
2105 1 5 . 1 1 71 71 LYS N N 71 118.427 118.427 118.278 0.149 25068
2106 1 5 . 1 1 71 71 LYS HA H 71 3.528 3.528 4.052 -0.524 25068
2107 1 5 . 1 1 71 71 LYS C C 71 179.280 179.280 178.637 0.643 25068
2108 1 5 . 1 1 71 71 LYS CA C 71 61.146 61.146 59.363 1.783 25068
2109 1 5 . 1 1 71 71 LYS CB C 71 32.196 32.196 32.020 0.176 25068
2110 1 5 . 1 1 71 71 LYS H H 71 7.234 7.234 8.300 -1.066 25068
2111 1 5 . 1 1 72 72 ALA N N 72 122.126 122.126 122.593 -0.467 25068
2112 1 5 . 1 1 72 72 ALA HA H 72 4.357 4.357 3.848 0.509 25068
2113 1 5 . 1 1 72 72 ALA C C 72 180.468 180.468 179.458 1.010 25068
2114 1 5 . 1 1 72 72 ALA CA C 72 56.457 56.457 55.236 1.220 25068
2115 1 5 . 1 1 72 72 ALA CB C 72 19.562 19.562 17.775 1.787 25068
2116 1 5 . 1 1 72 72 ALA H H 72 7.890 7.890 7.778 0.112 25068
2117 1 5 . 1 1 73 73 GLN N N 73 121.659 121.659 118.972 2.687 25068
2118 1 5 . 1 1 73 73 GLN HA H 73 4.029 4.029 4.036 -0.007 25068
2119 1 5 . 1 1 73 73 GLN C C 73 179.576 179.576 178.281 1.295 25068
2120 1 5 . 1 1 73 73 GLN CA C 73 60.427 60.427 58.930 1.497 25068
2121 1 5 . 1 1 73 73 GLN CB C 73 28.732 28.732 28.716 0.016 25068
2122 1 5 . 1 1 73 73 GLN H H 73 8.353 8.353 8.137 0.216 25068
2123 1 5 . 1 1 74 74 LEU N N 74 119.752 119.752 120.635 -0.883 25068
2124 1 5 . 1 1 74 74 LEU HA H 74 4.046 4.046 3.819 0.227 25068
2125 1 5 . 1 1 74 74 LEU C C 74 180.424 180.424 179.158 1.266 25068
2126 1 5 . 1 1 74 74 LEU CA C 74 58.675 58.675 58.022 0.653 25068
2127 1 5 . 1 1 74 74 LEU CB C 74 42.376 42.376 41.508 0.868 25068
2128 1 5 . 1 1 74 74 LEU H H 74 8.160 8.160 8.274 -0.114 25068
2129 1 5 . 1 1 75 75 ASP N N 75 122.159 122.159 118.999 3.160 25068
2130 1 5 . 1 1 75 75 ASP HA H 75 4.988 4.988 4.329 0.659 25068
2131 1 5 . 1 1 75 75 ASP C C 75 178.046 178.046 178.613 -0.567 25068
2132 1 5 . 1 1 75 75 ASP CA C 75 58.191 58.191 57.549 0.642 25068
2133 1 5 . 1 1 75 75 ASP CB C 75 42.958 42.958 40.083 2.875 25068
2134 1 5 . 1 1 75 75 ASP H H 75 8.361 8.361 8.491 -0.130 25068
2135 1 5 . 1 1 76 76 LYS N N 76 119.861 119.861 121.398 -1.537 25068
2136 1 5 . 1 1 76 76 LYS HA H 76 3.988 3.988 4.020 -0.032 25068
2137 1 5 . 1 1 76 76 LYS C C 76 179.668 179.668 179.007 0.661 25068
2138 1 5 . 1 1 76 76 LYS CA C 76 60.984 60.984 59.552 1.432 25068
2139 1 5 . 1 1 76 76 LYS CB C 76 33.124 33.124 32.336 0.789 25068
2140 1 5 . 1 1 76 76 LYS H H 76 7.940 7.940 7.804 0.136 25068
2141 1 5 . 1 1 77 77 VAL N N 77 121.485 121.485 119.326 2.159 25068
2142 1 5 . 1 1 77 77 VAL HA H 77 3.687 3.687 3.640 0.047 25068
2143 1 5 . 1 1 77 77 VAL C C 77 178.070 178.070 178.111 -0.041 25068
2144 1 5 . 1 1 77 77 VAL CA C 77 67.359 67.359 65.737 1.622 25068
2145 1 5 . 1 1 77 77 VAL CB C 77 32.645 32.645 31.151 1.494 25068
2146 1 5 . 1 1 77 77 VAL H H 77 7.401 7.401 8.124 -0.723 25068
2147 1 5 . 1 1 78 78 ARG N N 78 121.960 121.960 120.261 1.699 25068
2148 1 5 . 1 1 78 78 ARG HA H 78 4.010 4.010 3.902 0.108 25068
2149 1 5 . 1 1 78 78 ARG C C 78 179.144 179.144 178.678 0.466 25068
2150 1 5 . 1 1 78 78 ARG CA C 78 60.598 60.598 59.975 0.623 25068
2151 1 5 . 1 1 78 78 ARG CB C 78 28.352 28.352 30.115 -1.763 25068
2152 1 5 . 1 1 78 78 ARG H H 78 7.813 7.813 8.269 -0.456 25068
2153 1 5 . 1 1 79 79 TYR N N 79 120.411 120.411 120.241 0.170 25068
2154 1 5 . 1 1 79 79 TYR HA H 79 3.878 3.878 4.106 -0.228 25068
2155 1 5 . 1 1 79 79 TYR C C 79 176.080 176.080 177.197 -1.117 25068
2156 1 5 . 1 1 79 79 TYR CA C 79 63.669 63.669 59.700 3.969 25068
2157 1 5 . 1 1 79 79 TYR CB C 79 39.758 39.758 38.023 1.734 25068
2158 1 5 . 1 1 79 79 TYR H H 79 8.608 8.608 8.726 -0.118 25068
2159 1 5 . 1 1 80 80 SER N N 80 113.726 113.726 115.886 -2.160 25068
2160 1 5 . 1 1 80 80 SER HA H 80 3.880 3.880 3.629 0.251 25068
2161 1 5 . 1 1 80 80 SER C C 80 176.794 176.794 176.461 0.333 25068
2162 1 5 . 1 1 80 80 SER CA C 80 62.969 62.969 61.716 1.253 25068
2163 1 5 . 1 1 80 80 SER CB C 80 63.605 63.605 62.872 0.733 25068
2164 1 5 . 1 1 80 80 SER H H 80 8.234 8.234 8.200 0.034 25068
2165 1 5 . 1 1 81 81 LYS N N 81 121.920 121.920 121.337 0.583 25068
2166 1 5 . 1 1 81 81 LYS HA H 81 4.029 4.029 3.935 0.094 25068
2167 1 5 . 1 1 81 81 LYS C C 81 179.342 179.342 178.498 0.844 25068
2168 1 5 . 1 1 81 81 LYS CA C 81 60.138 60.138 58.885 1.253 25068
2169 1 5 . 1 1 81 81 LYS CB C 81 33.238 33.238 32.108 1.130 25068
2170 1 5 . 1 1 81 81 LYS H H 81 7.958 7.958 8.082 -0.124 25068
2171 1 5 . 1 1 82 82 GLU N N 82 119.515 119.515 119.414 0.101 25068
2172 1 5 . 1 1 82 82 GLU HA H 82 3.945 3.945 3.965 -0.020 25068
2173 1 5 . 1 1 82 82 GLU C C 82 180.689 180.689 179.166 1.523 25068
2174 1 5 . 1 1 82 82 GLU CA C 82 60.920 60.920 59.563 1.357 25068
2175 1 5 . 1 1 82 82 GLU CB C 82 30.885 30.885 29.405 1.480 25068
2176 1 5 . 1 1 82 82 GLU H H 82 8.310 8.310 7.953 0.357 25068
2177 1 5 . 1 1 83 83 ILE N N 83 121.362 121.362 120.299 1.063 25068
2178 1 5 . 1 1 83 83 ILE HA H 83 3.889 3.889 3.694 0.195 25068
2179 1 5 . 1 1 83 83 ILE C C 83 177.207 177.207 177.869 -0.662 25068
2180 1 5 . 1 1 83 83 ILE CA C 83 62.754 62.754 63.634 -0.880 25068
2181 1 5 . 1 1 83 83 ILE CB C 83 37.651 37.651 37.809 -0.158 25068
2182 1 5 . 1 1 83 83 ILE H H 83 8.887 8.887 8.090 0.797 25068
2183 1 5 . 1 1 84 84 GLU N N 84 122.327 122.327 120.238 2.089 25068
2184 1 5 . 1 1 84 84 GLU HA H 84 4.028 4.028 3.907 0.121 25068
2185 1 5 . 1 1 84 84 GLU C C 84 179.047 179.047 179.332 -0.285 25068
2186 1 5 . 1 1 84 84 GLU CA C 84 60.045 60.045 59.899 0.146 25068
2187 1 5 . 1 1 84 84 GLU CB C 84 30.099 30.099 28.970 1.129 25068
2188 1 5 . 1 1 84 84 GLU H H 84 7.289 7.289 8.090 -0.801 25068
2189 1 5 . 1 1 85 85 GLU N N 85 118.046 118.046 119.330 -1.284 25068
2190 1 5 . 1 1 85 85 GLU HA H 85 3.966 3.966 4.098 -0.132 25068
2191 1 5 . 1 1 85 85 GLU C C 85 178.614 178.614 179.438 -0.824 25068
2192 1 5 . 1 1 85 85 GLU CA C 85 59.997 59.997 59.229 0.768 25068
2193 1 5 . 1 1 85 85 GLU CB C 85 30.453 30.453 29.634 0.819 25068
2194 1 5 . 1 1 85 85 GLU H H 85 7.545 7.545 8.178 -0.633 25068
2195 1 5 . 1 1 86 86 TYR N N 86 121.050 121.050 119.250 1.800 25068
2196 1 5 . 1 1 86 86 TYR HA H 86 4.094 4.094 4.270 -0.176 25068
2197 1 5 . 1 1 86 86 TYR C C 86 177.815 177.815 178.292 -0.477 25068
2198 1 5 . 1 1 86 86 TYR CA C 86 62.072 62.072 61.350 0.722 25068
2199 1 5 . 1 1 86 86 TYR CB C 86 39.954 39.954 38.191 1.763 25068
2200 1 5 . 1 1 86 86 TYR H H 86 8.277 8.277 8.391 -0.114 25068
2201 1 5 . 1 1 87 87 ARG N N 87 118.353 118.353 117.783 0.570 25068
2202 1 5 . 1 1 87 87 ARG HA H 87 3.877 3.877 3.991 -0.114 25068
2203 1 5 . 1 1 87 87 ARG C C 87 178.067 178.067 178.808 -0.741 25068
2204 1 5 . 1 1 87 87 ARG CA C 87 59.513 59.513 59.558 -0.045 25068
2205 1 5 . 1 1 87 87 ARG CB C 87 31.053 31.053 30.242 0.811 25068
2206 1 5 . 1 1 87 87 ARG H H 87 8.249 8.249 8.414 -0.165 25068
2207 1 5 . 1 1 88 88 LYS N N 88 118.205 118.205 117.423 0.782 25068
2208 1 5 . 1 1 88 88 LYS HA H 88 3.982 3.982 4.025 -0.043 25068
2209 1 5 . 1 1 88 88 LYS C C 88 178.050 178.050 177.284 0.766 25068
2210 1 5 . 1 1 88 88 LYS CA C 88 59.265 59.265 59.391 -0.126 25068
2211 1 5 . 1 1 88 88 LYS CB C 88 33.499 33.499 32.756 0.743 25068
2212 1 5 . 1 1 88 88 LYS H H 88 7.465 7.465 7.963 -0.498 25068
2213 1 5 . 1 1 89 89 LYS N N 89 118.341 118.341 114.753 3.588 25068
2214 1 5 . 1 1 89 89 LYS HA H 89 4.084 4.084 4.443 -0.359 25068
2215 1 5 . 1 1 89 89 LYS C C 89 176.691 176.691 176.263 0.428 25068
2216 1 5 . 1 1 89 89 LYS CA C 89 58.188 58.188 55.942 2.246 25068
2217 1 5 . 1 1 89 89 LYS CB C 89 33.809 33.809 32.010 1.799 25068
2218 1 5 . 1 1 89 89 LYS H H 89 7.580 7.580 7.703 -0.123 25068
2219 1 5 . 1 1 90 90 ASN N N 90 117.604 117.604 118.855 -1.251 25068
2220 1 5 . 1 1 90 90 ASN HA H 90 4.563 4.563 4.844 -0.281 25068
2221 1 5 . 1 1 90 90 ASN C C 90 174.419 174.419 174.863 -0.444 25068
2222 1 5 . 1 1 90 90 ASN CA C 90 54.433 54.433 54.567 -0.134 25068
2223 1 5 . 1 1 90 90 ASN CB C 90 40.182 40.182 41.067 -0.885 25068
2224 1 5 . 1 1 90 90 ASN H H 90 7.741 7.741 7.905 -0.164 25068
2225 1 5 . 1 1 91 91 GLN N N 91 111.990 111.990 119.695 -7.705 25068
2226 1 5 . 1 1 91 91 GLN HA H 91 4.213 4.213 4.592 -0.379 25068
2227 1 5 . 1 1 91 91 GLN C C 91 174.970 174.970 175.353 -0.383 25068
2228 1 5 . 1 1 91 91 GLN CA C 91 57.011 57.011 55.063 1.948 25068
2229 1 5 . 1 1 91 91 GLN CB C 91 30.358 30.358 29.551 0.807 25068
2230 1 5 . 1 1 91 91 GLN H H 91 7.925 7.925 7.840 0.085 25068
2231 1 6 . 1 1 14 14 PRO HA H 14 4.322 4.322 4.324 -0.002 25068
2232 1 6 . 1 1 14 14 PRO C C 14 176.783 176.783 176.701 0.082 25068
2233 1 6 . 1 1 14 14 PRO CA C 14 64.643 64.643 64.137 0.506 25068
2234 1 6 . 1 1 14 14 PRO CB C 14 33.114 33.114 32.294 0.820 25068
2235 1 6 . 1 1 15 15 LEU N N 15 120.158 120.158 115.736 4.422 25068
2236 1 6 . 1 1 15 15 LEU HA H 15 4.238 4.238 4.031 0.207 25068
2237 1 6 . 1 1 15 15 LEU C C 15 176.361 176.361 175.525 0.836 25068
2238 1 6 . 1 1 15 15 LEU CA C 15 55.395 55.395 54.979 0.416 25068
2239 1 6 . 1 1 15 15 LEU CB C 15 42.619 42.619 40.732 1.887 25068
2240 1 6 . 1 1 15 15 LEU H H 15 8.189 8.189 8.146 0.043 25068
2241 1 6 . 1 1 16 16 ALA N N 16 124.269 124.269 120.677 3.592 25068
2242 1 6 . 1 1 16 16 ALA HA H 16 3.496 3.496 4.484 -0.988 25068
2243 1 6 . 1 1 16 16 ALA C C 16 175.124 175.124 176.162 -1.038 25068
2244 1 6 . 1 1 16 16 ALA CA C 16 51.457 51.457 51.045 0.411 25068
2245 1 6 . 1 1 16 16 ALA CB C 16 18.105 18.105 19.338 -1.233 25068
2246 1 6 . 1 1 16 16 ALA H H 16 7.500 7.500 7.675 -0.175 25068
2247 1 6 . 1 1 17 17 PRO HA H 17 4.157 4.157 4.391 -0.234 25068
2248 1 6 . 1 1 17 17 PRO C C 17 176.396 176.396 175.791 0.605 25068
2249 1 6 . 1 1 17 17 PRO CA C 17 63.588 63.588 62.342 1.246 25068
2250 1 6 . 1 1 17 17 PRO CB C 17 32.850 32.850 32.018 0.832 25068
2251 1 6 . 1 1 18 18 LYS N N 18 124.070 124.070 121.321 2.749 25068
2252 1 6 . 1 1 18 18 LYS HA H 18 4.147 4.147 4.307 -0.160 25068
2253 1 6 . 1 1 18 18 LYS C C 18 177.543 177.543 175.794 1.749 25068
2254 1 6 . 1 1 18 18 LYS CA C 18 57.081 57.081 56.348 0.733 25068
2255 1 6 . 1 1 18 18 LYS CB C 18 33.573 33.573 32.889 0.684 25068
2256 1 6 . 1 1 18 18 LYS H H 18 8.886 8.886 8.350 0.536 25068
2257 1 6 . 1 1 19 19 ARG N N 19 122.242 122.242 119.832 2.410 25068
2258 1 6 . 1 1 19 19 ARG HA H 19 3.437 3.437 4.477 -1.040 25068
2259 1 6 . 1 1 19 19 ARG C C 19 175.409 175.409 174.253 1.156 25068
2260 1 6 . 1 1 19 19 ARG CA C 19 57.545 57.545 55.598 1.947 25068
2261 1 6 . 1 1 19 19 ARG CB C 19 31.149 31.149 30.512 0.637 25068
2262 1 6 . 1 1 19 19 ARG H H 19 8.286 8.286 8.313 -0.027 25068
2263 1 6 . 1 1 20 20 ALA N N 20 123.176 123.176 122.972 0.204 25068
2264 1 6 . 1 1 20 20 ALA HA H 20 4.139 4.139 4.556 -0.417 25068
2265 1 6 . 1 1 20 20 ALA C C 20 177.843 177.843 176.679 1.164 25068
2266 1 6 . 1 1 20 20 ALA CA C 20 52.391 52.391 51.378 1.013 25068
2267 1 6 . 1 1 20 20 ALA CB C 20 19.397 19.397 20.265 -0.868 25068
2268 1 6 . 1 1 20 20 ALA H H 20 7.348 7.348 8.220 -0.872 25068
2269 1 6 . 1 1 21 21 LEU N N 21 125.680 125.680 121.084 4.596 25068
2270 1 6 . 1 1 21 21 LEU HA H 21 4.194 4.194 4.157 0.037 25068
2271 1 6 . 1 1 21 21 LEU C C 21 177.091 177.091 176.211 0.880 25068
2272 1 6 . 1 1 21 21 LEU CA C 21 55.472 55.472 54.975 0.497 25068
2273 1 6 . 1 1 21 21 LEU CB C 21 43.931 43.931 42.770 1.161 25068
2274 1 6 . 1 1 21 21 LEU H H 21 9.055 9.055 8.362 0.693 25068
2275 1 6 . 1 1 22 22 SER N N 22 116.686 116.686 114.127 2.559 25068
2276 1 6 . 1 1 22 22 SER HA H 22 4.427 4.427 4.638 -0.211 25068
2277 1 6 . 1 1 22 22 SER C C 22 174.241 174.241 174.999 -0.758 25068
2278 1 6 . 1 1 22 22 SER CA C 22 57.564 57.564 57.177 0.387 25068
2279 1 6 . 1 1 22 22 SER CB C 22 66.568 66.568 64.628 1.940 25068
2280 1 6 . 1 1 22 22 SER H H 22 7.549 7.549 8.035 -0.486 25068
2281 1 6 . 1 1 23 23 ALA N N 23 123.382 123.382 125.161 -1.779 25068
2282 1 6 . 1 1 23 23 ALA HA H 23 4.163 4.163 4.035 0.128 25068
2283 1 6 . 1 1 23 23 ALA C C 23 178.863 178.863 179.460 -0.597 25068
2284 1 6 . 1 1 23 23 ALA CA C 23 57.124 57.124 54.861 2.263 25068
2285 1 6 . 1 1 23 23 ALA CB C 23 19.441 19.441 18.559 0.882 25068
2286 1 6 . 1 1 23 23 ALA H H 23 9.035 9.035 8.832 0.203 25068
2287 1 6 . 1 1 24 24 TYR N N 24 115.979 115.979 117.897 -1.918 25068
2288 1 6 . 1 1 24 24 TYR HA H 24 2.590 2.590 4.358 -1.768 25068
2289 1 6 . 1 1 24 24 TYR C C 24 176.257 176.257 177.898 -1.641 25068
2290 1 6 . 1 1 24 24 TYR CA C 24 60.940 60.940 61.209 -0.269 25068
2291 1 6 . 1 1 24 24 TYR CB C 24 39.106 39.106 37.699 1.407 25068
2292 1 6 . 1 1 24 24 TYR H H 24 8.206 8.206 8.474 -0.268 25068
2293 1 6 . 1 1 25 25 MET N N 25 116.391 116.391 118.323 -1.932 25068
2294 1 6 . 1 1 25 25 MET HA H 25 3.643 3.643 4.216 -0.573 25068
2295 1 6 . 1 1 25 25 MET C C 25 180.177 180.177 178.640 1.537 25068
2296 1 6 . 1 1 25 25 MET CA C 25 59.161 59.161 58.087 1.074 25068
2297 1 6 . 1 1 25 25 MET CB C 25 32.748 32.748 31.381 1.367 25068
2298 1 6 . 1 1 25 25 MET H H 25 7.433 7.433 8.136 -0.703 25068
2299 1 6 . 1 1 26 26 PHE N N 26 118.699 118.699 120.197 -1.498 25068
2300 1 6 . 1 1 26 26 PHE HA H 26 4.063 4.063 4.170 -0.107 25068
2301 1 6 . 1 1 26 26 PHE C C 26 178.055 178.055 177.687 0.368 25068
2302 1 6 . 1 1 26 26 PHE CA C 26 64.840 64.840 61.783 3.057 25068
2303 1 6 . 1 1 26 26 PHE CB C 26 40.437 40.437 39.023 1.414 25068
2304 1 6 . 1 1 26 26 PHE H H 26 7.982 7.982 7.874 0.108 25068
2305 1 6 . 1 1 27 27 TYR N N 27 123.888 123.888 120.622 3.266 25068
2306 1 6 . 1 1 27 27 TYR HA H 27 3.576 3.576 4.114 -0.538 25068
2307 1 6 . 1 1 27 27 TYR C C 27 176.691 176.691 177.124 -0.433 25068
2308 1 6 . 1 1 27 27 TYR CA C 27 62.831 62.831 62.003 0.828 25068
2309 1 6 . 1 1 27 27 TYR CB C 27 39.238 39.238 38.398 0.840 25068
2310 1 6 . 1 1 27 27 TYR H H 27 7.843 7.843 7.860 -0.017 25068
2311 1 6 . 1 1 28 28 VAL N N 28 119.501 119.501 115.276 4.225 25068
2312 1 6 . 1 1 28 28 VAL HA H 28 2.912 2.912 3.396 -0.484 25068
2313 1 6 . 1 1 28 28 VAL C C 28 177.067 177.067 177.721 -0.654 25068
2314 1 6 . 1 1 28 28 VAL CA C 28 67.149 67.149 66.794 0.355 25068
2315 1 6 . 1 1 28 28 VAL CB C 28 32.599 32.599 31.378 1.221 25068
2316 1 6 . 1 1 28 28 VAL H H 28 8.370 8.370 7.937 0.433 25068
2317 1 6 . 1 1 29 29 LYS N N 29 114.512 114.512 120.824 -6.312 25068
2318 1 6 . 1 1 29 29 LYS HA H 29 3.676 3.676 3.814 -0.138 25068
2319 1 6 . 1 1 29 29 LYS C C 29 178.627 178.627 178.485 0.142 25068
2320 1 6 . 1 1 29 29 LYS CA C 29 60.349 60.349 60.282 0.067 25068
2321 1 6 . 1 1 29 29 LYS CB C 29 33.278 33.278 32.059 1.219 25068
2322 1 6 . 1 1 29 29 LYS H H 29 6.821 6.821 8.077 -1.256 25068
2323 1 6 . 1 1 30 30 ASP N N 30 116.793 116.793 119.757 -2.964 25068
2324 1 6 . 1 1 30 30 ASP HA H 30 4.466 4.466 4.176 0.290 25068
2325 1 6 . 1 1 30 30 ASP C C 30 178.615 178.615 178.458 0.157 25068
2326 1 6 . 1 1 30 30 ASP CA C 30 57.223 57.223 57.188 0.035 25068
2327 1 6 . 1 1 30 30 ASP CB C 30 42.066 42.066 40.078 1.988 25068
2328 1 6 . 1 1 30 30 ASP H H 30 6.875 6.875 7.876 -1.001 25068
2329 1 6 . 1 1 31 31 LYS N N 31 122.423 122.423 120.075 2.348 25068
2330 1 6 . 1 1 31 31 LYS HA H 31 3.813 3.813 3.793 0.020 25068
2331 1 6 . 1 1 31 31 LYS C C 31 178.443 178.443 178.842 -0.399 25068
2332 1 6 . 1 1 31 31 LYS CA C 31 57.494 57.494 59.151 -1.657 25068
2333 1 6 . 1 1 31 31 LYS CB C 31 32.539 32.539 32.166 0.373 25068
2334 1 6 . 1 1 31 31 LYS H H 31 8.910 8.910 7.968 0.942 25068
2335 1 6 . 1 1 32 32 ARG N N 32 117.823 117.823 119.092 -1.269 25068
2336 1 6 . 1 1 32 32 ARG HA H 32 3.540 3.540 3.916 -0.376 25068
2337 1 6 . 1 1 32 32 ARG C C 32 176.951 176.951 178.871 -1.920 25068
2338 1 6 . 1 1 32 32 ARG CA C 32 61.259 61.259 59.448 1.811 25068
2339 1 6 . 1 1 32 32 ARG CB C 32 30.668 30.668 30.103 0.565 25068
2340 1 6 . 1 1 32 32 ARG H H 32 8.501 8.501 7.941 0.560 25068
2341 1 6 . 1 1 33 33 LEU N N 33 114.878 114.878 120.126 -5.248 25068
2342 1 6 . 1 1 33 33 LEU HA H 33 3.871 3.871 3.797 0.074 25068
2343 1 6 . 1 1 33 33 LEU C C 33 179.180 179.180 178.972 0.208 25068
2344 1 6 . 1 1 33 33 LEU CA C 33 58.377 58.377 58.031 0.346 25068
2345 1 6 . 1 1 33 33 LEU CB C 33 42.429 42.429 41.528 0.901 25068
2346 1 6 . 1 1 33 33 LEU H H 33 6.549 6.549 8.234 -1.685 25068
2347 1 6 . 1 1 34 34 GLU N N 34 118.637 118.637 119.052 -0.415 25068
2348 1 6 . 1 1 34 34 GLU HA H 34 3.866 3.866 3.883 -0.017 25068
2349 1 6 . 1 1 34 34 GLU C C 34 178.988 178.988 179.158 -0.170 25068
2350 1 6 . 1 1 34 34 GLU CA C 34 60.248 60.248 59.621 0.627 25068
2351 1 6 . 1 1 34 34 GLU CB C 34 31.325 31.325 29.528 1.797 25068
2352 1 6 . 1 1 34 34 GLU H H 34 7.135 7.135 7.917 -0.782 25068
2353 1 6 . 1 1 35 35 ILE N N 35 119.142 119.142 119.551 -0.409 25068
2354 1 6 . 1 1 35 35 ILE HA H 35 3.693 3.693 3.886 -0.193 25068
2355 1 6 . 1 1 35 35 ILE C C 35 177.789 177.789 178.801 -1.012 25068
2356 1 6 . 1 1 35 35 ILE CA C 35 65.753 65.753 65.275 0.478 25068
2357 1 6 . 1 1 35 35 ILE CB C 35 38.940 38.940 37.883 1.057 25068
2358 1 6 . 1 1 35 35 ILE H H 35 8.076 8.076 8.223 -0.147 25068
2359 1 6 . 1 1 36 36 ILE N N 36 116.296 116.296 117.379 -1.083 25068
2360 1 6 . 1 1 36 36 ILE HA H 36 3.640 3.640 4.066 -0.426 25068
2361 1 6 . 1 1 36 36 ILE C C 36 177.270 177.270 177.138 0.132 25068
2362 1 6 . 1 1 36 36 ILE CA C 36 64.633 64.633 63.486 1.147 25068
2363 1 6 . 1 1 36 36 ILE CB C 36 38.718 38.718 37.903 0.815 25068
2364 1 6 . 1 1 36 36 ILE H H 36 7.754 7.754 7.957 -0.203 25068
2365 1 6 . 1 1 37 37 LYS N N 37 119.626 119.626 119.479 0.147 25068
2366 1 6 . 1 1 37 37 LYS HA H 37 3.922 3.922 4.136 -0.214 25068
2367 1 6 . 1 1 37 37 LYS C C 37 178.129 178.129 177.798 0.331 25068
2368 1 6 . 1 1 37 37 LYS CA C 37 59.996 59.996 58.638 1.358 25068
2369 1 6 . 1 1 37 37 LYS CB C 37 33.487 33.487 33.072 0.415 25068
2370 1 6 . 1 1 37 37 LYS H H 37 7.413 7.413 7.843 -0.430 25068
2371 1 6 . 1 1 38 38 GLU N N 38 116.708 116.708 115.951 0.757 25068
2372 1 6 . 1 1 38 38 GLU HA H 38 4.060 4.060 4.301 -0.241 25068
2373 1 6 . 1 1 38 38 GLU C C 38 177.004 177.004 177.148 -0.144 25068
2374 1 6 . 1 1 38 38 GLU CA C 38 59.070 59.070 57.480 1.590 25068
2375 1 6 . 1 1 38 38 GLU CB C 38 31.665 31.665 30.910 0.755 25068
2376 1 6 . 1 1 38 38 GLU H H 38 7.354 7.354 8.084 -0.730 25068
2377 1 6 . 1 1 39 39 LYS N N 39 118.621 118.621 120.512 -1.891 25068
2378 1 6 . 1 1 39 39 LYS HA H 39 4.690 4.690 4.865 -0.175 25068
2379 1 6 . 1 1 39 39 LYS C C 39 172.792 172.792 175.159 -2.367 25068
2380 1 6 . 1 1 39 39 LYS CA C 39 54.596 54.596 52.962 1.634 25068
2381 1 6 . 1 1 39 39 LYS CB C 39 33.945 33.945 34.027 -0.082 25068
2382 1 6 . 1 1 39 39 LYS H H 39 8.176 8.176 7.767 0.409 25068
2383 1 6 . 1 1 40 40 PRO HA H 40 4.429 4.429 4.383 0.046 25068
2384 1 6 . 1 1 40 40 PRO C C 40 179.829 179.829 178.472 1.357 25068
2385 1 6 . 1 1 40 40 PRO CA C 40 66.040 66.040 64.677 1.363 25068
2386 1 6 . 1 1 40 40 PRO CB C 40 32.606 32.606 31.874 0.732 25068
2387 1 6 . 1 1 41 41 GLU N N 41 119.150 119.150 120.743 -1.593 25068
2388 1 6 . 1 1 41 41 GLU HA H 41 4.143 4.143 4.167 -0.024 25068
2389 1 6 . 1 1 41 41 GLU C C 41 178.502 178.502 177.866 0.636 25068
2390 1 6 . 1 1 41 41 GLU CA C 41 59.485 59.485 59.045 0.440 25068
2391 1 6 . 1 1 41 41 GLU CB C 41 28.574 28.574 29.238 -0.664 25068
2392 1 6 . 1 1 41 41 GLU H H 41 9.789 9.789 8.795 0.994 25068
2393 1 6 . 1 1 42 42 LEU N N 42 121.443 121.443 119.148 2.295 25068
2394 1 6 . 1 1 42 42 LEU HA H 42 4.185 4.185 4.722 -0.537 25068
2395 1 6 . 1 1 42 42 LEU C C 42 177.815 177.815 177.656 0.159 25068
2396 1 6 . 1 1 42 42 LEU CA C 42 56.730 56.730 54.429 2.301 25068
2397 1 6 . 1 1 42 42 LEU CB C 42 42.013 42.013 41.568 0.445 25068
2398 1 6 . 1 1 42 42 LEU H H 42 8.312 8.312 7.652 0.660 25068
2399 1 6 . 1 1 43 43 ALA N N 43 119.949 119.949 122.566 -2.617 25068
2400 1 6 . 1 1 43 43 ALA HA H 43 3.746 3.746 3.997 -0.251 25068
2401 1 6 . 1 1 43 43 ALA C C 43 178.635 178.635 177.824 0.811 25068
2402 1 6 . 1 1 43 43 ALA CA C 43 56.164 56.164 54.639 1.525 25068
2403 1 6 . 1 1 43 43 ALA CB C 43 19.670 19.670 18.608 1.062 25068
2404 1 6 . 1 1 43 43 ALA H H 43 7.554 7.554 7.473 0.081 25068
2405 1 6 . 1 1 44 44 LYS N N 44 112.690 112.690 115.260 -2.570 25068
2406 1 6 . 1 1 44 44 LYS HA H 44 4.232 4.232 4.453 -0.221 25068
2407 1 6 . 1 1 44 44 LYS C C 44 175.949 175.949 175.636 0.313 25068
2408 1 6 . 1 1 44 44 LYS CA C 44 56.987 56.987 54.910 2.077 25068
2409 1 6 . 1 1 44 44 LYS CB C 44 33.345 33.345 31.750 1.595 25068
2410 1 6 . 1 1 44 44 LYS H H 44 7.560 7.560 7.790 -0.230 25068
2411 1 6 . 1 1 45 45 ASP N N 45 122.529 122.529 122.953 -0.424 25068
2412 1 6 . 1 1 45 45 ASP HA H 45 4.749 4.749 4.866 -0.117 25068
2413 1 6 . 1 1 45 45 ASP C C 45 174.677 174.677 175.941 -1.264 25068
2414 1 6 . 1 1 45 45 ASP CA C 45 53.030 53.030 53.105 -0.075 25068
2415 1 6 . 1 1 45 45 ASP CB C 45 41.549 41.549 40.295 1.254 25068
2416 1 6 . 1 1 45 45 ASP H H 45 7.672 7.672 8.022 -0.350 25068
2417 1 6 . 1 1 46 46 VAL N N 46 121.529 121.529 122.919 -1.390 25068
2418 1 6 . 1 1 46 46 VAL HA H 46 3.639 3.639 3.585 0.054 25068
2419 1 6 . 1 1 46 46 VAL C C 46 179.102 179.102 177.544 1.558 25068
2420 1 6 . 1 1 46 46 VAL CA C 46 66.430 66.430 65.851 0.579 25068
2421 1 6 . 1 1 46 46 VAL CB C 46 32.650 32.650 31.564 1.086 25068
2422 1 6 . 1 1 46 46 VAL H H 46 7.808 7.808 8.122 -0.314 25068
2423 1 6 . 1 1 47 47 ALA N N 47 123.933 123.933 120.461 3.472 25068
2424 1 6 . 1 1 47 47 ALA HA H 47 4.112 4.112 3.952 0.160 25068
2425 1 6 . 1 1 47 47 ALA C C 47 180.665 180.665 179.734 0.931 25068
2426 1 6 . 1 1 47 47 ALA CA C 47 55.822 55.822 55.167 0.654 25068
2427 1 6 . 1 1 47 47 ALA CB C 47 19.129 19.129 18.185 0.944 25068
2428 1 6 . 1 1 47 47 ALA H H 47 8.505 8.505 8.204 0.301 25068
2429 1 6 . 1 1 48 48 GLN N N 48 120.047 120.047 118.756 1.291 25068
2430 1 6 . 1 1 48 48 GLN HA H 48 4.033 4.033 4.118 -0.085 25068
2431 1 6 . 1 1 48 48 GLN C C 48 178.486 178.486 178.243 0.243 25068
2432 1 6 . 1 1 48 48 GLN CA C 48 59.436 59.436 58.396 1.040 25068
2433 1 6 . 1 1 48 48 GLN CB C 48 29.436 29.436 27.951 1.485 25068
2434 1 6 . 1 1 48 48 GLN H H 48 7.852 7.852 7.557 0.295 25068
2435 1 6 . 1 1 49 49 VAL N N 49 119.185 119.185 116.683 2.502 25068
2436 1 6 . 1 1 49 49 VAL HA H 49 3.424 3.424 3.601 -0.177 25068
2437 1 6 . 1 1 49 49 VAL C C 49 177.519 177.519 178.105 -0.586 25068
2438 1 6 . 1 1 49 49 VAL CA C 49 68.854 68.854 66.296 2.558 25068
2439 1 6 . 1 1 49 49 VAL CB C 49 32.454 32.454 30.427 2.027 25068
2440 1 6 . 1 1 49 49 VAL H H 49 7.984 7.984 8.039 -0.055 25068
2441 1 6 . 1 1 50 50 GLY N N 50 104.919 104.919 108.584 -3.665 25068
2442 1 6 . 1 1 50 50 GLY C C 50 176.825 176.825 175.938 0.887 25068
2443 1 6 . 1 1 50 50 GLY CA C 50 48.398 48.398 47.473 0.925 25068
2444 1 6 . 1 1 50 50 GLY H H 50 8.020 8.020 8.483 -0.463 25068
2445 1 6 . 1 1 51 51 LYS N N 51 123.422 123.422 122.736 0.686 25068
2446 1 6 . 1 1 51 51 LYS HA H 51 4.032 4.032 4.116 -0.084 25068
2447 1 6 . 1 1 51 51 LYS C C 51 179.332 179.332 179.106 0.226 25068
2448 1 6 . 1 1 51 51 LYS CA C 51 60.246 60.246 59.216 1.030 25068
2449 1 6 . 1 1 51 51 LYS CB C 51 33.626 33.626 32.050 1.576 25068
2450 1 6 . 1 1 51 51 LYS H H 51 7.699 7.699 7.907 -0.208 25068
2451 1 6 . 1 1 52 52 LEU N N 52 120.442 120.442 120.493 -0.051 25068
2452 1 6 . 1 1 52 52 LEU HA H 52 4.041 4.041 4.000 0.041 25068
2453 1 6 . 1 1 52 52 LEU C C 52 180.984 180.984 178.958 2.026 25068
2454 1 6 . 1 1 52 52 LEU CA C 52 58.855 58.855 57.971 0.884 25068
2455 1 6 . 1 1 52 52 LEU CB C 52 43.046 43.046 41.597 1.449 25068
2456 1 6 . 1 1 52 52 LEU H H 52 8.088 8.088 7.841 0.247 25068
2457 1 6 . 1 1 53 53 ILE N N 53 121.249 121.249 119.388 1.861 25068
2458 1 6 . 1 1 53 53 ILE HA H 53 3.557 3.557 3.874 -0.317 25068
2459 1 6 . 1 1 53 53 ILE C C 53 177.945 177.945 178.824 -0.879 25068
2460 1 6 . 1 1 53 53 ILE CA C 53 67.431 67.431 62.988 4.443 25068
2461 1 6 . 1 1 53 53 ILE CB C 53 38.887 38.887 36.051 2.836 25068
2462 1 6 . 1 1 53 53 ILE H H 53 8.475 8.475 8.186 0.289 25068
2463 1 6 . 1 1 54 54 GLY N N 54 107.755 107.755 108.089 -0.334 25068
2464 1 6 . 1 1 54 54 GLY C C 54 177.691 177.691 176.426 1.265 25068
2465 1 6 . 1 1 54 54 GLY CA C 54 48.997 48.997 47.559 1.438 25068
2466 1 6 . 1 1 54 54 GLY H H 54 8.130 8.130 8.511 -0.381 25068
2467 1 6 . 1 1 55 55 GLU N N 55 122.138 122.138 122.324 -0.186 25068
2468 1 6 . 1 1 55 55 GLU HA H 55 4.032 4.032 3.988 0.044 25068
2469 1 6 . 1 1 55 55 GLU C C 55 179.146 179.146 179.069 0.077 25068
2470 1 6 . 1 1 55 55 GLU CA C 55 59.958 59.958 59.647 0.311 25068
2471 1 6 . 1 1 55 55 GLU CB C 55 30.551 30.551 29.534 1.017 25068
2472 1 6 . 1 1 55 55 GLU H H 55 8.089 8.089 8.225 -0.136 25068
2473 1 6 . 1 1 56 56 ALA N N 56 122.985 122.985 121.751 1.234 25068
2474 1 6 . 1 1 56 56 ALA HA H 56 4.107 4.107 4.148 -0.041 25068
2475 1 6 . 1 1 56 56 ALA C C 56 181.177 181.177 179.922 1.255 25068
2476 1 6 . 1 1 56 56 ALA CA C 56 56.414 56.414 54.918 1.496 25068
2477 1 6 . 1 1 56 56 ALA CB C 56 19.948 19.948 18.326 1.622 25068
2478 1 6 . 1 1 56 56 ALA H H 56 7.947 7.947 8.430 -0.483 25068
2479 1 6 . 1 1 57 57 TRP N N 57 120.485 120.485 121.624 -1.139 25068
2480 1 6 . 1 1 57 57 TRP HA H 57 3.940 3.940 4.336 -0.396 25068
2481 1 6 . 1 1 57 57 TRP C C 57 178.537 178.537 179.156 -0.619 25068
2482 1 6 . 1 1 57 57 TRP CA C 57 60.633 60.633 59.509 1.124 25068
2483 1 6 . 1 1 57 57 TRP CB C 57 31.681 31.681 29.069 2.612 25068
2484 1 6 . 1 1 57 57 TRP H H 57 8.910 8.910 8.237 0.673 25068
2485 1 6 . 1 1 58 58 GLY N N 58 102.004 102.004 107.363 -5.359 25068
2486 1 6 . 1 1 58 58 GLY C C 58 174.723 174.723 175.177 -0.454 25068
2487 1 6 . 1 1 58 58 GLY CA C 58 47.091 47.091 46.430 0.661 25068
2488 1 6 . 1 1 58 58 GLY H H 58 7.668 7.668 7.964 -0.296 25068
2489 1 6 . 1 1 59 59 GLN N N 59 116.202 116.202 118.033 -1.831 25068
2490 1 6 . 1 1 59 59 GLN HA H 59 4.259 4.259 4.092 0.167 25068
2491 1 6 . 1 1 59 59 GLN C C 59 176.221 176.221 176.679 -0.458 25068
2492 1 6 . 1 1 59 59 GLN CA C 59 55.967 55.967 56.319 -0.352 25068
2493 1 6 . 1 1 59 59 GLN CB C 59 30.741 30.741 28.690 2.051 25068
2494 1 6 . 1 1 59 59 GLN H H 59 7.189 7.189 7.876 -0.687 25068
2495 1 6 . 1 1 60 60 LEU N N 60 120.776 120.776 121.185 -0.409 25068
2496 1 6 . 1 1 60 60 LEU HA H 60 4.185 4.185 4.102 0.083 25068
2497 1 6 . 1 1 60 60 LEU C C 60 177.372 177.372 176.255 1.117 25068
2498 1 6 . 1 1 60 60 LEU CA C 60 56.061 56.061 55.866 0.195 25068
2499 1 6 . 1 1 60 60 LEU CB C 60 43.696 43.696 42.556 1.140 25068
2500 1 6 . 1 1 60 60 LEU H H 60 6.968 6.968 7.394 -0.426 25068
2501 1 6 . 1 1 61 61 SER N N 61 120.432 120.432 114.248 6.184 25068
2502 1 6 . 1 1 61 61 SER HA H 61 4.582 4.582 4.767 -0.185 25068
2503 1 6 . 1 1 61 61 SER C C 61 173.500 173.500 173.548 -0.048 25068
2504 1 6 . 1 1 61 61 SER CA C 61 57.204 57.204 55.992 1.212 25068
2505 1 6 . 1 1 61 61 SER CB C 61 63.980 63.980 64.316 -0.336 25068
2506 1 6 . 1 1 61 61 SER H H 61 8.885 8.885 8.153 0.732 25068
2507 1 6 . 1 1 63 63 ALA HA H 63 4.089 4.089 4.168 -0.079 25068
2508 1 6 . 1 1 63 63 ALA C C 63 180.570 180.570 178.884 1.686 25068
2509 1 6 . 1 1 63 63 ALA CA C 63 56.005 56.005 54.617 1.388 25068
2510 1 6 . 1 1 63 63 ALA CB C 63 19.317 19.317 18.307 1.010 25068
2511 1 6 . 1 1 64 64 GLN N N 64 116.774 116.774 117.200 -0.426 25068
2512 1 6 . 1 1 64 64 GLN HA H 64 4.122 4.122 4.232 -0.110 25068
2513 1 6 . 1 1 64 64 GLN C C 64 178.275 178.275 178.195 0.080 25068
2514 1 6 . 1 1 64 64 GLN CA C 64 58.622 58.622 57.828 0.794 25068
2515 1 6 . 1 1 64 64 GLN CB C 64 31.350 31.350 28.840 2.510 25068
2516 1 6 . 1 1 64 64 GLN H H 64 7.603 7.603 7.966 -0.363 25068
2517 1 6 . 1 1 65 65 LYS N N 65 117.203 117.203 120.711 -3.508 25068
2518 1 6 . 1 1 65 65 LYS HA H 65 4.129 4.129 4.065 0.064 25068
2519 1 6 . 1 1 65 65 LYS C C 65 178.449 178.449 178.844 -0.395 25068
2520 1 6 . 1 1 65 65 LYS CA C 65 59.891 59.891 59.346 0.545 25068
2521 1 6 . 1 1 65 65 LYS CB C 65 34.351 34.351 32.348 2.003 25068
2522 1 6 . 1 1 65 65 LYS H H 65 7.810 7.810 7.772 0.038 25068
2523 1 6 . 1 1 66 66 ALA N N 66 122.218 122.218 122.472 -0.254 25068
2524 1 6 . 1 1 66 66 ALA HA H 66 4.290 4.290 4.229 0.061 25068
2525 1 6 . 1 1 66 66 ALA C C 66 176.135 176.135 176.721 -0.586 25068
2526 1 6 . 1 1 66 66 ALA CA C 66 57.745 57.745 56.768 0.977 25068
2527 1 6 . 1 1 66 66 ALA CB C 66 17.033 17.033 16.328 0.705 25068
2528 1 6 . 1 1 66 66 ALA H H 66 7.469 7.469 8.162 -0.693 25068
2529 1 6 . 1 1 67 67 PRO HA H 67 4.142 4.142 4.377 -0.235 25068
2530 1 6 . 1 1 67 67 PRO C C 67 179.591 179.591 179.062 0.529 25068
2531 1 6 . 1 1 67 67 PRO CA C 67 66.960 66.960 65.713 1.247 25068
2532 1 6 . 1 1 67 67 PRO CB C 67 32.014 32.014 31.542 0.472 25068
2533 1 6 . 1 1 68 68 TYR N N 68 117.140 117.140 119.284 -2.144 25068
2534 1 6 . 1 1 68 68 TYR HA H 68 3.940 3.940 4.125 -0.185 25068
2535 1 6 . 1 1 68 68 TYR C C 68 177.733 177.733 178.898 -1.165 25068
2536 1 6 . 1 1 68 68 TYR CA C 68 63.505 63.505 61.618 1.887 25068
2537 1 6 . 1 1 68 68 TYR CB C 68 38.503 38.503 37.721 0.782 25068
2538 1 6 . 1 1 68 68 TYR H H 68 7.268 7.268 8.480 -1.212 25068
2539 1 6 . 1 1 69 69 GLU N N 69 120.747 120.747 118.402 2.345 25068
2540 1 6 . 1 1 69 69 GLU HA H 69 4.253 4.253 3.995 0.258 25068
2541 1 6 . 1 1 69 69 GLU C C 69 179.805 179.805 178.874 0.931 25068
2542 1 6 . 1 1 69 69 GLU CA C 69 60.145 60.145 59.673 0.472 25068
2543 1 6 . 1 1 69 69 GLU CB C 69 29.808 29.808 29.366 0.442 25068
2544 1 6 . 1 1 69 69 GLU H H 69 8.048 8.048 8.591 -0.543 25068
2545 1 6 . 1 1 70 70 LYS N N 70 120.938 120.938 120.555 0.383 25068
2546 1 6 . 1 1 70 70 LYS HA H 70 4.020 4.020 3.941 0.079 25068
2547 1 6 . 1 1 70 70 LYS C C 70 178.740 178.740 178.889 -0.149 25068
2548 1 6 . 1 1 70 70 LYS CA C 70 60.202 60.202 59.757 0.445 25068
2549 1 6 . 1 1 70 70 LYS CB C 70 32.419 32.419 32.468 -0.049 25068
2550 1 6 . 1 1 70 70 LYS H H 70 8.301 8.301 8.020 0.281 25068
2551 1 6 . 1 1 71 71 LYS N N 71 118.427 118.427 118.213 0.214 25068
2552 1 6 . 1 1 71 71 LYS HA H 71 3.528 3.528 3.939 -0.411 25068
2553 1 6 . 1 1 71 71 LYS C C 71 179.280 179.280 178.865 0.415 25068
2554 1 6 . 1 1 71 71 LYS CA C 71 61.146 61.146 59.429 1.717 25068
2555 1 6 . 1 1 71 71 LYS CB C 71 32.196 32.196 32.240 -0.044 25068
2556 1 6 . 1 1 71 71 LYS H H 71 7.234 7.234 8.340 -1.106 25068
2557 1 6 . 1 1 72 72 ALA N N 72 122.126 122.126 121.301 0.825 25068
2558 1 6 . 1 1 72 72 ALA HA H 72 4.357 4.357 3.938 0.419 25068
2559 1 6 . 1 1 72 72 ALA C C 72 180.468 180.468 179.978 0.490 25068
2560 1 6 . 1 1 72 72 ALA CA C 72 56.457 56.457 54.969 1.488 25068
2561 1 6 . 1 1 72 72 ALA CB C 72 19.562 19.562 17.794 1.768 25068
2562 1 6 . 1 1 72 72 ALA H H 72 7.890 7.890 8.043 -0.153 25068
2563 1 6 . 1 1 73 73 GLN N N 73 121.659 121.659 119.127 2.532 25068
2564 1 6 . 1 1 73 73 GLN HA H 73 4.029 4.029 4.014 0.015 25068
2565 1 6 . 1 1 73 73 GLN C C 73 179.576 179.576 178.152 1.424 25068
2566 1 6 . 1 1 73 73 GLN CA C 73 60.427 60.427 58.131 2.296 25068
2567 1 6 . 1 1 73 73 GLN CB C 73 28.732 28.732 28.175 0.557 25068
2568 1 6 . 1 1 73 73 GLN H H 73 8.353 8.353 7.938 0.415 25068
2569 1 6 . 1 1 74 74 LEU N N 74 119.752 119.752 120.308 -0.556 25068
2570 1 6 . 1 1 74 74 LEU HA H 74 4.046 4.046 3.850 0.196 25068
2571 1 6 . 1 1 74 74 LEU C C 74 180.424 180.424 179.430 0.994 25068
2572 1 6 . 1 1 74 74 LEU CA C 74 58.675 58.675 58.274 0.401 25068
2573 1 6 . 1 1 74 74 LEU CB C 74 42.376 42.376 41.414 0.962 25068
2574 1 6 . 1 1 74 74 LEU H H 74 8.160 8.160 8.254 -0.094 25068
2575 1 6 . 1 1 75 75 ASP N N 75 122.159 122.159 118.966 3.193 25068
2576 1 6 . 1 1 75 75 ASP HA H 75 4.988 4.988 4.372 0.616 25068
2577 1 6 . 1 1 75 75 ASP C C 75 178.046 178.046 178.443 -0.397 25068
2578 1 6 . 1 1 75 75 ASP CA C 75 58.191 58.191 57.607 0.584 25068
2579 1 6 . 1 1 75 75 ASP CB C 75 42.958 42.958 40.731 2.227 25068
2580 1 6 . 1 1 75 75 ASP H H 75 8.361 8.361 8.562 -0.201 25068
2581 1 6 . 1 1 76 76 LYS N N 76 119.861 119.861 120.841 -0.980 25068
2582 1 6 . 1 1 76 76 LYS HA H 76 3.988 3.988 4.036 -0.048 25068
2583 1 6 . 1 1 76 76 LYS C C 76 179.668 179.668 179.021 0.647 25068
2584 1 6 . 1 1 76 76 LYS CA C 76 60.984 60.984 59.762 1.222 25068
2585 1 6 . 1 1 76 76 LYS CB C 76 33.124 33.124 32.429 0.695 25068
2586 1 6 . 1 1 76 76 LYS H H 76 7.940 7.940 7.738 0.202 25068
2587 1 6 . 1 1 77 77 VAL N N 77 121.485 121.485 119.134 2.351 25068
2588 1 6 . 1 1 77 77 VAL HA H 77 3.687 3.687 3.698 -0.011 25068
2589 1 6 . 1 1 77 77 VAL C C 77 178.070 178.070 177.298 0.772 25068
2590 1 6 . 1 1 77 77 VAL CA C 77 67.359 67.359 65.245 2.114 25068
2591 1 6 . 1 1 77 77 VAL CB C 77 32.645 32.645 31.799 0.846 25068
2592 1 6 . 1 1 77 77 VAL H H 77 7.401 7.401 8.141 -0.740 25068
2593 1 6 . 1 1 78 78 ARG N N 78 121.960 121.960 120.638 1.322 25068
2594 1 6 . 1 1 78 78 ARG HA H 78 4.010 4.010 3.990 0.020 25068
2595 1 6 . 1 1 78 78 ARG C C 78 179.144 179.144 178.139 1.005 25068
2596 1 6 . 1 1 78 78 ARG CA C 78 60.598 60.598 59.889 0.709 25068
2597 1 6 . 1 1 78 78 ARG CB C 78 28.352 28.352 30.033 -1.681 25068
2598 1 6 . 1 1 78 78 ARG H H 78 7.813 7.813 7.980 -0.167 25068
2599 1 6 . 1 1 79 79 TYR N N 79 120.411 120.411 119.890 0.521 25068
2600 1 6 . 1 1 79 79 TYR HA H 79 3.878 3.878 4.165 -0.287 25068
2601 1 6 . 1 1 79 79 TYR C C 79 176.080 176.080 177.362 -1.282 25068
2602 1 6 . 1 1 79 79 TYR CA C 79 63.669 63.669 59.687 3.982 25068
2603 1 6 . 1 1 79 79 TYR CB C 79 39.758 39.758 38.158 1.600 25068
2604 1 6 . 1 1 79 79 TYR H H 79 8.608 8.608 8.593 0.015 25068
2605 1 6 . 1 1 80 80 SER N N 80 113.726 113.726 114.275 -0.549 25068
2606 1 6 . 1 1 80 80 SER HA H 80 3.880 3.880 3.686 0.194 25068
2607 1 6 . 1 1 80 80 SER C C 80 176.794 176.794 176.772 0.022 25068
2608 1 6 . 1 1 80 80 SER CA C 80 62.969 62.969 61.630 1.339 25068
2609 1 6 . 1 1 80 80 SER CB C 80 63.605 63.605 62.799 0.806 25068
2610 1 6 . 1 1 80 80 SER H H 80 8.234 8.234 8.254 -0.020 25068
2611 1 6 . 1 1 81 81 LYS N N 81 121.920 121.920 121.074 0.846 25068
2612 1 6 . 1 1 81 81 LYS HA H 81 4.029 4.029 3.962 0.067 25068
2613 1 6 . 1 1 81 81 LYS C C 81 179.342 179.342 178.667 0.675 25068
2614 1 6 . 1 1 81 81 LYS CA C 81 60.138 60.138 59.036 1.102 25068
2615 1 6 . 1 1 81 81 LYS CB C 81 33.238 33.238 32.288 0.950 25068
2616 1 6 . 1 1 81 81 LYS H H 81 7.958 7.958 7.938 0.020 25068
2617 1 6 . 1 1 82 82 GLU N N 82 119.515 119.515 119.548 -0.033 25068
2618 1 6 . 1 1 82 82 GLU HA H 82 3.945 3.945 4.069 -0.124 25068
2619 1 6 . 1 1 82 82 GLU C C 82 180.689 180.689 179.110 1.579 25068
2620 1 6 . 1 1 82 82 GLU CA C 82 60.920 60.920 59.616 1.304 25068
2621 1 6 . 1 1 82 82 GLU CB C 82 30.885 30.885 29.386 1.499 25068
2622 1 6 . 1 1 82 82 GLU H H 82 8.310 8.310 8.099 0.211 25068
2623 1 6 . 1 1 83 83 ILE N N 83 121.362 121.362 120.351 1.011 25068
2624 1 6 . 1 1 83 83 ILE HA H 83 3.889 3.889 3.725 0.164 25068
2625 1 6 . 1 1 83 83 ILE C C 83 177.207 177.207 177.898 -0.691 25068
2626 1 6 . 1 1 83 83 ILE CA C 83 62.754 62.754 63.689 -0.935 25068
2627 1 6 . 1 1 83 83 ILE CB C 83 37.651 37.651 37.867 -0.216 25068
2628 1 6 . 1 1 83 83 ILE H H 83 8.887 8.887 8.000 0.887 25068
2629 1 6 . 1 1 84 84 GLU N N 84 122.327 122.327 120.271 2.056 25068
2630 1 6 . 1 1 84 84 GLU HA H 84 4.028 4.028 3.913 0.115 25068
2631 1 6 . 1 1 84 84 GLU C C 84 179.047 179.047 179.306 -0.259 25068
2632 1 6 . 1 1 84 84 GLU CA C 84 60.045 60.045 59.924 0.121 25068
2633 1 6 . 1 1 84 84 GLU CB C 84 30.099 30.099 28.991 1.108 25068
2634 1 6 . 1 1 84 84 GLU H H 84 7.289 7.289 8.115 -0.826 25068
2635 1 6 . 1 1 85 85 GLU N N 85 118.046 118.046 119.274 -1.228 25068
2636 1 6 . 1 1 85 85 GLU HA H 85 3.966 3.966 4.087 -0.121 25068
2637 1 6 . 1 1 85 85 GLU C C 85 178.614 178.614 179.398 -0.784 25068
2638 1 6 . 1 1 85 85 GLU CA C 85 59.997 59.997 59.032 0.965 25068
2639 1 6 . 1 1 85 85 GLU CB C 85 30.453 30.453 29.483 0.970 25068
2640 1 6 . 1 1 85 85 GLU H H 85 7.545 7.545 8.195 -0.650 25068
2641 1 6 . 1 1 86 86 TYR N N 86 121.050 121.050 119.257 1.793 25068
2642 1 6 . 1 1 86 86 TYR HA H 86 4.094 4.094 4.261 -0.167 25068
2643 1 6 . 1 1 86 86 TYR C C 86 177.815 177.815 178.110 -0.295 25068
2644 1 6 . 1 1 86 86 TYR CA C 86 62.072 62.072 61.875 0.197 25068
2645 1 6 . 1 1 86 86 TYR CB C 86 39.954 39.954 38.331 1.623 25068
2646 1 6 . 1 1 86 86 TYR H H 86 8.277 8.277 8.397 -0.120 25068
2647 1 6 . 1 1 87 87 ARG N N 87 118.353 118.353 118.527 -0.174 25068
2648 1 6 . 1 1 87 87 ARG HA H 87 3.877 3.877 3.938 -0.061 25068
2649 1 6 . 1 1 87 87 ARG C C 87 178.067 178.067 178.568 -0.501 25068
2650 1 6 . 1 1 87 87 ARG CA C 87 59.513 59.513 59.510 0.003 25068
2651 1 6 . 1 1 87 87 ARG CB C 87 31.053 31.053 30.334 0.719 25068
2652 1 6 . 1 1 87 87 ARG H H 87 8.249 8.249 8.502 -0.253 25068
2653 1 6 . 1 1 88 88 LYS N N 88 118.205 118.205 116.646 1.559 25068
2654 1 6 . 1 1 88 88 LYS HA H 88 3.982 3.982 4.048 -0.066 25068
2655 1 6 . 1 1 88 88 LYS C C 88 178.050 178.050 177.343 0.707 25068
2656 1 6 . 1 1 88 88 LYS CA C 88 59.265 59.265 59.138 0.127 25068
2657 1 6 . 1 1 88 88 LYS CB C 88 33.499 33.499 32.783 0.716 25068
2658 1 6 . 1 1 88 88 LYS H H 88 7.465 7.465 7.953 -0.488 25068
2659 1 6 . 1 1 89 89 LYS N N 89 118.341 118.341 113.728 4.613 25068
2660 1 6 . 1 1 89 89 LYS HA H 89 4.084 4.084 4.478 -0.394 25068
2661 1 6 . 1 1 89 89 LYS C C 89 176.691 176.691 175.934 0.757 25068
2662 1 6 . 1 1 89 89 LYS CA C 89 58.188 58.188 55.706 2.482 25068
2663 1 6 . 1 1 89 89 LYS CB C 89 33.809 33.809 32.012 1.797 25068
2664 1 6 . 1 1 89 89 LYS H H 89 7.580 7.580 7.734 -0.154 25068
2665 1 6 . 1 1 90 90 ASN N N 90 117.604 117.604 118.284 -0.680 25068
2666 1 6 . 1 1 90 90 ASN HA H 90 4.563 4.563 4.803 -0.240 25068
2667 1 6 . 1 1 90 90 ASN C C 90 174.419 174.419 174.936 -0.517 25068
2668 1 6 . 1 1 90 90 ASN CA C 90 54.433 54.433 54.268 0.165 25068
2669 1 6 . 1 1 90 90 ASN CB C 90 40.182 40.182 41.179 -0.998 25068
2670 1 6 . 1 1 90 90 ASN H H 90 7.741 7.741 7.920 -0.179 25068
2671 1 6 . 1 1 91 91 GLN N N 91 111.990 111.990 121.410 -9.420 25068
2672 1 6 . 1 1 91 91 GLN HA H 91 4.213 4.213 4.464 -0.251 25068
2673 1 6 . 1 1 91 91 GLN C C 91 174.970 174.970 175.405 -0.435 25068
2674 1 6 . 1 1 91 91 GLN CA C 91 57.011 57.011 55.285 1.726 25068
2675 1 6 . 1 1 91 91 GLN CB C 91 30.358 30.358 29.056 1.302 25068
2676 1 6 . 1 1 91 91 GLN H H 91 7.925 7.925 7.679 0.246 25068
2677 1 7 . 1 1 14 14 PRO HA H 14 4.322 4.322 4.315 0.007 25068
2678 1 7 . 1 1 14 14 PRO C C 14 176.783 176.783 176.828 -0.045 25068
2679 1 7 . 1 1 14 14 PRO CA C 14 64.643 64.643 63.382 1.261 25068
2680 1 7 . 1 1 14 14 PRO CB C 14 33.114 33.114 32.218 0.895 25068
2681 1 7 . 1 1 15 15 LEU N N 15 120.158 120.158 117.818 2.340 25068
2682 1 7 . 1 1 15 15 LEU HA H 15 4.238 4.238 3.977 0.261 25068
2683 1 7 . 1 1 15 15 LEU C C 15 176.361 176.361 176.297 0.064 25068
2684 1 7 . 1 1 15 15 LEU CA C 15 55.395 55.395 54.745 0.650 25068
2685 1 7 . 1 1 15 15 LEU CB C 15 42.619 42.619 41.298 1.321 25068
2686 1 7 . 1 1 15 15 LEU H H 15 8.189 8.189 8.090 0.099 25068
2687 1 7 . 1 1 16 16 ALA N N 16 124.269 124.269 121.117 3.152 25068
2688 1 7 . 1 1 16 16 ALA HA H 16 3.496 3.496 4.510 -1.014 25068
2689 1 7 . 1 1 16 16 ALA C C 16 175.124 175.124 175.702 -0.578 25068
2690 1 7 . 1 1 16 16 ALA CA C 16 51.457 51.457 50.755 0.702 25068
2691 1 7 . 1 1 16 16 ALA CB C 16 18.105 18.105 19.544 -1.439 25068
2692 1 7 . 1 1 16 16 ALA H H 16 7.500 7.500 7.885 -0.385 25068
2693 1 7 . 1 1 17 17 PRO HA H 17 4.157 4.157 4.429 -0.272 25068
2694 1 7 . 1 1 17 17 PRO C C 17 176.396 176.396 175.803 0.593 25068
2695 1 7 . 1 1 17 17 PRO CA C 17 63.588 63.588 62.181 1.407 25068
2696 1 7 . 1 1 17 17 PRO CB C 17 32.850 32.850 31.883 0.967 25068
2697 1 7 . 1 1 18 18 LYS N N 18 124.070 124.070 120.951 3.119 25068
2698 1 7 . 1 1 18 18 LYS HA H 18 4.147 4.147 4.174 -0.027 25068
2699 1 7 . 1 1 18 18 LYS C C 18 177.543 177.543 175.210 2.333 25068
2700 1 7 . 1 1 18 18 LYS CA C 18 57.081 57.081 56.919 0.162 25068
2701 1 7 . 1 1 18 18 LYS CB C 18 33.573 33.573 32.943 0.630 25068
2702 1 7 . 1 1 18 18 LYS H H 18 8.886 8.886 8.249 0.637 25068
2703 1 7 . 1 1 19 19 ARG N N 19 122.242 122.242 119.770 2.472 25068
2704 1 7 . 1 1 19 19 ARG HA H 19 3.437 3.437 4.309 -0.872 25068
2705 1 7 . 1 1 19 19 ARG C C 19 175.409 175.409 174.449 0.960 25068
2706 1 7 . 1 1 19 19 ARG CA C 19 57.545 57.545 55.389 2.156 25068
2707 1 7 . 1 1 19 19 ARG CB C 19 31.149 31.149 31.439 -0.290 25068
2708 1 7 . 1 1 19 19 ARG H H 19 8.286 8.286 8.178 0.108 25068
2709 1 7 . 1 1 20 20 ALA N N 20 123.176 123.176 125.889 -2.713 25068
2710 1 7 . 1 1 20 20 ALA HA H 20 4.139 4.139 4.617 -0.478 25068
2711 1 7 . 1 1 20 20 ALA C C 20 177.843 177.843 176.177 1.666 25068
2712 1 7 . 1 1 20 20 ALA CA C 20 52.391 52.391 50.902 1.489 25068
2713 1 7 . 1 1 20 20 ALA CB C 20 19.397 19.397 21.147 -1.750 25068
2714 1 7 . 1 1 20 20 ALA H H 20 7.348 7.348 9.002 -1.654 25068
2715 1 7 . 1 1 21 21 LEU N N 21 125.680 125.680 120.550 5.130 25068
2716 1 7 . 1 1 21 21 LEU HA H 21 4.194 4.194 4.299 -0.105 25068
2717 1 7 . 1 1 21 21 LEU C C 21 177.091 177.091 177.395 -0.304 25068
2718 1 7 . 1 1 21 21 LEU CA C 21 55.472 55.472 55.220 0.252 25068
2719 1 7 . 1 1 21 21 LEU CB C 21 43.931 43.931 42.417 1.514 25068
2720 1 7 . 1 1 21 21 LEU H H 21 9.055 9.055 8.464 0.591 25068
2721 1 7 . 1 1 22 22 SER N N 22 116.686 116.686 115.329 1.357 25068
2722 1 7 . 1 1 22 22 SER HA H 22 4.427 4.427 4.444 -0.017 25068
2723 1 7 . 1 1 22 22 SER C C 22 174.241 174.241 175.203 -0.962 25068
2724 1 7 . 1 1 22 22 SER CA C 22 57.564 57.564 57.184 0.379 25068
2725 1 7 . 1 1 22 22 SER CB C 22 66.568 66.568 64.041 2.527 25068
2726 1 7 . 1 1 22 22 SER H H 22 7.549 7.549 8.092 -0.543 25068
2727 1 7 . 1 1 23 23 ALA N N 23 123.382 123.382 123.482 -0.100 25068
2728 1 7 . 1 1 23 23 ALA HA H 23 4.163 4.163 3.881 0.282 25068
2729 1 7 . 1 1 23 23 ALA C C 23 178.863 178.863 179.048 -0.185 25068
2730 1 7 . 1 1 23 23 ALA CA C 23 57.124 57.124 54.076 3.048 25068
2731 1 7 . 1 1 23 23 ALA CB C 23 19.441 19.441 18.237 1.204 25068
2732 1 7 . 1 1 23 23 ALA H H 23 9.035 9.035 8.763 0.272 25068
2733 1 7 . 1 1 24 24 TYR N N 24 115.979 115.979 118.181 -2.202 25068
2734 1 7 . 1 1 24 24 TYR HA H 24 2.590 2.590 4.464 -1.874 25068
2735 1 7 . 1 1 24 24 TYR C C 24 176.257 176.257 177.888 -1.631 25068
2736 1 7 . 1 1 24 24 TYR CA C 24 60.940 60.940 61.830 -0.890 25068
2737 1 7 . 1 1 24 24 TYR CB C 24 39.106 39.106 37.773 1.333 25068
2738 1 7 . 1 1 24 24 TYR H H 24 8.206 8.206 8.121 0.085 25068
2739 1 7 . 1 1 25 25 MET N N 25 116.391 116.391 118.305 -1.914 25068
2740 1 7 . 1 1 25 25 MET HA H 25 3.643 3.643 4.173 -0.530 25068
2741 1 7 . 1 1 25 25 MET C C 25 180.177 180.177 178.165 2.012 25068
2742 1 7 . 1 1 25 25 MET CA C 25 59.161 59.161 58.033 1.128 25068
2743 1 7 . 1 1 25 25 MET CB C 25 32.748 32.748 31.425 1.323 25068
2744 1 7 . 1 1 25 25 MET H H 25 7.433 7.433 8.449 -1.016 25068
2745 1 7 . 1 1 26 26 PHE N N 26 118.699 118.699 120.060 -1.361 25068
2746 1 7 . 1 1 26 26 PHE HA H 26 4.063 4.063 4.087 -0.024 25068
2747 1 7 . 1 1 26 26 PHE C C 26 178.055 178.055 177.197 0.858 25068
2748 1 7 . 1 1 26 26 PHE CA C 26 64.840 64.840 62.855 1.985 25068
2749 1 7 . 1 1 26 26 PHE CB C 26 40.437 40.437 38.507 1.930 25068
2750 1 7 . 1 1 26 26 PHE H H 26 7.982 7.982 7.723 0.259 25068
2751 1 7 . 1 1 27 27 TYR N N 27 123.888 123.888 118.645 5.243 25068
2752 1 7 . 1 1 27 27 TYR HA H 27 3.576 3.576 4.081 -0.505 25068
2753 1 7 . 1 1 27 27 TYR C C 27 176.691 176.691 177.999 -1.308 25068
2754 1 7 . 1 1 27 27 TYR CA C 27 62.831 62.831 61.633 1.198 25068
2755 1 7 . 1 1 27 27 TYR CB C 27 39.238 39.238 38.110 1.128 25068
2756 1 7 . 1 1 27 27 TYR H H 27 7.843 7.843 7.786 0.057 25068
2757 1 7 . 1 1 28 28 VAL N N 28 119.501 119.501 119.469 0.032 25068
2758 1 7 . 1 1 28 28 VAL HA H 28 2.912 2.912 3.449 -0.537 25068
2759 1 7 . 1 1 28 28 VAL C C 28 177.067 177.067 178.051 -0.984 25068
2760 1 7 . 1 1 28 28 VAL CA C 28 67.149 67.149 67.710 -0.562 25068
2761 1 7 . 1 1 28 28 VAL CB C 28 32.599 32.599 31.476 1.123 25068
2762 1 7 . 1 1 28 28 VAL H H 28 8.370 8.370 8.457 -0.087 25068
2763 1 7 . 1 1 29 29 LYS N N 29 114.512 114.512 119.498 -4.986 25068
2764 1 7 . 1 1 29 29 LYS HA H 29 3.676 3.676 3.835 -0.159 25068
2765 1 7 . 1 1 29 29 LYS C C 29 178.627 178.627 178.695 -0.068 25068
2766 1 7 . 1 1 29 29 LYS CA C 29 60.349 60.349 60.430 -0.081 25068
2767 1 7 . 1 1 29 29 LYS CB C 29 33.278 33.278 32.059 1.219 25068
2768 1 7 . 1 1 29 29 LYS H H 29 6.821 6.821 8.319 -1.498 25068
2769 1 7 . 1 1 30 30 ASP N N 30 116.793 116.793 119.606 -2.813 25068
2770 1 7 . 1 1 30 30 ASP HA H 30 4.466 4.466 4.206 0.260 25068
2771 1 7 . 1 1 30 30 ASP C C 30 178.615 178.615 178.531 0.084 25068
2772 1 7 . 1 1 30 30 ASP CA C 30 57.223 57.223 57.343 -0.120 25068
2773 1 7 . 1 1 30 30 ASP CB C 30 42.066 42.066 40.258 1.808 25068
2774 1 7 . 1 1 30 30 ASP H H 30 6.875 6.875 8.289 -1.414 25068
2775 1 7 . 1 1 31 31 LYS N N 31 122.423 122.423 120.236 2.187 25068
2776 1 7 . 1 1 31 31 LYS HA H 31 3.813 3.813 4.262 -0.449 25068
2777 1 7 . 1 1 31 31 LYS C C 31 178.443 178.443 179.312 -0.869 25068
2778 1 7 . 1 1 31 31 LYS CA C 31 57.494 57.494 59.254 -1.760 25068
2779 1 7 . 1 1 31 31 LYS CB C 31 32.539 32.539 32.493 0.046 25068
2780 1 7 . 1 1 31 31 LYS H H 31 8.910 8.910 8.292 0.618 25068
2781 1 7 . 1 1 32 32 ARG N N 32 117.823 117.823 119.520 -1.697 25068
2782 1 7 . 1 1 32 32 ARG HA H 32 3.540 3.540 4.043 -0.503 25068
2783 1 7 . 1 1 32 32 ARG C C 32 176.951 176.951 178.798 -1.847 25068
2784 1 7 . 1 1 32 32 ARG CA C 32 61.259 61.259 59.635 1.624 25068
2785 1 7 . 1 1 32 32 ARG CB C 32 30.668 30.668 30.191 0.477 25068
2786 1 7 . 1 1 32 32 ARG H H 32 8.501 8.501 8.202 0.299 25068
2787 1 7 . 1 1 33 33 LEU N N 33 114.878 114.878 118.815 -3.937 25068
2788 1 7 . 1 1 33 33 LEU HA H 33 3.871 3.871 4.039 -0.168 25068
2789 1 7 . 1 1 33 33 LEU C C 33 179.180 179.180 179.318 -0.138 25068
2790 1 7 . 1 1 33 33 LEU CA C 33 58.377 58.377 58.264 0.113 25068
2791 1 7 . 1 1 33 33 LEU CB C 33 42.429 42.429 41.909 0.520 25068
2792 1 7 . 1 1 33 33 LEU H H 33 6.549 6.549 8.469 -1.920 25068
2793 1 7 . 1 1 34 34 GLU N N 34 118.637 118.637 119.323 -0.686 25068
2794 1 7 . 1 1 34 34 GLU HA H 34 3.866 3.866 3.999 -0.133 25068
2795 1 7 . 1 1 34 34 GLU C C 34 178.988 178.988 179.301 -0.313 25068
2796 1 7 . 1 1 34 34 GLU CA C 34 60.248 60.248 59.845 0.403 25068
2797 1 7 . 1 1 34 34 GLU CB C 34 31.325 31.325 29.649 1.676 25068
2798 1 7 . 1 1 34 34 GLU H H 34 7.135 7.135 8.178 -1.043 25068
2799 1 7 . 1 1 35 35 ILE N N 35 119.142 119.142 119.968 -0.826 25068
2800 1 7 . 1 1 35 35 ILE HA H 35 3.693 3.693 3.959 -0.267 25068
2801 1 7 . 1 1 35 35 ILE C C 35 177.789 177.789 178.488 -0.699 25068
2802 1 7 . 1 1 35 35 ILE CA C 35 65.753 65.753 65.129 0.624 25068
2803 1 7 . 1 1 35 35 ILE CB C 35 38.940 38.940 37.837 1.103 25068
2804 1 7 . 1 1 35 35 ILE H H 35 8.076 8.076 8.230 -0.154 25068
2805 1 7 . 1 1 36 36 ILE N N 36 116.296 116.296 119.460 -3.164 25068
2806 1 7 . 1 1 36 36 ILE HA H 36 3.640 3.640 3.946 -0.306 25068
2807 1 7 . 1 1 36 36 ILE C C 36 177.270 177.270 177.280 -0.010 25068
2808 1 7 . 1 1 36 36 ILE CA C 36 64.633 64.633 64.091 0.542 25068
2809 1 7 . 1 1 36 36 ILE CB C 36 38.718 38.718 38.303 0.415 25068
2810 1 7 . 1 1 36 36 ILE H H 36 7.754 7.754 7.993 -0.239 25068
2811 1 7 . 1 1 37 37 LYS N N 37 119.626 119.626 118.278 1.348 25068
2812 1 7 . 1 1 37 37 LYS HA H 37 3.922 3.922 4.068 -0.146 25068
2813 1 7 . 1 1 37 37 LYS C C 37 178.129 178.129 177.983 0.146 25068
2814 1 7 . 1 1 37 37 LYS CA C 37 59.996 59.996 58.517 1.479 25068
2815 1 7 . 1 1 37 37 LYS CB C 37 33.487 33.487 32.514 0.973 25068
2816 1 7 . 1 1 37 37 LYS H H 37 7.413 7.413 7.977 -0.564 25068
2817 1 7 . 1 1 38 38 GLU N N 38 116.708 116.708 118.130 -1.422 25068
2818 1 7 . 1 1 38 38 GLU HA H 38 4.060 4.060 4.251 -0.191 25068
2819 1 7 . 1 1 38 38 GLU C C 38 177.004 177.004 176.939 0.065 25068
2820 1 7 . 1 1 38 38 GLU CA C 38 59.070 59.070 57.556 1.514 25068
2821 1 7 . 1 1 38 38 GLU CB C 38 31.665 31.665 30.488 1.177 25068
2822 1 7 . 1 1 38 38 GLU H H 38 7.354 7.354 8.086 -0.732 25068
2823 1 7 . 1 1 39 39 LYS N N 39 118.621 118.621 119.446 -0.825 25068
2824 1 7 . 1 1 39 39 LYS HA H 39 4.690 4.690 4.729 -0.039 25068
2825 1 7 . 1 1 39 39 LYS C C 39 172.792 172.792 174.543 -1.751 25068
2826 1 7 . 1 1 39 39 LYS CA C 39 54.596 54.596 53.197 1.399 25068
2827 1 7 . 1 1 39 39 LYS CB C 39 33.945 33.945 33.718 0.227 25068
2828 1 7 . 1 1 39 39 LYS H H 39 8.176 8.176 7.635 0.541 25068
2829 1 7 . 1 1 40 40 PRO HA H 40 4.429 4.429 4.353 0.076 25068
2830 1 7 . 1 1 40 40 PRO C C 40 179.829 179.829 177.637 2.192 25068
2831 1 7 . 1 1 40 40 PRO CA C 40 66.040 66.040 64.686 1.354 25068
2832 1 7 . 1 1 40 40 PRO CB C 40 32.606 32.606 32.045 0.561 25068
2833 1 7 . 1 1 41 41 GLU N N 41 119.150 119.150 119.817 -0.667 25068
2834 1 7 . 1 1 41 41 GLU HA H 41 4.143 4.143 4.187 -0.044 25068
2835 1 7 . 1 1 41 41 GLU C C 41 178.502 178.502 178.459 0.043 25068
2836 1 7 . 1 1 41 41 GLU CA C 41 59.485 59.485 59.191 0.294 25068
2837 1 7 . 1 1 41 41 GLU CB C 41 28.574 28.574 29.419 -0.845 25068
2838 1 7 . 1 1 41 41 GLU H H 41 9.789 9.789 8.779 1.010 25068
2839 1 7 . 1 1 42 42 LEU N N 42 121.443 121.443 120.328 1.115 25068
2840 1 7 . 1 1 42 42 LEU HA H 42 4.185 4.185 4.699 -0.514 25068
2841 1 7 . 1 1 42 42 LEU C C 42 177.815 177.815 178.027 -0.212 25068
2842 1 7 . 1 1 42 42 LEU CA C 42 56.730 56.730 54.761 1.968 25068
2843 1 7 . 1 1 42 42 LEU CB C 42 42.013 42.013 41.866 0.147 25068
2844 1 7 . 1 1 42 42 LEU H H 42 8.312 8.312 7.590 0.722 25068
2845 1 7 . 1 1 43 43 ALA N N 43 119.949 119.949 121.621 -1.672 25068
2846 1 7 . 1 1 43 43 ALA HA H 43 3.746 3.746 4.040 -0.294 25068
2847 1 7 . 1 1 43 43 ALA C C 43 178.635 178.635 177.739 0.896 25068
2848 1 7 . 1 1 43 43 ALA CA C 43 56.164 56.164 54.300 1.864 25068
2849 1 7 . 1 1 43 43 ALA CB C 43 19.670 19.670 18.455 1.215 25068
2850 1 7 . 1 1 43 43 ALA H H 43 7.554 7.554 7.881 -0.327 25068
2851 1 7 . 1 1 44 44 LYS N N 44 112.690 112.690 115.793 -3.103 25068
2852 1 7 . 1 1 44 44 LYS HA H 44 4.232 4.232 4.420 -0.188 25068
2853 1 7 . 1 1 44 44 LYS C C 44 175.949 175.949 175.635 0.314 25068
2854 1 7 . 1 1 44 44 LYS CA C 44 56.987 56.987 55.493 1.494 25068
2855 1 7 . 1 1 44 44 LYS CB C 44 33.345 33.345 32.253 1.092 25068
2856 1 7 . 1 1 44 44 LYS H H 44 7.560 7.560 7.967 -0.407 25068
2857 1 7 . 1 1 45 45 ASP N N 45 122.529 122.529 122.518 0.011 25068
2858 1 7 . 1 1 45 45 ASP HA H 45 4.749 4.749 4.884 -0.135 25068
2859 1 7 . 1 1 45 45 ASP C C 45 174.677 174.677 175.976 -1.299 25068
2860 1 7 . 1 1 45 45 ASP CA C 45 53.030 53.030 52.999 0.031 25068
2861 1 7 . 1 1 45 45 ASP CB C 45 41.549 41.549 40.203 1.346 25068
2862 1 7 . 1 1 45 45 ASP H H 45 7.672 7.672 8.049 -0.377 25068
2863 1 7 . 1 1 46 46 VAL N N 46 121.529 121.529 123.086 -1.557 25068
2864 1 7 . 1 1 46 46 VAL HA H 46 3.639 3.639 3.591 0.047 25068
2865 1 7 . 1 1 46 46 VAL C C 46 179.102 179.102 177.479 1.623 25068
2866 1 7 . 1 1 46 46 VAL CA C 46 66.430 66.430 66.356 0.074 25068
2867 1 7 . 1 1 46 46 VAL CB C 46 32.650 32.650 31.704 0.946 25068
2868 1 7 . 1 1 46 46 VAL H H 46 7.808 7.808 7.958 -0.150 25068
2869 1 7 . 1 1 47 47 ALA N N 47 123.933 123.933 120.385 3.548 25068
2870 1 7 . 1 1 47 47 ALA HA H 47 4.112 4.112 3.944 0.168 25068
2871 1 7 . 1 1 47 47 ALA C C 47 180.665 180.665 179.724 0.941 25068
2872 1 7 . 1 1 47 47 ALA CA C 47 55.822 55.822 55.161 0.661 25068
2873 1 7 . 1 1 47 47 ALA CB C 47 19.129 19.129 18.162 0.967 25068
2874 1 7 . 1 1 47 47 ALA H H 47 8.505 8.505 8.205 0.300 25068
2875 1 7 . 1 1 48 48 GLN N N 48 120.047 120.047 118.754 1.293 25068
2876 1 7 . 1 1 48 48 GLN HA H 48 4.033 4.033 4.097 -0.064 25068
2877 1 7 . 1 1 48 48 GLN C C 48 178.486 178.486 178.158 0.328 25068
2878 1 7 . 1 1 48 48 GLN CA C 48 59.436 59.436 58.276 1.161 25068
2879 1 7 . 1 1 48 48 GLN CB C 48 29.436 29.436 28.064 1.372 25068
2880 1 7 . 1 1 48 48 GLN H H 48 7.852 7.852 7.615 0.237 25068
2881 1 7 . 1 1 49 49 VAL N N 49 119.185 119.185 116.690 2.495 25068
2882 1 7 . 1 1 49 49 VAL HA H 49 3.424 3.424 3.591 -0.167 25068
2883 1 7 . 1 1 49 49 VAL C C 49 177.519 177.519 177.973 -0.454 25068
2884 1 7 . 1 1 49 49 VAL CA C 49 68.854 68.854 66.111 2.743 25068
2885 1 7 . 1 1 49 49 VAL CB C 49 32.454 32.454 31.067 1.387 25068
2886 1 7 . 1 1 49 49 VAL H H 49 7.984 7.984 7.995 -0.011 25068
2887 1 7 . 1 1 50 50 GLY N N 50 104.919 104.919 108.166 -3.247 25068
2888 1 7 . 1 1 50 50 GLY C C 50 176.825 176.825 175.822 1.003 25068
2889 1 7 . 1 1 50 50 GLY CA C 50 48.398 48.398 47.357 1.041 25068
2890 1 7 . 1 1 50 50 GLY H H 50 8.020 8.020 8.382 -0.362 25068
2891 1 7 . 1 1 51 51 LYS N N 51 123.422 123.422 122.797 0.625 25068
2892 1 7 . 1 1 51 51 LYS HA H 51 4.032 4.032 4.053 -0.021 25068
2893 1 7 . 1 1 51 51 LYS C C 51 179.332 179.332 179.133 0.199 25068
2894 1 7 . 1 1 51 51 LYS CA C 51 60.246 60.246 59.003 1.243 25068
2895 1 7 . 1 1 51 51 LYS CB C 51 33.626 33.626 32.066 1.560 25068
2896 1 7 . 1 1 51 51 LYS H H 51 7.699 7.699 7.885 -0.186 25068
2897 1 7 . 1 1 52 52 LEU N N 52 120.442 120.442 120.567 -0.125 25068
2898 1 7 . 1 1 52 52 LEU HA H 52 4.041 4.041 4.003 0.038 25068
2899 1 7 . 1 1 52 52 LEU C C 52 180.984 180.984 178.977 2.007 25068
2900 1 7 . 1 1 52 52 LEU CA C 52 58.855 58.855 57.900 0.955 25068
2901 1 7 . 1 1 52 52 LEU CB C 52 43.046 43.046 41.631 1.415 25068
2902 1 7 . 1 1 52 52 LEU H H 52 8.088 8.088 7.823 0.265 25068
2903 1 7 . 1 1 53 53 ILE N N 53 121.249 121.249 119.074 2.175 25068
2904 1 7 . 1 1 53 53 ILE HA H 53 3.557 3.557 3.784 -0.227 25068
2905 1 7 . 1 1 53 53 ILE C C 53 177.945 177.945 178.519 -0.574 25068
2906 1 7 . 1 1 53 53 ILE CA C 53 67.431 67.431 62.868 4.563 25068
2907 1 7 . 1 1 53 53 ILE CB C 53 38.887 38.887 36.010 2.877 25068
2908 1 7 . 1 1 53 53 ILE H H 53 8.475 8.475 8.137 0.338 25068
2909 1 7 . 1 1 54 54 GLY N N 54 107.755 107.755 107.834 -0.079 25068
2910 1 7 . 1 1 54 54 GLY C C 54 177.691 177.691 176.235 1.456 25068
2911 1 7 . 1 1 54 54 GLY CA C 54 48.997 48.997 47.434 1.562 25068
2912 1 7 . 1 1 54 54 GLY H H 54 8.130 8.130 8.386 -0.256 25068
2913 1 7 . 1 1 55 55 GLU N N 55 122.138 122.138 122.405 -0.267 25068
2914 1 7 . 1 1 55 55 GLU HA H 55 4.032 4.032 3.861 0.171 25068
2915 1 7 . 1 1 55 55 GLU C C 55 179.146 179.146 178.920 0.226 25068
2916 1 7 . 1 1 55 55 GLU CA C 55 59.958 59.958 59.274 0.684 25068
2917 1 7 . 1 1 55 55 GLU CB C 55 30.551 30.551 29.643 0.908 25068
2918 1 7 . 1 1 55 55 GLU H H 55 8.089 8.089 8.138 -0.049 25068
2919 1 7 . 1 1 56 56 ALA N N 56 122.985 122.985 121.957 1.028 25068
2920 1 7 . 1 1 56 56 ALA HA H 56 4.107 4.107 4.025 0.082 25068
2921 1 7 . 1 1 56 56 ALA C C 56 181.177 181.177 179.186 1.991 25068
2922 1 7 . 1 1 56 56 ALA CA C 56 56.414 56.414 54.706 1.708 25068
2923 1 7 . 1 1 56 56 ALA CB C 56 19.948 19.948 18.144 1.804 25068
2924 1 7 . 1 1 56 56 ALA H H 56 7.947 7.947 7.889 0.058 25068
2925 1 7 . 1 1 57 57 TRP N N 57 120.485 120.485 121.967 -1.482 25068
2926 1 7 . 1 1 57 57 TRP HA H 57 3.940 3.940 4.339 -0.399 25068
2927 1 7 . 1 1 57 57 TRP C C 57 178.537 178.537 178.924 -0.387 25068
2928 1 7 . 1 1 57 57 TRP CA C 57 60.633 60.633 60.563 0.070 25068
2929 1 7 . 1 1 57 57 TRP CB C 57 31.681 31.681 29.490 2.191 25068
2930 1 7 . 1 1 57 57 TRP H H 57 8.910 8.910 8.087 0.823 25068
2931 1 7 . 1 1 58 58 GLY N N 58 102.004 102.004 106.519 -4.515 25068
2932 1 7 . 1 1 58 58 GLY C C 58 174.723 174.723 175.004 -0.281 25068
2933 1 7 . 1 1 58 58 GLY CA C 58 47.091 47.091 46.417 0.674 25068
2934 1 7 . 1 1 58 58 GLY H H 58 7.668 7.668 8.076 -0.408 25068
2935 1 7 . 1 1 59 59 GLN N N 59 116.202 116.202 117.307 -1.105 25068
2936 1 7 . 1 1 59 59 GLN HA H 59 4.259 4.259 4.335 -0.076 25068
2937 1 7 . 1 1 59 59 GLN C C 59 176.221 176.221 175.884 0.337 25068
2938 1 7 . 1 1 59 59 GLN CA C 59 55.967 55.967 54.720 1.247 25068
2939 1 7 . 1 1 59 59 GLN CB C 59 30.741 30.741 28.820 1.921 25068
2940 1 7 . 1 1 59 59 GLN H H 59 7.189 7.189 7.702 -0.513 25068
2941 1 7 . 1 1 60 60 LEU N N 60 120.776 120.776 122.427 -1.651 25068
2942 1 7 . 1 1 60 60 LEU HA H 60 4.185 4.185 4.402 -0.217 25068
2943 1 7 . 1 1 60 60 LEU C C 60 177.372 177.372 176.120 1.252 25068
2944 1 7 . 1 1 60 60 LEU CA C 60 56.061 56.061 54.754 1.307 25068
2945 1 7 . 1 1 60 60 LEU CB C 60 43.696 43.696 42.748 0.948 25068
2946 1 7 . 1 1 60 60 LEU H H 60 6.968 6.968 7.690 -0.722 25068
2947 1 7 . 1 1 61 61 SER N N 61 120.432 120.432 118.934 1.498 25068
2948 1 7 . 1 1 61 61 SER HA H 61 4.582 4.582 4.676 -0.094 25068
2949 1 7 . 1 1 61 61 SER C C 61 173.500 173.500 174.013 -0.513 25068
2950 1 7 . 1 1 61 61 SER CA C 61 57.204 57.204 56.382 0.822 25068
2951 1 7 . 1 1 61 61 SER CB C 61 63.980 63.980 64.236 -0.256 25068
2952 1 7 . 1 1 61 61 SER H H 61 8.885 8.885 8.333 0.552 25068
2953 1 7 . 1 1 63 63 ALA HA H 63 4.089 4.089 4.165 -0.076 25068
2954 1 7 . 1 1 63 63 ALA C C 63 180.570 180.570 178.959 1.611 25068
2955 1 7 . 1 1 63 63 ALA CA C 63 56.005 56.005 54.632 1.373 25068
2956 1 7 . 1 1 63 63 ALA CB C 63 19.317 19.317 18.239 1.078 25068
2957 1 7 . 1 1 64 64 GLN N N 64 116.774 116.774 117.043 -0.269 25068
2958 1 7 . 1 1 64 64 GLN HA H 64 4.122 4.122 4.227 -0.105 25068
2959 1 7 . 1 1 64 64 GLN C C 64 178.275 178.275 178.209 0.066 25068
2960 1 7 . 1 1 64 64 GLN CA C 64 58.622 58.622 57.880 0.742 25068
2961 1 7 . 1 1 64 64 GLN CB C 64 31.350 31.350 28.963 2.387 25068
2962 1 7 . 1 1 64 64 GLN H H 64 7.603 7.603 7.843 -0.240 25068
2963 1 7 . 1 1 65 65 LYS N N 65 117.203 117.203 120.219 -3.016 25068
2964 1 7 . 1 1 65 65 LYS HA H 65 4.129 4.129 4.063 0.066 25068
2965 1 7 . 1 1 65 65 LYS C C 65 178.449 178.449 178.890 -0.441 25068
2966 1 7 . 1 1 65 65 LYS CA C 65 59.891 59.891 59.582 0.309 25068
2967 1 7 . 1 1 65 65 LYS CB C 65 34.351 34.351 32.355 1.996 25068
2968 1 7 . 1 1 65 65 LYS H H 65 7.810 7.810 7.780 0.030 25068
2969 1 7 . 1 1 66 66 ALA N N 66 122.218 122.218 122.602 -0.384 25068
2970 1 7 . 1 1 66 66 ALA HA H 66 4.290 4.290 4.233 0.057 25068
2971 1 7 . 1 1 66 66 ALA C C 66 176.135 176.135 176.666 -0.531 25068
2972 1 7 . 1 1 66 66 ALA CA C 66 57.745 57.745 56.809 0.936 25068
2973 1 7 . 1 1 66 66 ALA CB C 66 17.033 17.033 16.354 0.680 25068
2974 1 7 . 1 1 66 66 ALA H H 66 7.469 7.469 8.347 -0.878 25068
2975 1 7 . 1 1 67 67 PRO HA H 67 4.142 4.142 4.359 -0.217 25068
2976 1 7 . 1 1 67 67 PRO C C 67 179.591 179.591 179.043 0.548 25068
2977 1 7 . 1 1 67 67 PRO CA C 67 66.960 66.960 65.672 1.288 25068
2978 1 7 . 1 1 67 67 PRO CB C 67 32.014 32.014 31.527 0.487 25068
2979 1 7 . 1 1 68 68 TYR N N 68 117.140 117.140 119.384 -2.244 25068
2980 1 7 . 1 1 68 68 TYR HA H 68 3.940 3.940 3.992 -0.052 25068
2981 1 7 . 1 1 68 68 TYR C C 68 177.733 177.733 178.662 -0.929 25068
2982 1 7 . 1 1 68 68 TYR CA C 68 63.505 63.505 61.416 2.089 25068
2983 1 7 . 1 1 68 68 TYR CB C 68 38.503 38.503 37.532 0.971 25068
2984 1 7 . 1 1 68 68 TYR H H 68 7.268 7.268 8.429 -1.161 25068
2985 1 7 . 1 1 69 69 GLU N N 69 120.747 120.747 118.397 2.350 25068
2986 1 7 . 1 1 69 69 GLU HA H 69 4.253 4.253 4.045 0.208 25068
2987 1 7 . 1 1 69 69 GLU C C 69 179.805 179.805 178.830 0.975 25068
2988 1 7 . 1 1 69 69 GLU CA C 69 60.145 60.145 59.664 0.481 25068
2989 1 7 . 1 1 69 69 GLU CB C 69 29.808 29.808 29.389 0.419 25068
2990 1 7 . 1 1 69 69 GLU H H 69 8.048 8.048 8.512 -0.464 25068
2991 1 7 . 1 1 70 70 LYS N N 70 120.938 120.938 120.664 0.274 25068
2992 1 7 . 1 1 70 70 LYS HA H 70 4.020 4.020 3.945 0.075 25068
2993 1 7 . 1 1 70 70 LYS C C 70 178.740 178.740 178.992 -0.252 25068
2994 1 7 . 1 1 70 70 LYS CA C 70 60.202 60.202 59.790 0.412 25068
2995 1 7 . 1 1 70 70 LYS CB C 70 32.419 32.419 32.476 -0.057 25068
2996 1 7 . 1 1 70 70 LYS H H 70 8.301 8.301 8.135 0.166 25068
2997 1 7 . 1 1 71 71 LYS N N 71 118.427 118.427 118.510 -0.083 25068
2998 1 7 . 1 1 71 71 LYS HA H 71 3.528 3.528 3.969 -0.441 25068
2999 1 7 . 1 1 71 71 LYS C C 71 179.280 179.280 178.871 0.409 25068
3000 1 7 . 1 1 71 71 LYS CA C 71 61.146 61.146 59.002 2.144 25068
3001 1 7 . 1 1 71 71 LYS CB C 71 32.196 32.196 31.905 0.291 25068
3002 1 7 . 1 1 71 71 LYS H H 71 7.234 7.234 8.250 -1.016 25068
3003 1 7 . 1 1 72 72 ALA N N 72 122.126 122.126 121.961 0.165 25068
3004 1 7 . 1 1 72 72 ALA HA H 72 4.357 4.357 3.938 0.419 25068
3005 1 7 . 1 1 72 72 ALA C C 72 180.468 180.468 179.771 0.697 25068
3006 1 7 . 1 1 72 72 ALA CA C 72 56.457 56.457 55.143 1.314 25068
3007 1 7 . 1 1 72 72 ALA CB C 72 19.562 19.562 18.043 1.519 25068
3008 1 7 . 1 1 72 72 ALA H H 72 7.890 7.890 7.946 -0.056 25068
3009 1 7 . 1 1 73 73 GLN N N 73 121.659 121.659 119.122 2.537 25068
3010 1 7 . 1 1 73 73 GLN HA H 73 4.029 4.029 4.022 0.007 25068
3011 1 7 . 1 1 73 73 GLN C C 73 179.576 179.576 178.283 1.293 25068
3012 1 7 . 1 1 73 73 GLN CA C 73 60.427 60.427 58.993 1.434 25068
3013 1 7 . 1 1 73 73 GLN CB C 73 28.732 28.732 28.836 -0.104 25068
3014 1 7 . 1 1 73 73 GLN H H 73 8.353 8.353 8.136 0.217 25068
3015 1 7 . 1 1 74 74 LEU N N 74 119.752 119.752 120.744 -0.992 25068
3016 1 7 . 1 1 74 74 LEU HA H 74 4.046 4.046 3.880 0.166 25068
3017 1 7 . 1 1 74 74 LEU C C 74 180.424 180.424 179.332 1.092 25068
3018 1 7 . 1 1 74 74 LEU CA C 74 58.675 58.675 58.702 -0.027 25068
3019 1 7 . 1 1 74 74 LEU CB C 74 42.376 42.376 41.664 0.712 25068
3020 1 7 . 1 1 74 74 LEU H H 74 8.160 8.160 8.224 -0.064 25068
3021 1 7 . 1 1 75 75 ASP N N 75 122.159 122.159 118.490 3.669 25068
3022 1 7 . 1 1 75 75 ASP HA H 75 4.988 4.988 4.350 0.638 25068
3023 1 7 . 1 1 75 75 ASP C C 75 178.046 178.046 178.852 -0.806 25068
3024 1 7 . 1 1 75 75 ASP CA C 75 58.191 58.191 57.570 0.621 25068
3025 1 7 . 1 1 75 75 ASP CB C 75 42.958 42.958 40.261 2.697 25068
3026 1 7 . 1 1 75 75 ASP H H 75 8.361 8.361 8.489 -0.128 25068
3027 1 7 . 1 1 76 76 LYS N N 76 119.861 119.861 121.376 -1.515 25068
3028 1 7 . 1 1 76 76 LYS HA H 76 3.988 3.988 3.922 0.066 25068
3029 1 7 . 1 1 76 76 LYS C C 76 179.668 179.668 178.653 1.015 25068
3030 1 7 . 1 1 76 76 LYS CA C 76 60.984 60.984 59.779 1.205 25068
3031 1 7 . 1 1 76 76 LYS CB C 76 33.124 33.124 32.419 0.705 25068
3032 1 7 . 1 1 76 76 LYS H H 76 7.940 7.940 7.716 0.224 25068
3033 1 7 . 1 1 77 77 VAL N N 77 121.485 121.485 119.583 1.902 25068
3034 1 7 . 1 1 77 77 VAL HA H 77 3.687 3.687 3.700 -0.013 25068
3035 1 7 . 1 1 77 77 VAL C C 77 178.070 178.070 177.289 0.781 25068
3036 1 7 . 1 1 77 77 VAL CA C 77 67.359 67.359 65.526 1.833 25068
3037 1 7 . 1 1 77 77 VAL CB C 77 32.645 32.645 31.810 0.835 25068
3038 1 7 . 1 1 77 77 VAL H H 77 7.401 7.401 8.106 -0.705 25068
3039 1 7 . 1 1 78 78 ARG N N 78 121.960 121.960 120.167 1.793 25068
3040 1 7 . 1 1 78 78 ARG HA H 78 4.010 4.010 4.026 -0.016 25068
3041 1 7 . 1 1 78 78 ARG C C 78 179.144 179.144 178.597 0.547 25068
3042 1 7 . 1 1 78 78 ARG CA C 78 60.598 60.598 59.958 0.640 25068
3043 1 7 . 1 1 78 78 ARG CB C 78 28.352 28.352 30.141 -1.789 25068
3044 1 7 . 1 1 78 78 ARG H H 78 7.813 7.813 8.128 -0.315 25068
3045 1 7 . 1 1 79 79 TYR N N 79 120.411 120.411 118.595 1.816 25068
3046 1 7 . 1 1 79 79 TYR HA H 79 3.878 3.878 4.243 -0.365 25068
3047 1 7 . 1 1 79 79 TYR C C 79 176.080 176.080 178.044 -1.964 25068
3048 1 7 . 1 1 79 79 TYR CA C 79 63.669 63.669 60.603 3.066 25068
3049 1 7 . 1 1 79 79 TYR CB C 79 39.758 39.758 38.000 1.758 25068
3050 1 7 . 1 1 79 79 TYR H H 79 8.608 8.608 8.493 0.115 25068
3051 1 7 . 1 1 80 80 SER N N 80 113.726 113.726 114.318 -0.592 25068
3052 1 7 . 1 1 80 80 SER HA H 80 3.880 3.880 4.121 -0.241 25068
3053 1 7 . 1 1 80 80 SER C C 80 176.794 176.794 176.940 -0.146 25068
3054 1 7 . 1 1 80 80 SER CA C 80 62.969 62.969 62.093 0.876 25068
3055 1 7 . 1 1 80 80 SER CB C 80 63.605 63.605 63.106 0.499 25068
3056 1 7 . 1 1 80 80 SER H H 80 8.234 8.234 8.425 -0.191 25068
3057 1 7 . 1 1 81 81 LYS N N 81 121.920 121.920 120.786 1.134 25068
3058 1 7 . 1 1 81 81 LYS HA H 81 4.029 4.029 4.022 0.007 25068
3059 1 7 . 1 1 81 81 LYS C C 81 179.342 179.342 178.938 0.404 25068
3060 1 7 . 1 1 81 81 LYS CA C 81 60.138 60.138 59.307 0.831 25068
3061 1 7 . 1 1 81 81 LYS CB C 81 33.238 33.238 32.199 1.039 25068
3062 1 7 . 1 1 81 81 LYS H H 81 7.958 7.958 8.000 -0.042 25068
3063 1 7 . 1 1 82 82 GLU N N 82 119.515 119.515 119.718 -0.203 25068
3064 1 7 . 1 1 82 82 GLU HA H 82 3.945 3.945 4.041 -0.096 25068
3065 1 7 . 1 1 82 82 GLU C C 82 180.689 180.689 179.071 1.618 25068
3066 1 7 . 1 1 82 82 GLU CA C 82 60.920 60.920 59.466 1.454 25068
3067 1 7 . 1 1 82 82 GLU CB C 82 30.885 30.885 29.288 1.597 25068
3068 1 7 . 1 1 82 82 GLU H H 82 8.310 8.310 7.974 0.336 25068
3069 1 7 . 1 1 83 83 ILE N N 83 121.362 121.362 120.383 0.979 25068
3070 1 7 . 1 1 83 83 ILE HA H 83 3.889 3.889 3.703 0.186 25068
3071 1 7 . 1 1 83 83 ILE C C 83 177.207 177.207 177.944 -0.737 25068
3072 1 7 . 1 1 83 83 ILE CA C 83 62.754 62.754 63.714 -0.959 25068
3073 1 7 . 1 1 83 83 ILE CB C 83 37.651 37.651 38.005 -0.354 25068
3074 1 7 . 1 1 83 83 ILE H H 83 8.887 8.887 8.044 0.843 25068
3075 1 7 . 1 1 84 84 GLU N N 84 122.327 122.327 120.146 2.181 25068
3076 1 7 . 1 1 84 84 GLU HA H 84 4.028 4.028 3.947 0.081 25068
3077 1 7 . 1 1 84 84 GLU C C 84 179.047 179.047 179.337 -0.290 25068
3078 1 7 . 1 1 84 84 GLU CA C 84 60.045 60.045 60.097 -0.052 25068
3079 1 7 . 1 1 84 84 GLU CB C 84 30.099 30.099 29.105 0.994 25068
3080 1 7 . 1 1 84 84 GLU H H 84 7.289 7.289 8.203 -0.914 25068
3081 1 7 . 1 1 85 85 GLU N N 85 118.046 118.046 119.558 -1.512 25068
3082 1 7 . 1 1 85 85 GLU HA H 85 3.966 3.966 4.068 -0.102 25068
3083 1 7 . 1 1 85 85 GLU C C 85 178.614 178.614 179.381 -0.767 25068
3084 1 7 . 1 1 85 85 GLU CA C 85 59.997 59.997 59.385 0.612 25068
3085 1 7 . 1 1 85 85 GLU CB C 85 30.453 30.453 29.783 0.670 25068
3086 1 7 . 1 1 85 85 GLU H H 85 7.545 7.545 8.174 -0.629 25068
3087 1 7 . 1 1 86 86 TYR N N 86 121.050 121.050 118.915 2.135 25068
3088 1 7 . 1 1 86 86 TYR HA H 86 4.094 4.094 4.255 -0.161 25068
3089 1 7 . 1 1 86 86 TYR C C 86 177.815 177.815 178.094 -0.279 25068
3090 1 7 . 1 1 86 86 TYR CA C 86 62.072 62.072 61.755 0.317 25068
3091 1 7 . 1 1 86 86 TYR CB C 86 39.954 39.954 38.291 1.663 25068
3092 1 7 . 1 1 86 86 TYR H H 86 8.277 8.277 8.365 -0.088 25068
3093 1 7 . 1 1 87 87 ARG N N 87 118.353 118.353 118.438 -0.085 25068
3094 1 7 . 1 1 87 87 ARG HA H 87 3.877 3.877 3.941 -0.064 25068
3095 1 7 . 1 1 87 87 ARG C C 87 178.067 178.067 178.757 -0.690 25068
3096 1 7 . 1 1 87 87 ARG CA C 87 59.513 59.513 59.363 0.150 25068
3097 1 7 . 1 1 87 87 ARG CB C 87 31.053 31.053 30.326 0.727 25068
3098 1 7 . 1 1 87 87 ARG H H 87 8.249 8.249 8.477 -0.228 25068
3099 1 7 . 1 1 88 88 LYS N N 88 118.205 118.205 117.496 0.709 25068
3100 1 7 . 1 1 88 88 LYS HA H 88 3.982 3.982 4.074 -0.092 25068
3101 1 7 . 1 1 88 88 LYS C C 88 178.050 178.050 177.600 0.450 25068
3102 1 7 . 1 1 88 88 LYS CA C 88 59.265 59.265 58.454 0.811 25068
3103 1 7 . 1 1 88 88 LYS CB C 88 33.499 33.499 32.616 0.883 25068
3104 1 7 . 1 1 88 88 LYS H H 88 7.465 7.465 8.005 -0.540 25068
3105 1 7 . 1 1 89 89 LYS N N 89 118.341 118.341 113.576 4.765 25068
3106 1 7 . 1 1 89 89 LYS HA H 89 4.084 4.084 4.471 -0.387 25068
3107 1 7 . 1 1 89 89 LYS C C 89 176.691 176.691 176.023 0.668 25068
3108 1 7 . 1 1 89 89 LYS CA C 89 58.188 58.188 55.694 2.494 25068
3109 1 7 . 1 1 89 89 LYS CB C 89 33.809 33.809 32.095 1.714 25068
3110 1 7 . 1 1 89 89 LYS H H 89 7.580 7.580 7.811 -0.231 25068
3111 1 7 . 1 1 90 90 ASN N N 90 117.604 117.604 118.484 -0.880 25068
3112 1 7 . 1 1 90 90 ASN HA H 90 4.563 4.563 4.771 -0.208 25068
3113 1 7 . 1 1 90 90 ASN C C 90 174.419 174.419 175.171 -0.752 25068
3114 1 7 . 1 1 90 90 ASN CA C 90 54.433 54.433 54.558 -0.125 25068
3115 1 7 . 1 1 90 90 ASN CB C 90 40.182 40.182 40.157 0.025 25068
3116 1 7 . 1 1 90 90 ASN H H 90 7.741 7.741 7.882 -0.141 25068
3117 1 7 . 1 1 91 91 GLN N N 91 111.990 111.990 121.610 -9.620 25068
3118 1 7 . 1 1 91 91 GLN HA H 91 4.213 4.213 4.305 -0.092 25068
3119 1 7 . 1 1 91 91 GLN C C 91 174.970 174.970 175.723 -0.753 25068
3120 1 7 . 1 1 91 91 GLN CA C 91 57.011 57.011 55.858 1.153 25068
3121 1 7 . 1 1 91 91 GLN CB C 91 30.358 30.358 28.403 1.955 25068
3122 1 7 . 1 1 91 91 GLN H H 91 7.925 7.925 7.936 -0.011 25068
3123 1 8 . 1 1 14 14 PRO HA H 14 4.322 4.322 4.322 -0.000 25068
3124 1 8 . 1 1 14 14 PRO C C 14 176.783 176.783 177.046 -0.263 25068
3125 1 8 . 1 1 14 14 PRO CA C 14 64.643 64.643 63.417 1.226 25068
3126 1 8 . 1 1 14 14 PRO CB C 14 33.114 33.114 32.059 1.055 25068
3127 1 8 . 1 1 15 15 LEU N N 15 120.158 120.158 118.694 1.464 25068
3128 1 8 . 1 1 15 15 LEU HA H 15 4.238 4.238 4.033 0.205 25068
3129 1 8 . 1 1 15 15 LEU C C 15 176.361 176.361 175.098 1.263 25068
3130 1 8 . 1 1 15 15 LEU CA C 15 55.395 55.395 54.995 0.400 25068
3131 1 8 . 1 1 15 15 LEU CB C 15 42.619 42.619 40.918 1.701 25068
3132 1 8 . 1 1 15 15 LEU H H 15 8.189 8.189 7.927 0.262 25068
3133 1 8 . 1 1 16 16 ALA N N 16 124.269 124.269 120.031 4.238 25068
3134 1 8 . 1 1 16 16 ALA HA H 16 3.496 3.496 4.631 -1.135 25068
3135 1 8 . 1 1 16 16 ALA C C 16 175.124 175.124 175.513 -0.389 25068
3136 1 8 . 1 1 16 16 ALA CA C 16 51.457 51.457 50.617 0.840 25068
3137 1 8 . 1 1 16 16 ALA CB C 16 18.105 18.105 19.728 -1.623 25068
3138 1 8 . 1 1 16 16 ALA H H 16 7.500 7.500 7.685 -0.185 25068
3139 1 8 . 1 1 17 17 PRO HA H 17 4.157 4.157 4.266 -0.109 25068
3140 1 8 . 1 1 17 17 PRO C C 17 176.396 176.396 175.722 0.674 25068
3141 1 8 . 1 1 17 17 PRO CA C 17 63.588 63.588 62.063 1.525 25068
3142 1 8 . 1 1 17 17 PRO CB C 17 32.850 32.850 31.919 0.931 25068
3143 1 8 . 1 1 18 18 LYS N N 18 124.070 124.070 121.223 2.847 25068
3144 1 8 . 1 1 18 18 LYS HA H 18 4.147 4.147 4.385 -0.238 25068
3145 1 8 . 1 1 18 18 LYS C C 18 177.543 177.543 176.060 1.483 25068
3146 1 8 . 1 1 18 18 LYS CA C 18 57.081 57.081 56.115 0.966 25068
3147 1 8 . 1 1 18 18 LYS CB C 18 33.573 33.573 32.759 0.814 25068
3148 1 8 . 1 1 18 18 LYS H H 18 8.886 8.886 8.306 0.580 25068
3149 1 8 . 1 1 19 19 ARG N N 19 122.242 122.242 123.386 -1.144 25068
3150 1 8 . 1 1 19 19 ARG HA H 19 3.437 3.437 4.589 -1.152 25068
3151 1 8 . 1 1 19 19 ARG C C 19 175.409 175.409 174.351 1.058 25068
3152 1 8 . 1 1 19 19 ARG CA C 19 57.545 57.545 55.352 2.193 25068
3153 1 8 . 1 1 19 19 ARG CB C 19 31.149 31.149 30.744 0.405 25068
3154 1 8 . 1 1 19 19 ARG H H 19 8.286 8.286 8.304 -0.018 25068
3155 1 8 . 1 1 20 20 ALA N N 20 123.176 123.176 122.421 0.755 25068
3156 1 8 . 1 1 20 20 ALA HA H 20 4.139 4.139 4.565 -0.426 25068
3157 1 8 . 1 1 20 20 ALA C C 20 177.843 177.843 176.844 0.999 25068
3158 1 8 . 1 1 20 20 ALA CA C 20 52.391 52.391 51.341 1.050 25068
3159 1 8 . 1 1 20 20 ALA CB C 20 19.397 19.397 20.202 -0.805 25068
3160 1 8 . 1 1 20 20 ALA H H 20 7.348 7.348 8.214 -0.866 25068
3161 1 8 . 1 1 21 21 LEU N N 21 125.680 125.680 120.882 4.798 25068
3162 1 8 . 1 1 21 21 LEU HA H 21 4.194 4.194 4.022 0.172 25068
3163 1 8 . 1 1 21 21 LEU C C 21 177.091 177.091 176.432 0.659 25068
3164 1 8 . 1 1 21 21 LEU CA C 21 55.472 55.472 55.213 0.259 25068
3165 1 8 . 1 1 21 21 LEU CB C 21 43.931 43.931 42.514 1.417 25068
3166 1 8 . 1 1 21 21 LEU H H 21 9.055 9.055 8.234 0.821 25068
3167 1 8 . 1 1 22 22 SER N N 22 116.686 116.686 114.186 2.500 25068
3168 1 8 . 1 1 22 22 SER HA H 22 4.427 4.427 4.879 -0.452 25068
3169 1 8 . 1 1 22 22 SER C C 22 174.241 174.241 175.359 -1.118 25068
3170 1 8 . 1 1 22 22 SER CA C 22 57.564 57.564 56.600 0.964 25068
3171 1 8 . 1 1 22 22 SER CB C 22 66.568 66.568 65.786 0.782 25068
3172 1 8 . 1 1 22 22 SER H H 22 7.549 7.549 7.821 -0.272 25068
3173 1 8 . 1 1 23 23 ALA N N 23 123.382 123.382 124.772 -1.390 25068
3174 1 8 . 1 1 23 23 ALA HA H 23 4.163 4.163 4.288 -0.125 25068
3175 1 8 . 1 1 23 23 ALA C C 23 178.863 178.863 179.456 -0.593 25068
3176 1 8 . 1 1 23 23 ALA CA C 23 57.124 57.124 55.397 1.727 25068
3177 1 8 . 1 1 23 23 ALA CB C 23 19.441 19.441 18.448 0.993 25068
3178 1 8 . 1 1 23 23 ALA H H 23 9.035 9.035 9.048 -0.013 25068
3179 1 8 . 1 1 24 24 TYR N N 24 115.979 115.979 119.057 -3.078 25068
3180 1 8 . 1 1 24 24 TYR HA H 24 2.590 2.590 4.441 -1.851 25068
3181 1 8 . 1 1 24 24 TYR C C 24 176.257 176.257 178.543 -2.286 25068
3182 1 8 . 1 1 24 24 TYR CA C 24 60.940 60.940 61.271 -0.331 25068
3183 1 8 . 1 1 24 24 TYR CB C 24 39.106 39.106 37.648 1.458 25068
3184 1 8 . 1 1 24 24 TYR H H 24 8.206 8.206 7.709 0.497 25068
3185 1 8 . 1 1 25 25 MET N N 25 116.391 116.391 117.806 -1.415 25068
3186 1 8 . 1 1 25 25 MET HA H 25 3.643 3.643 4.013 -0.370 25068
3187 1 8 . 1 1 25 25 MET C C 25 180.177 180.177 178.280 1.897 25068
3188 1 8 . 1 1 25 25 MET CA C 25 59.161 59.161 58.491 0.670 25068
3189 1 8 . 1 1 25 25 MET CB C 25 32.748 32.748 31.928 0.820 25068
3190 1 8 . 1 1 25 25 MET H H 25 7.433 7.433 7.701 -0.268 25068
3191 1 8 . 1 1 26 26 PHE N N 26 118.699 118.699 118.991 -0.292 25068
3192 1 8 . 1 1 26 26 PHE HA H 26 4.063 4.063 4.105 -0.042 25068
3193 1 8 . 1 1 26 26 PHE C C 26 178.055 178.055 177.975 0.080 25068
3194 1 8 . 1 1 26 26 PHE CA C 26 64.840 64.840 62.157 2.683 25068
3195 1 8 . 1 1 26 26 PHE CB C 26 40.437 40.437 38.194 2.244 25068
3196 1 8 . 1 1 26 26 PHE H H 26 7.982 7.982 8.131 -0.149 25068
3197 1 8 . 1 1 27 27 TYR N N 27 123.888 123.888 119.571 4.317 25068
3198 1 8 . 1 1 27 27 TYR HA H 27 3.576 3.576 4.192 -0.616 25068
3199 1 8 . 1 1 27 27 TYR C C 27 176.691 176.691 177.776 -1.085 25068
3200 1 8 . 1 1 27 27 TYR CA C 27 62.831 62.831 62.007 0.824 25068
3201 1 8 . 1 1 27 27 TYR CB C 27 39.238 39.238 38.177 1.061 25068
3202 1 8 . 1 1 27 27 TYR H H 27 7.843 7.843 8.635 -0.792 25068
3203 1 8 . 1 1 28 28 VAL N N 28 119.501 119.501 120.425 -0.924 25068
3204 1 8 . 1 1 28 28 VAL HA H 28 2.912 2.912 3.467 -0.555 25068
3205 1 8 . 1 1 28 28 VAL C C 28 177.067 177.067 177.639 -0.572 25068
3206 1 8 . 1 1 28 28 VAL CA C 28 67.149 67.149 67.358 -0.209 25068
3207 1 8 . 1 1 28 28 VAL CB C 28 32.599 32.599 31.520 1.079 25068
3208 1 8 . 1 1 28 28 VAL H H 28 8.370 8.370 8.213 0.157 25068
3209 1 8 . 1 1 29 29 LYS N N 29 114.512 114.512 119.252 -4.740 25068
3210 1 8 . 1 1 29 29 LYS HA H 29 3.676 3.676 3.858 -0.182 25068
3211 1 8 . 1 1 29 29 LYS C C 29 178.627 178.627 178.925 -0.298 25068
3212 1 8 . 1 1 29 29 LYS CA C 29 60.349 60.349 59.801 0.548 25068
3213 1 8 . 1 1 29 29 LYS CB C 29 33.278 33.278 31.670 1.608 25068
3214 1 8 . 1 1 29 29 LYS H H 29 6.821 6.821 8.514 -1.693 25068
3215 1 8 . 1 1 30 30 ASP N N 30 116.793 116.793 121.171 -4.378 25068
3216 1 8 . 1 1 30 30 ASP HA H 30 4.466 4.466 4.411 0.055 25068
3217 1 8 . 1 1 30 30 ASP C C 30 178.615 178.615 178.458 0.157 25068
3218 1 8 . 1 1 30 30 ASP CA C 30 57.223 57.223 57.380 -0.157 25068
3219 1 8 . 1 1 30 30 ASP CB C 30 42.066 42.066 40.602 1.464 25068
3220 1 8 . 1 1 30 30 ASP H H 30 6.875 6.875 8.286 -1.411 25068
3221 1 8 . 1 1 31 31 LYS N N 31 122.423 122.423 120.299 2.124 25068
3222 1 8 . 1 1 31 31 LYS HA H 31 3.813 3.813 3.836 -0.022 25068
3223 1 8 . 1 1 31 31 LYS C C 31 178.443 178.443 178.780 -0.337 25068
3224 1 8 . 1 1 31 31 LYS CA C 31 57.494 57.494 58.648 -1.154 25068
3225 1 8 . 1 1 31 31 LYS CB C 31 32.539 32.539 32.206 0.333 25068
3226 1 8 . 1 1 31 31 LYS H H 31 8.910 8.910 7.763 1.147 25068
3227 1 8 . 1 1 32 32 ARG N N 32 117.823 117.823 119.053 -1.230 25068
3228 1 8 . 1 1 32 32 ARG HA H 32 3.540 3.540 3.954 -0.414 25068
3229 1 8 . 1 1 32 32 ARG C C 32 176.951 176.951 178.676 -1.725 25068
3230 1 8 . 1 1 32 32 ARG CA C 32 61.259 61.259 59.649 1.610 25068
3231 1 8 . 1 1 32 32 ARG CB C 32 30.668 30.668 30.191 0.477 25068
3232 1 8 . 1 1 32 32 ARG H H 32 8.501 8.501 8.165 0.336 25068
3233 1 8 . 1 1 33 33 LEU N N 33 114.878 114.878 119.612 -4.734 25068
3234 1 8 . 1 1 33 33 LEU HA H 33 3.871 3.871 3.872 -0.001 25068
3235 1 8 . 1 1 33 33 LEU C C 33 179.180 179.180 179.337 -0.157 25068
3236 1 8 . 1 1 33 33 LEU CA C 33 58.377 58.377 57.861 0.516 25068
3237 1 8 . 1 1 33 33 LEU CB C 33 42.429 42.429 41.557 0.872 25068
3238 1 8 . 1 1 33 33 LEU H H 33 6.549 6.549 8.163 -1.614 25068
3239 1 8 . 1 1 34 34 GLU N N 34 118.637 118.637 119.515 -0.878 25068
3240 1 8 . 1 1 34 34 GLU HA H 34 3.866 3.866 4.010 -0.144 25068
3241 1 8 . 1 1 34 34 GLU C C 34 178.988 178.988 179.292 -0.304 25068
3242 1 8 . 1 1 34 34 GLU CA C 34 60.248 60.248 59.527 0.721 25068
3243 1 8 . 1 1 34 34 GLU CB C 34 31.325 31.325 29.353 1.972 25068
3244 1 8 . 1 1 34 34 GLU H H 34 7.135 7.135 7.935 -0.800 25068
3245 1 8 . 1 1 35 35 ILE N N 35 119.142 119.142 120.216 -1.074 25068
3246 1 8 . 1 1 35 35 ILE HA H 35 3.693 3.693 3.715 -0.022 25068
3247 1 8 . 1 1 35 35 ILE C C 35 177.789 177.789 178.653 -0.864 25068
3248 1 8 . 1 1 35 35 ILE CA C 35 65.753 65.753 65.375 0.378 25068
3249 1 8 . 1 1 35 35 ILE CB C 35 38.940 38.940 37.995 0.945 25068
3250 1 8 . 1 1 35 35 ILE H H 35 8.076 8.076 8.042 0.034 25068
3251 1 8 . 1 1 36 36 ILE N N 36 116.296 116.296 119.180 -2.884 25068
3252 1 8 . 1 1 36 36 ILE HA H 36 3.640 3.640 4.002 -0.362 25068
3253 1 8 . 1 1 36 36 ILE C C 36 177.270 177.270 177.747 -0.477 25068
3254 1 8 . 1 1 36 36 ILE CA C 36 64.633 64.633 64.102 0.531 25068
3255 1 8 . 1 1 36 36 ILE CB C 36 38.718 38.718 37.772 0.946 25068
3256 1 8 . 1 1 36 36 ILE H H 36 7.754 7.754 7.982 -0.228 25068
3257 1 8 . 1 1 37 37 LYS N N 37 119.626 119.626 120.304 -0.678 25068
3258 1 8 . 1 1 37 37 LYS HA H 37 3.922 3.922 4.099 -0.177 25068
3259 1 8 . 1 1 37 37 LYS C C 37 178.129 178.129 178.314 -0.185 25068
3260 1 8 . 1 1 37 37 LYS CA C 37 59.996 59.996 58.891 1.105 25068
3261 1 8 . 1 1 37 37 LYS CB C 37 33.487 33.487 32.625 0.862 25068
3262 1 8 . 1 1 37 37 LYS H H 37 7.413 7.413 7.895 -0.482 25068
3263 1 8 . 1 1 38 38 GLU N N 38 116.708 116.708 116.372 0.336 25068
3264 1 8 . 1 1 38 38 GLU HA H 38 4.060 4.060 4.236 -0.176 25068
3265 1 8 . 1 1 38 38 GLU C C 38 177.004 177.004 177.149 -0.145 25068
3266 1 8 . 1 1 38 38 GLU CA C 38 59.070 59.070 57.733 1.337 25068
3267 1 8 . 1 1 38 38 GLU CB C 38 31.665 31.665 30.477 1.188 25068
3268 1 8 . 1 1 38 38 GLU H H 38 7.354 7.354 7.954 -0.600 25068
3269 1 8 . 1 1 39 39 LYS N N 39 118.621 118.621 119.390 -0.769 25068
3270 1 8 . 1 1 39 39 LYS HA H 39 4.690 4.690 4.746 -0.056 25068
3271 1 8 . 1 1 39 39 LYS C C 39 172.792 172.792 174.598 -1.806 25068
3272 1 8 . 1 1 39 39 LYS CA C 39 54.596 54.596 53.277 1.319 25068
3273 1 8 . 1 1 39 39 LYS CB C 39 33.945 33.945 33.587 0.358 25068
3274 1 8 . 1 1 39 39 LYS H H 39 8.176 8.176 7.741 0.435 25068
3275 1 8 . 1 1 40 40 PRO HA H 40 4.429 4.429 4.439 -0.010 25068
3276 1 8 . 1 1 40 40 PRO C C 40 179.829 179.829 178.010 1.819 25068
3277 1 8 . 1 1 40 40 PRO CA C 40 66.040 66.040 64.568 1.472 25068
3278 1 8 . 1 1 40 40 PRO CB C 40 32.606 32.606 31.837 0.769 25068
3279 1 8 . 1 1 41 41 GLU N N 41 119.150 119.150 120.093 -0.943 25068
3280 1 8 . 1 1 41 41 GLU HA H 41 4.143 4.143 4.228 -0.085 25068
3281 1 8 . 1 1 41 41 GLU C C 41 178.502 178.502 177.726 0.776 25068
3282 1 8 . 1 1 41 41 GLU CA C 41 59.485 59.485 58.589 0.896 25068
3283 1 8 . 1 1 41 41 GLU CB C 41 28.574 28.574 29.391 -0.817 25068
3284 1 8 . 1 1 41 41 GLU H H 41 9.789 9.789 8.722 1.067 25068
3285 1 8 . 1 1 42 42 LEU N N 42 121.443 121.443 120.064 1.379 25068
3286 1 8 . 1 1 42 42 LEU HA H 42 4.185 4.185 4.680 -0.495 25068
3287 1 8 . 1 1 42 42 LEU C C 42 177.815 177.815 177.553 0.262 25068
3288 1 8 . 1 1 42 42 LEU CA C 42 56.730 56.730 54.412 2.318 25068
3289 1 8 . 1 1 42 42 LEU CB C 42 42.013 42.013 41.848 0.165 25068
3290 1 8 . 1 1 42 42 LEU H H 42 8.312 8.312 7.624 0.688 25068
3291 1 8 . 1 1 43 43 ALA N N 43 119.949 119.949 122.003 -2.054 25068
3292 1 8 . 1 1 43 43 ALA HA H 43 3.746 3.746 3.994 -0.248 25068
3293 1 8 . 1 1 43 43 ALA C C 43 178.635 178.635 177.650 0.985 25068
3294 1 8 . 1 1 43 43 ALA CA C 43 56.164 56.164 54.314 1.850 25068
3295 1 8 . 1 1 43 43 ALA CB C 43 19.670 19.670 18.587 1.083 25068
3296 1 8 . 1 1 43 43 ALA H H 43 7.554 7.554 7.329 0.225 25068
3297 1 8 . 1 1 44 44 LYS N N 44 112.690 112.690 115.856 -3.166 25068
3298 1 8 . 1 1 44 44 LYS HA H 44 4.232 4.232 4.356 -0.124 25068
3299 1 8 . 1 1 44 44 LYS C C 44 175.949 175.949 175.803 0.146 25068
3300 1 8 . 1 1 44 44 LYS CA C 44 56.987 56.987 55.704 1.283 25068
3301 1 8 . 1 1 44 44 LYS CB C 44 33.345 33.345 32.026 1.319 25068
3302 1 8 . 1 1 44 44 LYS H H 44 7.560 7.560 7.873 -0.313 25068
3303 1 8 . 1 1 45 45 ASP N N 45 122.529 122.529 121.540 0.989 25068
3304 1 8 . 1 1 45 45 ASP HA H 45 4.749 4.749 4.947 -0.198 25068
3305 1 8 . 1 1 45 45 ASP C C 45 174.677 174.677 175.976 -1.299 25068
3306 1 8 . 1 1 45 45 ASP CA C 45 53.030 53.030 53.417 -0.387 25068
3307 1 8 . 1 1 45 45 ASP CB C 45 41.549 41.549 40.332 1.217 25068
3308 1 8 . 1 1 45 45 ASP H H 45 7.672 7.672 8.001 -0.329 25068
3309 1 8 . 1 1 46 46 VAL N N 46 121.529 121.529 122.026 -0.497 25068
3310 1 8 . 1 1 46 46 VAL HA H 46 3.639 3.639 3.553 0.086 25068
3311 1 8 . 1 1 46 46 VAL C C 46 179.102 179.102 177.505 1.597 25068
3312 1 8 . 1 1 46 46 VAL CA C 46 66.430 66.430 67.134 -0.704 25068
3313 1 8 . 1 1 46 46 VAL CB C 46 32.650 32.650 31.955 0.695 25068
3314 1 8 . 1 1 46 46 VAL H H 46 7.808 7.808 8.144 -0.336 25068
3315 1 8 . 1 1 47 47 ALA N N 47 123.933 123.933 120.292 3.641 25068
3316 1 8 . 1 1 47 47 ALA HA H 47 4.112 4.112 3.955 0.157 25068
3317 1 8 . 1 1 47 47 ALA C C 47 180.665 180.665 179.671 0.994 25068
3318 1 8 . 1 1 47 47 ALA CA C 47 55.822 55.822 55.085 0.737 25068
3319 1 8 . 1 1 47 47 ALA CB C 47 19.129 19.129 18.123 1.006 25068
3320 1 8 . 1 1 47 47 ALA H H 47 8.505 8.505 8.147 0.358 25068
3321 1 8 . 1 1 48 48 GLN N N 48 120.047 120.047 118.749 1.298 25068
3322 1 8 . 1 1 48 48 GLN HA H 48 4.033 4.033 4.103 -0.070 25068
3323 1 8 . 1 1 48 48 GLN C C 48 178.486 178.486 178.189 0.297 25068
3324 1 8 . 1 1 48 48 GLN CA C 48 59.436 59.436 58.289 1.147 25068
3325 1 8 . 1 1 48 48 GLN CB C 48 29.436 29.436 28.168 1.268 25068
3326 1 8 . 1 1 48 48 GLN H H 48 7.852 7.852 7.608 0.244 25068
3327 1 8 . 1 1 49 49 VAL N N 49 119.185 119.185 117.051 2.134 25068
3328 1 8 . 1 1 49 49 VAL HA H 49 3.424 3.424 3.582 -0.158 25068
3329 1 8 . 1 1 49 49 VAL C C 49 177.519 177.519 177.992 -0.473 25068
3330 1 8 . 1 1 49 49 VAL CA C 49 68.854 68.854 66.577 2.277 25068
3331 1 8 . 1 1 49 49 VAL CB C 49 32.454 32.454 31.049 1.405 25068
3332 1 8 . 1 1 49 49 VAL H H 49 7.984 7.984 7.956 0.028 25068
3333 1 8 . 1 1 50 50 GLY N N 50 104.919 104.919 107.803 -2.884 25068
3334 1 8 . 1 1 50 50 GLY C C 50 176.825 176.825 175.968 0.857 25068
3335 1 8 . 1 1 50 50 GLY CA C 50 48.398 48.398 47.366 1.032 25068
3336 1 8 . 1 1 50 50 GLY H H 50 8.020 8.020 8.360 -0.340 25068
3337 1 8 . 1 1 51 51 LYS N N 51 123.422 123.422 122.551 0.871 25068
3338 1 8 . 1 1 51 51 LYS HA H 51 4.032 4.032 4.079 -0.047 25068
3339 1 8 . 1 1 51 51 LYS C C 51 179.332 179.332 179.235 0.097 25068
3340 1 8 . 1 1 51 51 LYS CA C 51 60.246 60.246 58.727 1.519 25068
3341 1 8 . 1 1 51 51 LYS CB C 51 33.626 33.626 31.956 1.670 25068
3342 1 8 . 1 1 51 51 LYS H H 51 7.699 7.699 7.917 -0.218 25068
3343 1 8 . 1 1 52 52 LEU N N 52 120.442 120.442 120.629 -0.187 25068
3344 1 8 . 1 1 52 52 LEU HA H 52 4.041 4.041 4.027 0.014 25068
3345 1 8 . 1 1 52 52 LEU C C 52 180.984 180.984 179.104 1.880 25068
3346 1 8 . 1 1 52 52 LEU CA C 52 58.855 58.855 57.921 0.934 25068
3347 1 8 . 1 1 52 52 LEU CB C 52 43.046 43.046 41.656 1.390 25068
3348 1 8 . 1 1 52 52 LEU H H 52 8.088 8.088 7.887 0.201 25068
3349 1 8 . 1 1 53 53 ILE N N 53 121.249 121.249 119.697 1.552 25068
3350 1 8 . 1 1 53 53 ILE HA H 53 3.557 3.557 3.820 -0.263 25068
3351 1 8 . 1 1 53 53 ILE C C 53 177.945 177.945 178.751 -0.806 25068
3352 1 8 . 1 1 53 53 ILE CA C 53 67.431 67.431 62.880 4.551 25068
3353 1 8 . 1 1 53 53 ILE CB C 53 38.887 38.887 36.059 2.828 25068
3354 1 8 . 1 1 53 53 ILE H H 53 8.475 8.475 8.116 0.359 25068
3355 1 8 . 1 1 54 54 GLY N N 54 107.755 107.755 108.117 -0.362 25068
3356 1 8 . 1 1 54 54 GLY C C 54 177.691 177.691 176.441 1.250 25068
3357 1 8 . 1 1 54 54 GLY CA C 54 48.997 48.997 47.587 1.410 25068
3358 1 8 . 1 1 54 54 GLY H H 54 8.130 8.130 8.505 -0.375 25068
3359 1 8 . 1 1 55 55 GLU N N 55 122.138 122.138 122.567 -0.429 25068
3360 1 8 . 1 1 55 55 GLU HA H 55 4.032 4.032 3.966 0.066 25068
3361 1 8 . 1 1 55 55 GLU C C 55 179.146 179.146 179.097 0.049 25068
3362 1 8 . 1 1 55 55 GLU CA C 55 59.958 59.958 59.352 0.606 25068
3363 1 8 . 1 1 55 55 GLU CB C 55 30.551 30.551 29.456 1.095 25068
3364 1 8 . 1 1 55 55 GLU H H 55 8.089 8.089 8.183 -0.094 25068
3365 1 8 . 1 1 56 56 ALA N N 56 122.985 122.985 122.099 0.886 25068
3366 1 8 . 1 1 56 56 ALA HA H 56 4.107 4.107 4.078 0.029 25068
3367 1 8 . 1 1 56 56 ALA C C 56 181.177 181.177 178.525 2.652 25068
3368 1 8 . 1 1 56 56 ALA CA C 56 56.414 56.414 55.193 1.222 25068
3369 1 8 . 1 1 56 56 ALA CB C 56 19.948 19.948 18.587 1.361 25068
3370 1 8 . 1 1 56 56 ALA H H 56 7.947 7.947 8.319 -0.372 25068
3371 1 8 . 1 1 57 57 TRP N N 57 120.485 120.485 119.430 1.055 25068
3372 1 8 . 1 1 57 57 TRP HA H 57 3.940 3.940 4.138 -0.198 25068
3373 1 8 . 1 1 57 57 TRP C C 57 178.537 178.537 179.069 -0.532 25068
3374 1 8 . 1 1 57 57 TRP CA C 57 60.633 60.633 58.939 1.694 25068
3375 1 8 . 1 1 57 57 TRP CB C 57 31.681 31.681 29.373 2.308 25068
3376 1 8 . 1 1 57 57 TRP H H 57 8.910 8.910 8.128 0.782 25068
3377 1 8 . 1 1 58 58 GLY N N 58 102.004 102.004 106.278 -4.274 25068
3378 1 8 . 1 1 58 58 GLY C C 58 174.723 174.723 175.108 -0.385 25068
3379 1 8 . 1 1 58 58 GLY CA C 58 47.091 47.091 46.201 0.890 25068
3380 1 8 . 1 1 58 58 GLY H H 58 7.668 7.668 7.995 -0.327 25068
3381 1 8 . 1 1 59 59 GLN N N 59 116.202 116.202 117.126 -0.924 25068
3382 1 8 . 1 1 59 59 GLN HA H 59 4.259 4.259 4.290 -0.031 25068
3383 1 8 . 1 1 59 59 GLN C C 59 176.221 176.221 175.966 0.255 25068
3384 1 8 . 1 1 59 59 GLN CA C 59 55.967 55.967 54.395 1.572 25068
3385 1 8 . 1 1 59 59 GLN CB C 59 30.741 30.741 29.094 1.647 25068
3386 1 8 . 1 1 59 59 GLN H H 59 7.189 7.189 7.724 -0.535 25068
3387 1 8 . 1 1 60 60 LEU N N 60 120.776 120.776 122.473 -1.697 25068
3388 1 8 . 1 1 60 60 LEU HA H 60 4.185 4.185 4.212 -0.027 25068
3389 1 8 . 1 1 60 60 LEU C C 60 177.372 177.372 176.701 0.671 25068
3390 1 8 . 1 1 60 60 LEU CA C 60 56.061 56.061 55.703 0.358 25068
3391 1 8 . 1 1 60 60 LEU CB C 60 43.696 43.696 42.515 1.181 25068
3392 1 8 . 1 1 60 60 LEU H H 60 6.968 6.968 7.503 -0.535 25068
3393 1 8 . 1 1 61 61 SER N N 61 120.432 120.432 119.856 0.576 25068
3394 1 8 . 1 1 61 61 SER HA H 61 4.582 4.582 4.498 0.084 25068
3395 1 8 . 1 1 61 61 SER C C 61 173.500 173.500 174.292 -0.792 25068
3396 1 8 . 1 1 61 61 SER CA C 61 57.204 57.204 57.775 -0.571 25068
3397 1 8 . 1 1 61 61 SER CB C 61 63.980 63.980 63.346 0.634 25068
3398 1 8 . 1 1 61 61 SER H H 61 8.885 8.885 8.313 0.572 25068
3399 1 8 . 1 1 63 63 ALA HA H 63 4.089 4.089 4.162 -0.073 25068
3400 1 8 . 1 1 63 63 ALA C C 63 180.570 180.570 179.171 1.399 25068
3401 1 8 . 1 1 63 63 ALA CA C 63 56.005 56.005 54.645 1.360 25068
3402 1 8 . 1 1 63 63 ALA CB C 63 19.317 19.317 18.001 1.316 25068
3403 1 8 . 1 1 64 64 GLN N N 64 116.774 116.774 116.028 0.746 25068
3404 1 8 . 1 1 64 64 GLN HA H 64 4.122 4.122 4.286 -0.164 25068
3405 1 8 . 1 1 64 64 GLN C C 64 178.275 178.275 178.248 0.027 25068
3406 1 8 . 1 1 64 64 GLN CA C 64 58.622 58.622 57.663 0.959 25068
3407 1 8 . 1 1 64 64 GLN CB C 64 31.350 31.350 28.651 2.699 25068
3408 1 8 . 1 1 64 64 GLN H H 64 7.603 7.603 8.175 -0.572 25068
3409 1 8 . 1 1 65 65 LYS N N 65 117.203 117.203 120.366 -3.163 25068
3410 1 8 . 1 1 65 65 LYS HA H 65 4.129 4.129 4.213 -0.084 25068
3411 1 8 . 1 1 65 65 LYS C C 65 178.449 178.449 178.848 -0.399 25068
3412 1 8 . 1 1 65 65 LYS CA C 65 59.891 59.891 58.618 1.273 25068
3413 1 8 . 1 1 65 65 LYS CB C 65 34.351 34.351 32.072 2.280 25068
3414 1 8 . 1 1 65 65 LYS H H 65 7.810 7.810 7.885 -0.075 25068
3415 1 8 . 1 1 66 66 ALA N N 66 122.218 122.218 122.393 -0.175 25068
3416 1 8 . 1 1 66 66 ALA HA H 66 4.290 4.290 4.219 0.071 25068
3417 1 8 . 1 1 66 66 ALA C C 66 176.135 176.135 176.687 -0.552 25068
3418 1 8 . 1 1 66 66 ALA CA C 66 57.745 57.745 56.992 0.752 25068
3419 1 8 . 1 1 66 66 ALA CB C 66 17.033 17.033 16.394 0.639 25068
3420 1 8 . 1 1 66 66 ALA H H 66 7.469 7.469 8.399 -0.930 25068
3421 1 8 . 1 1 67 67 PRO HA H 67 4.142 4.142 4.322 -0.180 25068
3422 1 8 . 1 1 67 67 PRO C C 67 179.591 179.591 178.686 0.905 25068
3423 1 8 . 1 1 67 67 PRO CA C 67 66.960 66.960 65.625 1.335 25068
3424 1 8 . 1 1 67 67 PRO CB C 67 32.014 32.014 31.426 0.588 25068
3425 1 8 . 1 1 68 68 TYR N N 68 117.140 117.140 120.464 -3.324 25068
3426 1 8 . 1 1 68 68 TYR HA H 68 3.940 3.940 4.011 -0.071 25068
3427 1 8 . 1 1 68 68 TYR C C 68 177.733 177.733 177.742 -0.009 25068
3428 1 8 . 1 1 68 68 TYR CA C 68 63.505 63.505 62.101 1.404 25068
3429 1 8 . 1 1 68 68 TYR CB C 68 38.503 38.503 38.356 0.147 25068
3430 1 8 . 1 1 68 68 TYR H H 68 7.268 7.268 8.464 -1.196 25068
3431 1 8 . 1 1 69 69 GLU N N 69 120.747 120.747 118.238 2.509 25068
3432 1 8 . 1 1 69 69 GLU HA H 69 4.253 4.253 4.077 0.176 25068
3433 1 8 . 1 1 69 69 GLU C C 69 179.805 179.805 179.199 0.606 25068
3434 1 8 . 1 1 69 69 GLU CA C 69 60.145 60.145 59.238 0.907 25068
3435 1 8 . 1 1 69 69 GLU CB C 69 29.808 29.808 29.264 0.544 25068
3436 1 8 . 1 1 69 69 GLU H H 69 8.048 8.048 8.576 -0.528 25068
3437 1 8 . 1 1 70 70 LYS N N 70 120.938 120.938 119.509 1.429 25068
3438 1 8 . 1 1 70 70 LYS HA H 70 4.020 4.020 4.003 0.017 25068
3439 1 8 . 1 1 70 70 LYS C C 70 178.740 178.740 179.218 -0.478 25068
3440 1 8 . 1 1 70 70 LYS CA C 70 60.202 60.202 59.617 0.585 25068
3441 1 8 . 1 1 70 70 LYS CB C 70 32.419 32.419 32.186 0.233 25068
3442 1 8 . 1 1 70 70 LYS H H 70 8.301 8.301 8.212 0.089 25068
3443 1 8 . 1 1 71 71 LYS N N 71 118.427 118.427 118.505 -0.078 25068
3444 1 8 . 1 1 71 71 LYS HA H 71 3.528 3.528 4.105 -0.577 25068
3445 1 8 . 1 1 71 71 LYS C C 71 179.280 179.280 178.854 0.426 25068
3446 1 8 . 1 1 71 71 LYS CA C 71 61.146 61.146 58.893 2.253 25068
3447 1 8 . 1 1 71 71 LYS CB C 71 32.196 32.196 32.183 0.013 25068
3448 1 8 . 1 1 71 71 LYS H H 71 7.234 7.234 8.344 -1.110 25068
3449 1 8 . 1 1 72 72 ALA N N 72 122.126 122.126 122.850 -0.724 25068
3450 1 8 . 1 1 72 72 ALA HA H 72 4.357 4.357 3.871 0.486 25068
3451 1 8 . 1 1 72 72 ALA C C 72 180.468 180.468 179.706 0.762 25068
3452 1 8 . 1 1 72 72 ALA CA C 72 56.457 56.457 55.340 1.117 25068
3453 1 8 . 1 1 72 72 ALA CB C 72 19.562 19.562 17.867 1.695 25068
3454 1 8 . 1 1 72 72 ALA H H 72 7.890 7.890 7.978 -0.088 25068
3455 1 8 . 1 1 73 73 GLN N N 73 121.659 121.659 119.009 2.650 25068
3456 1 8 . 1 1 73 73 GLN HA H 73 4.029 4.029 4.036 -0.007 25068
3457 1 8 . 1 1 73 73 GLN C C 73 179.576 179.576 178.231 1.345 25068
3458 1 8 . 1 1 73 73 GLN CA C 73 60.427 60.427 58.790 1.637 25068
3459 1 8 . 1 1 73 73 GLN CB C 73 28.732 28.732 28.720 0.012 25068
3460 1 8 . 1 1 73 73 GLN H H 73 8.353 8.353 8.185 0.168 25068
3461 1 8 . 1 1 74 74 LEU N N 74 119.752 119.752 121.090 -1.338 25068
3462 1 8 . 1 1 74 74 LEU HA H 74 4.046 4.046 3.891 0.155 25068
3463 1 8 . 1 1 74 74 LEU C C 74 180.424 180.424 179.366 1.058 25068
3464 1 8 . 1 1 74 74 LEU CA C 74 58.675 58.675 58.620 0.055 25068
3465 1 8 . 1 1 74 74 LEU CB C 74 42.376 42.376 41.612 0.764 25068
3466 1 8 . 1 1 74 74 LEU H H 74 8.160 8.160 8.263 -0.103 25068
3467 1 8 . 1 1 75 75 ASP N N 75 122.159 122.159 118.938 3.221 25068
3468 1 8 . 1 1 75 75 ASP HA H 75 4.988 4.988 4.379 0.609 25068
3469 1 8 . 1 1 75 75 ASP C C 75 178.046 178.046 178.724 -0.678 25068
3470 1 8 . 1 1 75 75 ASP CA C 75 58.191 58.191 57.575 0.616 25068
3471 1 8 . 1 1 75 75 ASP CB C 75 42.958 42.958 40.239 2.719 25068
3472 1 8 . 1 1 75 75 ASP H H 75 8.361 8.361 8.617 -0.256 25068
3473 1 8 . 1 1 76 76 LYS N N 76 119.861 119.861 121.033 -1.172 25068
3474 1 8 . 1 1 76 76 LYS HA H 76 3.988 3.988 4.095 -0.107 25068
3475 1 8 . 1 1 76 76 LYS C C 76 179.668 179.668 179.137 0.531 25068
3476 1 8 . 1 1 76 76 LYS CA C 76 60.984 60.984 59.202 1.782 25068
3477 1 8 . 1 1 76 76 LYS CB C 76 33.124 33.124 32.356 0.768 25068
3478 1 8 . 1 1 76 76 LYS H H 76 7.940 7.940 7.704 0.236 25068
3479 1 8 . 1 1 77 77 VAL N N 77 121.485 121.485 119.070 2.415 25068
3480 1 8 . 1 1 77 77 VAL HA H 77 3.687 3.687 3.607 0.080 25068
3481 1 8 . 1 1 77 77 VAL C C 77 178.070 178.070 177.758 0.312 25068
3482 1 8 . 1 1 77 77 VAL CA C 77 67.359 67.359 67.284 0.075 25068
3483 1 8 . 1 1 77 77 VAL CB C 77 32.645 32.645 31.808 0.837 25068
3484 1 8 . 1 1 77 77 VAL H H 77 7.401 7.401 8.375 -0.974 25068
3485 1 8 . 1 1 78 78 ARG N N 78 121.960 121.960 119.899 2.061 25068
3486 1 8 . 1 1 78 78 ARG HA H 78 4.010 4.010 3.942 0.068 25068
3487 1 8 . 1 1 78 78 ARG C C 78 179.144 179.144 178.809 0.335 25068
3488 1 8 . 1 1 78 78 ARG CA C 78 60.598 60.598 59.857 0.741 25068
3489 1 8 . 1 1 78 78 ARG CB C 78 28.352 28.352 30.028 -1.676 25068
3490 1 8 . 1 1 78 78 ARG H H 78 7.813 7.813 8.113 -0.300 25068
3491 1 8 . 1 1 79 79 TYR N N 79 120.411 120.411 121.060 -0.649 25068
3492 1 8 . 1 1 79 79 TYR HA H 79 3.878 3.878 4.539 -0.661 25068
3493 1 8 . 1 1 79 79 TYR C C 79 176.080 176.080 177.740 -1.660 25068
3494 1 8 . 1 1 79 79 TYR CA C 79 63.669 63.669 59.363 4.306 25068
3495 1 8 . 1 1 79 79 TYR CB C 79 39.758 39.758 38.230 1.528 25068
3496 1 8 . 1 1 79 79 TYR H H 79 8.608 8.608 8.649 -0.041 25068
3497 1 8 . 1 1 80 80 SER N N 80 113.726 113.726 114.087 -0.361 25068
3498 1 8 . 1 1 80 80 SER HA H 80 3.880 3.880 3.735 0.145 25068
3499 1 8 . 1 1 80 80 SER C C 80 176.794 176.794 176.928 -0.134 25068
3500 1 8 . 1 1 80 80 SER CA C 80 62.969 62.969 62.030 0.939 25068
3501 1 8 . 1 1 80 80 SER CB C 80 63.605 63.605 62.906 0.699 25068
3502 1 8 . 1 1 80 80 SER H H 80 8.234 8.234 8.043 0.191 25068
3503 1 8 . 1 1 81 81 LYS N N 81 121.920 121.920 120.318 1.602 25068
3504 1 8 . 1 1 81 81 LYS HA H 81 4.029 4.029 4.239 -0.210 25068
3505 1 8 . 1 1 81 81 LYS C C 81 179.342 179.342 179.280 0.062 25068
3506 1 8 . 1 1 81 81 LYS CA C 81 60.138 60.138 59.185 0.953 25068
3507 1 8 . 1 1 81 81 LYS CB C 81 33.238 33.238 32.169 1.069 25068
3508 1 8 . 1 1 81 81 LYS H H 81 7.958 7.958 8.196 -0.238 25068
3509 1 8 . 1 1 82 82 GLU N N 82 119.515 119.515 120.036 -0.521 25068
3510 1 8 . 1 1 82 82 GLU HA H 82 3.945 3.945 4.050 -0.105 25068
3511 1 8 . 1 1 82 82 GLU C C 82 180.689 180.689 179.048 1.641 25068
3512 1 8 . 1 1 82 82 GLU CA C 82 60.920 60.920 59.481 1.439 25068
3513 1 8 . 1 1 82 82 GLU CB C 82 30.885 30.885 29.568 1.317 25068
3514 1 8 . 1 1 82 82 GLU H H 82 8.310 8.310 7.896 0.414 25068
3515 1 8 . 1 1 83 83 ILE N N 83 121.362 121.362 120.005 1.357 25068
3516 1 8 . 1 1 83 83 ILE HA H 83 3.889 3.889 3.663 0.226 25068
3517 1 8 . 1 1 83 83 ILE C C 83 177.207 177.207 177.642 -0.435 25068
3518 1 8 . 1 1 83 83 ILE CA C 83 62.754 62.754 63.688 -0.934 25068
3519 1 8 . 1 1 83 83 ILE CB C 83 37.651 37.651 37.798 -0.147 25068
3520 1 8 . 1 1 83 83 ILE H H 83 8.887 8.887 8.024 0.863 25068
3521 1 8 . 1 1 84 84 GLU N N 84 122.327 122.327 120.363 1.964 25068
3522 1 8 . 1 1 84 84 GLU HA H 84 4.028 4.028 3.865 0.163 25068
3523 1 8 . 1 1 84 84 GLU C C 84 179.047 179.047 179.083 -0.036 25068
3524 1 8 . 1 1 84 84 GLU CA C 84 60.045 60.045 60.175 -0.130 25068
3525 1 8 . 1 1 84 84 GLU CB C 84 30.099 30.099 29.352 0.747 25068
3526 1 8 . 1 1 84 84 GLU H H 84 7.289 7.289 8.153 -0.864 25068
3527 1 8 . 1 1 85 85 GLU N N 85 118.046 118.046 119.082 -1.036 25068
3528 1 8 . 1 1 85 85 GLU HA H 85 3.966 3.966 4.071 -0.105 25068
3529 1 8 . 1 1 85 85 GLU C C 85 178.614 178.614 179.341 -0.727 25068
3530 1 8 . 1 1 85 85 GLU CA C 85 59.997 59.997 59.120 0.878 25068
3531 1 8 . 1 1 85 85 GLU CB C 85 30.453 30.453 29.395 1.058 25068
3532 1 8 . 1 1 85 85 GLU H H 85 7.545 7.545 8.129 -0.584 25068
3533 1 8 . 1 1 86 86 TYR N N 86 121.050 121.050 119.241 1.809 25068
3534 1 8 . 1 1 86 86 TYR HA H 86 4.094 4.094 4.217 -0.123 25068
3535 1 8 . 1 1 86 86 TYR C C 86 177.815 177.815 177.127 0.688 25068
3536 1 8 . 1 1 86 86 TYR CA C 86 62.072 62.072 61.983 0.089 25068
3537 1 8 . 1 1 86 86 TYR CB C 86 39.954 39.954 38.342 1.612 25068
3538 1 8 . 1 1 86 86 TYR H H 86 8.277 8.277 8.290 -0.013 25068
3539 1 8 . 1 1 87 87 ARG N N 87 118.353 118.353 117.589 0.764 25068
3540 1 8 . 1 1 87 87 ARG HA H 87 3.877 3.877 3.937 -0.060 25068
3541 1 8 . 1 1 87 87 ARG C C 87 178.067 178.067 179.202 -1.135 25068
3542 1 8 . 1 1 87 87 ARG CA C 87 59.513 59.513 58.833 0.680 25068
3543 1 8 . 1 1 87 87 ARG CB C 87 31.053 31.053 30.362 0.691 25068
3544 1 8 . 1 1 87 87 ARG H H 87 8.249 8.249 8.303 -0.054 25068
3545 1 8 . 1 1 88 88 LYS N N 88 118.205 118.205 118.215 -0.010 25068
3546 1 8 . 1 1 88 88 LYS HA H 88 3.982 3.982 4.098 -0.116 25068
3547 1 8 . 1 1 88 88 LYS C C 88 178.050 178.050 178.028 0.022 25068
3548 1 8 . 1 1 88 88 LYS CA C 88 59.265 59.265 58.575 0.690 25068
3549 1 8 . 1 1 88 88 LYS CB C 88 33.499 33.499 32.540 0.959 25068
3550 1 8 . 1 1 88 88 LYS H H 88 7.465 7.465 7.845 -0.380 25068
3551 1 8 . 1 1 89 89 LYS N N 89 118.341 118.341 113.864 4.477 25068
3552 1 8 . 1 1 89 89 LYS HA H 89 4.084 4.084 4.450 -0.366 25068
3553 1 8 . 1 1 89 89 LYS C C 89 176.691 176.691 176.110 0.581 25068
3554 1 8 . 1 1 89 89 LYS CA C 89 58.188 58.188 55.773 2.415 25068
3555 1 8 . 1 1 89 89 LYS CB C 89 33.809 33.809 31.997 1.812 25068
3556 1 8 . 1 1 89 89 LYS H H 89 7.580 7.580 7.749 -0.169 25068
3557 1 8 . 1 1 90 90 ASN N N 90 117.604 117.604 118.692 -1.088 25068
3558 1 8 . 1 1 90 90 ASN HA H 90 4.563 4.563 4.845 -0.282 25068
3559 1 8 . 1 1 90 90 ASN C C 90 174.419 174.419 174.210 0.209 25068
3560 1 8 . 1 1 90 90 ASN CA C 90 54.433 54.433 53.236 1.197 25068
3561 1 8 . 1 1 90 90 ASN CB C 90 40.182 40.182 39.431 0.751 25068
3562 1 8 . 1 1 90 90 ASN H H 90 7.741 7.741 7.760 -0.019 25068
3563 1 8 . 1 1 91 91 GLN N N 91 111.990 111.990 118.914 -6.924 25068
3564 1 8 . 1 1 91 91 GLN HA H 91 4.213 4.213 4.538 -0.325 25068
3565 1 8 . 1 1 91 91 GLN C C 91 174.970 174.970 175.664 -0.694 25068
3566 1 8 . 1 1 91 91 GLN CA C 91 57.011 57.011 54.905 2.106 25068
3567 1 8 . 1 1 91 91 GLN CB C 91 30.358 30.358 29.883 0.475 25068
3568 1 8 . 1 1 91 91 GLN H H 91 7.925 7.925 7.809 0.116 25068
3569 1 9 . 1 1 14 14 PRO HA H 14 4.322 4.322 4.387 -0.065 25068
3570 1 9 . 1 1 14 14 PRO C C 14 176.783 176.783 176.896 -0.113 25068
3571 1 9 . 1 1 14 14 PRO CA C 14 64.643 64.643 64.113 0.530 25068
3572 1 9 . 1 1 14 14 PRO CB C 14 33.114 33.114 31.910 1.204 25068
3573 1 9 . 1 1 15 15 LEU N N 15 120.158 120.158 114.735 5.423 25068
3574 1 9 . 1 1 15 15 LEU HA H 15 4.238 4.238 4.524 -0.286 25068
3575 1 9 . 1 1 15 15 LEU C C 15 176.361 176.361 176.785 -0.424 25068
3576 1 9 . 1 1 15 15 LEU CA C 15 55.395 55.395 54.362 1.033 25068
3577 1 9 . 1 1 15 15 LEU CB C 15 42.619 42.619 41.403 1.216 25068
3578 1 9 . 1 1 15 15 LEU H H 15 8.189 8.189 7.357 0.832 25068
3579 1 9 . 1 1 16 16 ALA N N 16 124.269 124.269 122.787 1.482 25068
3580 1 9 . 1 1 16 16 ALA HA H 16 3.496 3.496 4.644 -1.148 25068
3581 1 9 . 1 1 16 16 ALA C C 16 175.124 175.124 175.689 -0.565 25068
3582 1 9 . 1 1 16 16 ALA CA C 16 51.457 51.457 50.282 1.175 25068
3583 1 9 . 1 1 16 16 ALA CB C 16 18.105 18.105 18.883 -0.778 25068
3584 1 9 . 1 1 16 16 ALA H H 16 7.500 7.500 7.350 0.150 25068
3585 1 9 . 1 1 17 17 PRO HA H 17 4.157 4.157 4.416 -0.259 25068
3586 1 9 . 1 1 17 17 PRO C C 17 176.396 176.396 175.830 0.566 25068
3587 1 9 . 1 1 17 17 PRO CA C 17 63.588 63.588 62.717 0.871 25068
3588 1 9 . 1 1 17 17 PRO CB C 17 32.850 32.850 32.044 0.806 25068
3589 1 9 . 1 1 18 18 LYS N N 18 124.070 124.070 123.156 0.914 25068
3590 1 9 . 1 1 18 18 LYS HA H 18 4.147 4.147 4.497 -0.350 25068
3591 1 9 . 1 1 18 18 LYS C C 18 177.543 177.543 175.656 1.887 25068
3592 1 9 . 1 1 18 18 LYS CA C 18 57.081 57.081 56.069 1.012 25068
3593 1 9 . 1 1 18 18 LYS CB C 18 33.573 33.573 33.734 -0.161 25068
3594 1 9 . 1 1 18 18 LYS H H 18 8.886 8.886 8.370 0.516 25068
3595 1 9 . 1 1 19 19 ARG N N 19 122.242 122.242 121.820 0.422 25068
3596 1 9 . 1 1 19 19 ARG HA H 19 3.437 3.437 4.374 -0.937 25068
3597 1 9 . 1 1 19 19 ARG C C 19 175.409 175.409 174.483 0.926 25068
3598 1 9 . 1 1 19 19 ARG CA C 19 57.545 57.545 55.376 2.169 25068
3599 1 9 . 1 1 19 19 ARG CB C 19 31.149 31.149 30.236 0.913 25068
3600 1 9 . 1 1 19 19 ARG H H 19 8.286 8.286 8.302 -0.016 25068
3601 1 9 . 1 1 20 20 ALA N N 20 123.176 123.176 124.248 -1.072 25068
3602 1 9 . 1 1 20 20 ALA HA H 20 4.139 4.139 4.283 -0.144 25068
3603 1 9 . 1 1 20 20 ALA C C 20 177.843 177.843 177.422 0.421 25068
3604 1 9 . 1 1 20 20 ALA CA C 20 52.391 52.391 52.224 0.167 25068
3605 1 9 . 1 1 20 20 ALA CB C 20 19.397 19.397 19.177 0.220 25068
3606 1 9 . 1 1 20 20 ALA H H 20 7.348 7.348 8.365 -1.017 25068
3607 1 9 . 1 1 21 21 LEU N N 21 125.680 125.680 123.843 1.837 25068
3608 1 9 . 1 1 21 21 LEU HA H 21 4.194 4.194 4.048 0.146 25068
3609 1 9 . 1 1 21 21 LEU C C 21 177.091 177.091 177.246 -0.155 25068
3610 1 9 . 1 1 21 21 LEU CA C 21 55.472 55.472 55.185 0.287 25068
3611 1 9 . 1 1 21 21 LEU CB C 21 43.931 43.931 42.545 1.386 25068
3612 1 9 . 1 1 21 21 LEU H H 21 9.055 9.055 8.281 0.774 25068
3613 1 9 . 1 1 22 22 SER N N 22 116.686 116.686 114.521 2.165 25068
3614 1 9 . 1 1 22 22 SER HA H 22 4.427 4.427 4.528 -0.101 25068
3615 1 9 . 1 1 22 22 SER C C 22 174.241 174.241 175.850 -1.609 25068
3616 1 9 . 1 1 22 22 SER CA C 22 57.564 57.564 58.403 -0.839 25068
3617 1 9 . 1 1 22 22 SER CB C 22 66.568 66.568 64.136 2.432 25068
3618 1 9 . 1 1 22 22 SER H H 22 7.549 7.549 8.042 -0.493 25068
3619 1 9 . 1 1 23 23 ALA N N 23 123.382 123.382 126.507 -3.125 25068
3620 1 9 . 1 1 23 23 ALA HA H 23 4.163 4.163 4.005 0.158 25068
3621 1 9 . 1 1 23 23 ALA C C 23 178.863 178.863 179.474 -0.611 25068
3622 1 9 . 1 1 23 23 ALA CA C 23 57.124 57.124 54.990 2.134 25068
3623 1 9 . 1 1 23 23 ALA CB C 23 19.441 19.441 18.404 1.036 25068
3624 1 9 . 1 1 23 23 ALA H H 23 9.035 9.035 8.845 0.190 25068
3625 1 9 . 1 1 24 24 TYR N N 24 115.979 115.979 118.971 -2.992 25068
3626 1 9 . 1 1 24 24 TYR HA H 24 2.590 2.590 4.331 -1.741 25068
3627 1 9 . 1 1 24 24 TYR C C 24 176.257 176.257 177.681 -1.424 25068
3628 1 9 . 1 1 24 24 TYR CA C 24 60.940 60.940 61.458 -0.518 25068
3629 1 9 . 1 1 24 24 TYR CB C 24 39.106 39.106 38.611 0.495 25068
3630 1 9 . 1 1 24 24 TYR H H 24 8.206 8.206 8.230 -0.024 25068
3631 1 9 . 1 1 25 25 MET N N 25 116.391 116.391 119.757 -3.366 25068
3632 1 9 . 1 1 25 25 MET HA H 25 3.643 3.643 4.206 -0.563 25068
3633 1 9 . 1 1 25 25 MET C C 25 180.177 180.177 177.535 2.642 25068
3634 1 9 . 1 1 25 25 MET CA C 25 59.161 59.161 58.351 0.810 25068
3635 1 9 . 1 1 25 25 MET CB C 25 32.748 32.748 32.468 0.280 25068
3636 1 9 . 1 1 25 25 MET H H 25 7.433 7.433 7.762 -0.329 25068
3637 1 9 . 1 1 26 26 PHE N N 26 118.699 118.699 120.452 -1.753 25068
3638 1 9 . 1 1 26 26 PHE HA H 26 4.063 4.063 4.062 0.001 25068
3639 1 9 . 1 1 26 26 PHE C C 26 178.055 178.055 177.238 0.817 25068
3640 1 9 . 1 1 26 26 PHE CA C 26 64.840 64.840 62.577 2.263 25068
3641 1 9 . 1 1 26 26 PHE CB C 26 40.437 40.437 39.177 1.260 25068
3642 1 9 . 1 1 26 26 PHE H H 26 7.982 7.982 9.059 -1.077 25068
3643 1 9 . 1 1 27 27 TYR N N 27 123.888 123.888 118.966 4.922 25068
3644 1 9 . 1 1 27 27 TYR HA H 27 3.576 3.576 4.220 -0.644 25068
3645 1 9 . 1 1 27 27 TYR C C 27 176.691 176.691 177.370 -0.679 25068
3646 1 9 . 1 1 27 27 TYR CA C 27 62.831 62.831 61.977 0.854 25068
3647 1 9 . 1 1 27 27 TYR CB C 27 39.238 39.238 38.354 0.884 25068
3648 1 9 . 1 1 27 27 TYR H H 27 7.843 7.843 7.969 -0.126 25068
3649 1 9 . 1 1 28 28 VAL N N 28 119.501 119.501 119.277 0.224 25068
3650 1 9 . 1 1 28 28 VAL HA H 28 2.912 2.912 3.351 -0.439 25068
3651 1 9 . 1 1 28 28 VAL C C 28 177.067 177.067 177.689 -0.622 25068
3652 1 9 . 1 1 28 28 VAL CA C 28 67.149 67.149 67.640 -0.491 25068
3653 1 9 . 1 1 28 28 VAL CB C 28 32.599 32.599 31.456 1.143 25068
3654 1 9 . 1 1 28 28 VAL H H 28 8.370 8.370 7.696 0.674 25068
3655 1 9 . 1 1 29 29 LYS N N 29 114.512 114.512 118.624 -4.112 25068
3656 1 9 . 1 1 29 29 LYS HA H 29 3.676 3.676 3.801 -0.125 25068
3657 1 9 . 1 1 29 29 LYS C C 29 178.627 178.627 178.657 -0.030 25068
3658 1 9 . 1 1 29 29 LYS CA C 29 60.349 60.349 59.628 0.721 25068
3659 1 9 . 1 1 29 29 LYS CB C 29 33.278 33.278 31.590 1.688 25068
3660 1 9 . 1 1 29 29 LYS H H 29 6.821 6.821 8.189 -1.368 25068
3661 1 9 . 1 1 30 30 ASP N N 30 116.793 116.793 121.682 -4.889 25068
3662 1 9 . 1 1 30 30 ASP HA H 30 4.466 4.466 4.298 0.168 25068
3663 1 9 . 1 1 30 30 ASP C C 30 178.615 178.615 178.443 0.172 25068
3664 1 9 . 1 1 30 30 ASP CA C 30 57.223 57.223 57.180 0.043 25068
3665 1 9 . 1 1 30 30 ASP CB C 30 42.066 42.066 40.279 1.787 25068
3666 1 9 . 1 1 30 30 ASP H H 30 6.875 6.875 8.037 -1.162 25068
3667 1 9 . 1 1 31 31 LYS N N 31 122.423 122.423 120.844 1.579 25068
3668 1 9 . 1 1 31 31 LYS HA H 31 3.813 3.813 3.993 -0.180 25068
3669 1 9 . 1 1 31 31 LYS C C 31 178.443 178.443 179.078 -0.635 25068
3670 1 9 . 1 1 31 31 LYS CA C 31 57.494 57.494 59.179 -1.685 25068
3671 1 9 . 1 1 31 31 LYS CB C 31 32.539 32.539 32.220 0.319 25068
3672 1 9 . 1 1 31 31 LYS H H 31 8.910 8.910 8.021 0.889 25068
3673 1 9 . 1 1 32 32 ARG N N 32 117.823 117.823 119.397 -1.574 25068
3674 1 9 . 1 1 32 32 ARG HA H 32 3.540 3.540 3.934 -0.394 25068
3675 1 9 . 1 1 32 32 ARG C C 32 176.951 176.951 178.683 -1.732 25068
3676 1 9 . 1 1 32 32 ARG CA C 32 61.259 61.259 59.594 1.665 25068
3677 1 9 . 1 1 32 32 ARG CB C 32 30.668 30.668 30.136 0.532 25068
3678 1 9 . 1 1 32 32 ARG H H 32 8.501 8.501 7.856 0.645 25068
3679 1 9 . 1 1 33 33 LEU N N 33 114.878 114.878 119.372 -4.494 25068
3680 1 9 . 1 1 33 33 LEU HA H 33 3.871 3.871 3.810 0.061 25068
3681 1 9 . 1 1 33 33 LEU C C 33 179.180 179.180 179.025 0.155 25068
3682 1 9 . 1 1 33 33 LEU CA C 33 58.377 58.377 57.972 0.404 25068
3683 1 9 . 1 1 33 33 LEU CB C 33 42.429 42.429 41.647 0.782 25068
3684 1 9 . 1 1 33 33 LEU H H 33 6.549 6.549 8.172 -1.623 25068
3685 1 9 . 1 1 34 34 GLU N N 34 118.637 118.637 119.545 -0.908 25068
3686 1 9 . 1 1 34 34 GLU HA H 34 3.866 3.866 3.991 -0.125 25068
3687 1 9 . 1 1 34 34 GLU C C 34 178.988 178.988 179.295 -0.307 25068
3688 1 9 . 1 1 34 34 GLU CA C 34 60.248 60.248 59.589 0.659 25068
3689 1 9 . 1 1 34 34 GLU CB C 34 31.325 31.325 29.626 1.699 25068
3690 1 9 . 1 1 34 34 GLU H H 34 7.135 7.135 7.942 -0.807 25068
3691 1 9 . 1 1 35 35 ILE N N 35 119.142 119.142 120.103 -0.961 25068
3692 1 9 . 1 1 35 35 ILE HA H 35 3.693 3.693 3.879 -0.186 25068
3693 1 9 . 1 1 35 35 ILE C C 35 177.789 177.789 178.458 -0.669 25068
3694 1 9 . 1 1 35 35 ILE CA C 35 65.753 65.753 65.004 0.749 25068
3695 1 9 . 1 1 35 35 ILE CB C 35 38.940 38.940 37.804 1.136 25068
3696 1 9 . 1 1 35 35 ILE H H 35 8.076 8.076 8.236 -0.160 25068
3697 1 9 . 1 1 36 36 ILE N N 36 116.296 116.296 119.164 -2.868 25068
3698 1 9 . 1 1 36 36 ILE HA H 36 3.640 3.640 3.950 -0.310 25068
3699 1 9 . 1 1 36 36 ILE C C 36 177.270 177.270 177.264 0.006 25068
3700 1 9 . 1 1 36 36 ILE CA C 36 64.633 64.633 63.860 0.773 25068
3701 1 9 . 1 1 36 36 ILE CB C 36 38.718 38.718 38.385 0.333 25068
3702 1 9 . 1 1 36 36 ILE H H 36 7.754 7.754 7.919 -0.165 25068
3703 1 9 . 1 1 37 37 LYS N N 37 119.626 119.626 118.683 0.943 25068
3704 1 9 . 1 1 37 37 LYS HA H 37 3.922 3.922 4.090 -0.168 25068
3705 1 9 . 1 1 37 37 LYS C C 37 178.129 178.129 177.760 0.369 25068
3706 1 9 . 1 1 37 37 LYS CA C 37 59.996 59.996 58.582 1.414 25068
3707 1 9 . 1 1 37 37 LYS CB C 37 33.487 33.487 32.590 0.897 25068
3708 1 9 . 1 1 37 37 LYS H H 37 7.413 7.413 7.973 -0.560 25068
3709 1 9 . 1 1 38 38 GLU N N 38 116.708 116.708 117.458 -0.750 25068
3710 1 9 . 1 1 38 38 GLU HA H 38 4.060 4.060 4.297 -0.237 25068
3711 1 9 . 1 1 38 38 GLU C C 38 177.004 177.004 176.813 0.191 25068
3712 1 9 . 1 1 38 38 GLU CA C 38 59.070 59.070 57.205 1.865 25068
3713 1 9 . 1 1 38 38 GLU CB C 38 31.665 31.665 30.772 0.893 25068
3714 1 9 . 1 1 38 38 GLU H H 38 7.354 7.354 8.109 -0.755 25068
3715 1 9 . 1 1 39 39 LYS N N 39 118.621 118.621 119.670 -1.049 25068
3716 1 9 . 1 1 39 39 LYS HA H 39 4.690 4.690 4.723 -0.033 25068
3717 1 9 . 1 1 39 39 LYS C C 39 172.792 172.792 174.499 -1.707 25068
3718 1 9 . 1 1 39 39 LYS CA C 39 54.596 54.596 53.218 1.378 25068
3719 1 9 . 1 1 39 39 LYS CB C 39 33.945 33.945 33.815 0.130 25068
3720 1 9 . 1 1 39 39 LYS H H 39 8.176 8.176 7.611 0.565 25068
3721 1 9 . 1 1 40 40 PRO HA H 40 4.429 4.429 4.286 0.143 25068
3722 1 9 . 1 1 40 40 PRO C C 40 179.829 179.829 177.635 2.194 25068
3723 1 9 . 1 1 40 40 PRO CA C 40 66.040 66.040 64.395 1.645 25068
3724 1 9 . 1 1 40 40 PRO CB C 40 32.606 32.606 32.063 0.543 25068
3725 1 9 . 1 1 41 41 GLU N N 41 119.150 119.150 119.302 -0.152 25068
3726 1 9 . 1 1 41 41 GLU HA H 41 4.143 4.143 4.173 -0.030 25068
3727 1 9 . 1 1 41 41 GLU C C 41 178.502 178.502 178.206 0.296 25068
3728 1 9 . 1 1 41 41 GLU CA C 41 59.485 59.485 58.748 0.737 25068
3729 1 9 . 1 1 41 41 GLU CB C 41 28.574 28.574 29.400 -0.826 25068
3730 1 9 . 1 1 41 41 GLU H H 41 9.789 9.789 8.669 1.120 25068
3731 1 9 . 1 1 42 42 LEU N N 42 121.443 121.443 119.857 1.586 25068
3732 1 9 . 1 1 42 42 LEU HA H 42 4.185 4.185 4.424 -0.239 25068
3733 1 9 . 1 1 42 42 LEU C C 42 177.815 177.815 178.178 -0.363 25068
3734 1 9 . 1 1 42 42 LEU CA C 42 56.730 56.730 54.834 1.896 25068
3735 1 9 . 1 1 42 42 LEU CB C 42 42.013 42.013 41.656 0.357 25068
3736 1 9 . 1 1 42 42 LEU H H 42 8.312 8.312 7.605 0.707 25068
3737 1 9 . 1 1 43 43 ALA N N 43 119.949 119.949 122.436 -2.487 25068
3738 1 9 . 1 1 43 43 ALA HA H 43 3.746 3.746 3.942 -0.196 25068
3739 1 9 . 1 1 43 43 ALA C C 43 178.635 178.635 177.836 0.799 25068
3740 1 9 . 1 1 43 43 ALA CA C 43 56.164 56.164 54.588 1.576 25068
3741 1 9 . 1 1 43 43 ALA CB C 43 19.670 19.670 18.491 1.179 25068
3742 1 9 . 1 1 43 43 ALA H H 43 7.554 7.554 7.823 -0.269 25068
3743 1 9 . 1 1 44 44 LYS N N 44 112.690 112.690 115.998 -3.308 25068
3744 1 9 . 1 1 44 44 LYS HA H 44 4.232 4.232 4.350 -0.118 25068
3745 1 9 . 1 1 44 44 LYS C C 44 175.949 175.949 175.509 0.440 25068
3746 1 9 . 1 1 44 44 LYS CA C 44 56.987 56.987 55.345 1.642 25068
3747 1 9 . 1 1 44 44 LYS CB C 44 33.345 33.345 31.811 1.534 25068
3748 1 9 . 1 1 44 44 LYS H H 44 7.560 7.560 7.895 -0.335 25068
3749 1 9 . 1 1 45 45 ASP N N 45 122.529 122.529 121.337 1.192 25068
3750 1 9 . 1 1 45 45 ASP HA H 45 4.749 4.749 4.842 -0.093 25068
3751 1 9 . 1 1 45 45 ASP C C 45 174.677 174.677 176.038 -1.361 25068
3752 1 9 . 1 1 45 45 ASP CA C 45 53.030 53.030 52.291 0.739 25068
3753 1 9 . 1 1 45 45 ASP CB C 45 41.549 41.549 41.221 0.328 25068
3754 1 9 . 1 1 45 45 ASP H H 45 7.672 7.672 8.013 -0.341 25068
3755 1 9 . 1 1 46 46 VAL N N 46 121.529 121.529 124.488 -2.959 25068
3756 1 9 . 1 1 46 46 VAL HA H 46 3.639 3.639 3.585 0.054 25068
3757 1 9 . 1 1 46 46 VAL C C 46 179.102 179.102 177.494 1.608 25068
3758 1 9 . 1 1 46 46 VAL CA C 46 66.430 66.430 66.030 0.400 25068
3759 1 9 . 1 1 46 46 VAL CB C 46 32.650 32.650 31.555 1.095 25068
3760 1 9 . 1 1 46 46 VAL H H 46 7.808 7.808 8.565 -0.757 25068
3761 1 9 . 1 1 47 47 ALA N N 47 123.933 123.933 121.186 2.747 25068
3762 1 9 . 1 1 47 47 ALA HA H 47 4.112 4.112 3.977 0.135 25068
3763 1 9 . 1 1 47 47 ALA C C 47 180.665 180.665 179.632 1.033 25068
3764 1 9 . 1 1 47 47 ALA CA C 47 55.822 55.822 55.192 0.630 25068
3765 1 9 . 1 1 47 47 ALA CB C 47 19.129 19.129 17.920 1.209 25068
3766 1 9 . 1 1 47 47 ALA H H 47 8.505 8.505 8.318 0.187 25068
3767 1 9 . 1 1 48 48 GLN N N 48 120.047 120.047 118.927 1.120 25068
3768 1 9 . 1 1 48 48 GLN HA H 48 4.033 4.033 4.075 -0.042 25068
3769 1 9 . 1 1 48 48 GLN C C 48 178.486 178.486 178.176 0.310 25068
3770 1 9 . 1 1 48 48 GLN CA C 48 59.436 59.436 58.340 1.096 25068
3771 1 9 . 1 1 48 48 GLN CB C 48 29.436 29.436 28.399 1.037 25068
3772 1 9 . 1 1 48 48 GLN H H 48 7.852 7.852 8.076 -0.224 25068
3773 1 9 . 1 1 49 49 VAL N N 49 119.185 119.185 116.688 2.497 25068
3774 1 9 . 1 1 49 49 VAL HA H 49 3.424 3.424 3.546 -0.122 25068
3775 1 9 . 1 1 49 49 VAL C C 49 177.519 177.519 177.937 -0.418 25068
3776 1 9 . 1 1 49 49 VAL CA C 49 68.854 68.854 66.113 2.741 25068
3777 1 9 . 1 1 49 49 VAL CB C 49 32.454 32.454 31.017 1.437 25068
3778 1 9 . 1 1 49 49 VAL H H 49 7.984 7.984 7.947 0.037 25068
3779 1 9 . 1 1 50 50 GLY N N 50 104.919 104.919 108.114 -3.195 25068
3780 1 9 . 1 1 50 50 GLY C C 50 176.825 176.825 175.784 1.041 25068
3781 1 9 . 1 1 50 50 GLY CA C 50 48.398 48.398 47.302 1.096 25068
3782 1 9 . 1 1 50 50 GLY H H 50 8.020 8.020 8.370 -0.350 25068
3783 1 9 . 1 1 51 51 LYS N N 51 123.422 123.422 122.865 0.557 25068
3784 1 9 . 1 1 51 51 LYS HA H 51 4.032 4.032 4.062 -0.030 25068
3785 1 9 . 1 1 51 51 LYS C C 51 179.332 179.332 179.082 0.250 25068
3786 1 9 . 1 1 51 51 LYS CA C 51 60.246 60.246 58.946 1.300 25068
3787 1 9 . 1 1 51 51 LYS CB C 51 33.626 33.626 32.172 1.454 25068
3788 1 9 . 1 1 51 51 LYS H H 51 7.699 7.699 7.865 -0.166 25068
3789 1 9 . 1 1 52 52 LEU N N 52 120.442 120.442 120.335 0.107 25068
3790 1 9 . 1 1 52 52 LEU HA H 52 4.041 4.041 3.982 0.059 25068
3791 1 9 . 1 1 52 52 LEU C C 52 180.984 180.984 178.908 2.076 25068
3792 1 9 . 1 1 52 52 LEU CA C 52 58.855 58.855 58.022 0.833 25068
3793 1 9 . 1 1 52 52 LEU CB C 52 43.046 43.046 41.629 1.417 25068
3794 1 9 . 1 1 52 52 LEU H H 52 8.088 8.088 7.818 0.270 25068
3795 1 9 . 1 1 53 53 ILE N N 53 121.249 121.249 119.112 2.137 25068
3796 1 9 . 1 1 53 53 ILE HA H 53 3.557 3.557 3.802 -0.245 25068
3797 1 9 . 1 1 53 53 ILE C C 53 177.945 177.945 178.563 -0.618 25068
3798 1 9 . 1 1 53 53 ILE CA C 53 67.431 67.431 62.862 4.569 25068
3799 1 9 . 1 1 53 53 ILE CB C 53 38.887 38.887 35.990 2.897 25068
3800 1 9 . 1 1 53 53 ILE H H 53 8.475 8.475 8.122 0.353 25068
3801 1 9 . 1 1 54 54 GLY N N 54 107.755 107.755 107.885 -0.130 25068
3802 1 9 . 1 1 54 54 GLY C C 54 177.691 177.691 176.270 1.421 25068
3803 1 9 . 1 1 54 54 GLY CA C 54 48.997 48.997 47.332 1.665 25068
3804 1 9 . 1 1 54 54 GLY H H 54 8.130 8.130 8.388 -0.258 25068
3805 1 9 . 1 1 55 55 GLU N N 55 122.138 122.138 122.533 -0.395 25068
3806 1 9 . 1 1 55 55 GLU HA H 55 4.032 4.032 3.936 0.096 25068
3807 1 9 . 1 1 55 55 GLU C C 55 179.146 179.146 178.971 0.175 25068
3808 1 9 . 1 1 55 55 GLU CA C 55 59.958 59.958 59.428 0.530 25068
3809 1 9 . 1 1 55 55 GLU CB C 55 30.551 30.551 29.684 0.867 25068
3810 1 9 . 1 1 55 55 GLU H H 55 8.089 8.089 8.168 -0.079 25068
3811 1 9 . 1 1 56 56 ALA N N 56 122.985 122.985 122.067 0.918 25068
3812 1 9 . 1 1 56 56 ALA HA H 56 4.107 4.107 4.120 -0.013 25068
3813 1 9 . 1 1 56 56 ALA C C 56 181.177 181.177 179.184 1.993 25068
3814 1 9 . 1 1 56 56 ALA CA C 56 56.414 56.414 54.818 1.596 25068
3815 1 9 . 1 1 56 56 ALA CB C 56 19.948 19.948 18.294 1.654 25068
3816 1 9 . 1 1 56 56 ALA H H 56 7.947 7.947 8.011 -0.064 25068
3817 1 9 . 1 1 57 57 TRP N N 57 120.485 120.485 120.870 -0.385 25068
3818 1 9 . 1 1 57 57 TRP HA H 57 3.940 3.940 4.243 -0.303 25068
3819 1 9 . 1 1 57 57 TRP C C 57 178.537 178.537 178.803 -0.266 25068
3820 1 9 . 1 1 57 57 TRP CA C 57 60.633 60.633 60.064 0.569 25068
3821 1 9 . 1 1 57 57 TRP CB C 57 31.681 31.681 29.783 1.898 25068
3822 1 9 . 1 1 57 57 TRP H H 57 8.910 8.910 8.252 0.658 25068
3823 1 9 . 1 1 58 58 GLY N N 58 102.004 102.004 106.951 -4.947 25068
3824 1 9 . 1 1 58 58 GLY C C 58 174.723 174.723 174.917 -0.194 25068
3825 1 9 . 1 1 58 58 GLY CA C 58 47.091 47.091 46.700 0.390 25068
3826 1 9 . 1 1 58 58 GLY H H 58 7.668 7.668 8.503 -0.835 25068
3827 1 9 . 1 1 59 59 GLN N N 59 116.202 116.202 117.265 -1.063 25068
3828 1 9 . 1 1 59 59 GLN HA H 59 4.259 4.259 4.361 -0.102 25068
3829 1 9 . 1 1 59 59 GLN C C 59 176.221 176.221 175.875 0.346 25068
3830 1 9 . 1 1 59 59 GLN CA C 59 55.967 55.967 54.354 1.613 25068
3831 1 9 . 1 1 59 59 GLN CB C 59 30.741 30.741 28.891 1.850 25068
3832 1 9 . 1 1 59 59 GLN H H 59 7.189 7.189 7.858 -0.669 25068
3833 1 9 . 1 1 60 60 LEU N N 60 120.776 120.776 123.896 -3.120 25068
3834 1 9 . 1 1 60 60 LEU HA H 60 4.185 4.185 4.295 -0.110 25068
3835 1 9 . 1 1 60 60 LEU C C 60 177.372 177.372 176.730 0.642 25068
3836 1 9 . 1 1 60 60 LEU CA C 60 56.061 56.061 54.587 1.474 25068
3837 1 9 . 1 1 60 60 LEU CB C 60 43.696 43.696 42.346 1.350 25068
3838 1 9 . 1 1 60 60 LEU H H 60 6.968 6.968 7.272 -0.304 25068
3839 1 9 . 1 1 61 61 SER N N 61 120.432 120.432 121.705 -1.273 25068
3840 1 9 . 1 1 61 61 SER HA H 61 4.582 4.582 4.566 0.016 25068
3841 1 9 . 1 1 61 61 SER C C 61 173.500 173.500 174.026 -0.526 25068
3842 1 9 . 1 1 61 61 SER CA C 61 57.204 57.204 56.676 0.528 25068
3843 1 9 . 1 1 61 61 SER CB C 61 63.980 63.980 62.787 1.193 25068
3844 1 9 . 1 1 61 61 SER H H 61 8.885 8.885 8.319 0.566 25068
3845 1 9 . 1 1 63 63 ALA HA H 63 4.089 4.089 4.115 -0.026 25068
3846 1 9 . 1 1 63 63 ALA C C 63 180.570 180.570 179.162 1.408 25068
3847 1 9 . 1 1 63 63 ALA CA C 63 56.005 56.005 54.662 1.343 25068
3848 1 9 . 1 1 63 63 ALA CB C 63 19.317 19.317 18.047 1.270 25068
3849 1 9 . 1 1 64 64 GLN N N 64 116.774 116.774 116.445 0.329 25068
3850 1 9 . 1 1 64 64 GLN HA H 64 4.122 4.122 4.260 -0.138 25068
3851 1 9 . 1 1 64 64 GLN C C 64 178.275 178.275 178.165 0.110 25068
3852 1 9 . 1 1 64 64 GLN CA C 64 58.622 58.622 58.063 0.559 25068
3853 1 9 . 1 1 64 64 GLN CB C 64 31.350 31.350 28.980 2.370 25068
3854 1 9 . 1 1 64 64 GLN H H 64 7.603 7.603 7.832 -0.229 25068
3855 1 9 . 1 1 65 65 LYS N N 65 117.203 117.203 120.386 -3.183 25068
3856 1 9 . 1 1 65 65 LYS HA H 65 4.129 4.129 4.140 -0.011 25068
3857 1 9 . 1 1 65 65 LYS C C 65 178.449 178.449 178.811 -0.362 25068
3858 1 9 . 1 1 65 65 LYS CA C 65 59.891 59.891 59.081 0.810 25068
3859 1 9 . 1 1 65 65 LYS CB C 65 34.351 34.351 32.123 2.228 25068
3860 1 9 . 1 1 65 65 LYS H H 65 7.810 7.810 7.471 0.339 25068
3861 1 9 . 1 1 66 66 ALA N N 66 122.218 122.218 122.684 -0.466 25068
3862 1 9 . 1 1 66 66 ALA HA H 66 4.290 4.290 4.183 0.107 25068
3863 1 9 . 1 1 66 66 ALA C C 66 176.135 176.135 176.767 -0.632 25068
3864 1 9 . 1 1 66 66 ALA CA C 66 57.745 57.745 56.839 0.906 25068
3865 1 9 . 1 1 66 66 ALA CB C 66 17.033 17.033 16.465 0.568 25068
3866 1 9 . 1 1 66 66 ALA H H 66 7.469 7.469 8.482 -1.013 25068
3867 1 9 . 1 1 67 67 PRO HA H 67 4.142 4.142 4.298 -0.156 25068
3868 1 9 . 1 1 67 67 PRO C C 67 179.591 179.591 178.637 0.954 25068
3869 1 9 . 1 1 67 67 PRO CA C 67 66.960 66.960 65.573 1.387 25068
3870 1 9 . 1 1 67 67 PRO CB C 67 32.014 32.014 31.425 0.589 25068
3871 1 9 . 1 1 68 68 TYR N N 68 117.140 117.140 120.629 -3.489 25068
3872 1 9 . 1 1 68 68 TYR HA H 68 3.940 3.940 4.006 -0.066 25068
3873 1 9 . 1 1 68 68 TYR C C 68 177.733 177.733 177.768 -0.035 25068
3874 1 9 . 1 1 68 68 TYR CA C 68 63.505 63.505 62.242 1.263 25068
3875 1 9 . 1 1 68 68 TYR CB C 68 38.503 38.503 38.586 -0.083 25068
3876 1 9 . 1 1 68 68 TYR H H 68 7.268 7.268 8.283 -1.015 25068
3877 1 9 . 1 1 69 69 GLU N N 69 120.747 120.747 118.411 2.336 25068
3878 1 9 . 1 1 69 69 GLU HA H 69 4.253 4.253 3.977 0.276 25068
3879 1 9 . 1 1 69 69 GLU C C 69 179.805 179.805 178.762 1.043 25068
3880 1 9 . 1 1 69 69 GLU CA C 69 60.145 60.145 59.629 0.516 25068
3881 1 9 . 1 1 69 69 GLU CB C 69 29.808 29.808 29.589 0.219 25068
3882 1 9 . 1 1 69 69 GLU H H 69 8.048 8.048 8.738 -0.690 25068
3883 1 9 . 1 1 70 70 LYS N N 70 120.938 120.938 120.611 0.327 25068
3884 1 9 . 1 1 70 70 LYS HA H 70 4.020 4.020 3.963 0.057 25068
3885 1 9 . 1 1 70 70 LYS C C 70 178.740 178.740 178.907 -0.167 25068
3886 1 9 . 1 1 70 70 LYS CA C 70 60.202 60.202 59.650 0.552 25068
3887 1 9 . 1 1 70 70 LYS CB C 70 32.419 32.419 32.270 0.148 25068
3888 1 9 . 1 1 70 70 LYS H H 70 8.301 8.301 8.064 0.237 25068
3889 1 9 . 1 1 71 71 LYS N N 71 118.427 118.427 118.762 -0.335 25068
3890 1 9 . 1 1 71 71 LYS HA H 71 3.528 3.528 3.923 -0.395 25068
3891 1 9 . 1 1 71 71 LYS C C 71 179.280 179.280 178.959 0.321 25068
3892 1 9 . 1 1 71 71 LYS CA C 71 61.146 61.146 59.291 1.855 25068
3893 1 9 . 1 1 71 71 LYS CB C 71 32.196 32.196 31.908 0.288 25068
3894 1 9 . 1 1 71 71 LYS H H 71 7.234 7.234 8.224 -0.990 25068
3895 1 9 . 1 1 72 72 ALA N N 72 122.126 122.126 121.643 0.483 25068
3896 1 9 . 1 1 72 72 ALA HA H 72 4.357 4.357 3.915 0.442 25068
3897 1 9 . 1 1 72 72 ALA C C 72 180.468 180.468 179.850 0.618 25068
3898 1 9 . 1 1 72 72 ALA CA C 72 56.457 56.457 55.097 1.360 25068
3899 1 9 . 1 1 72 72 ALA CB C 72 19.562 19.562 17.816 1.746 25068
3900 1 9 . 1 1 72 72 ALA H H 72 7.890 7.890 8.021 -0.131 25068
3901 1 9 . 1 1 73 73 GLN N N 73 121.659 121.659 119.110 2.549 25068
3902 1 9 . 1 1 73 73 GLN HA H 73 4.029 4.029 4.034 -0.005 25068
3903 1 9 . 1 1 73 73 GLN C C 73 179.576 179.576 178.319 1.257 25068
3904 1 9 . 1 1 73 73 GLN CA C 73 60.427 60.427 58.845 1.582 25068
3905 1 9 . 1 1 73 73 GLN CB C 73 28.732 28.732 28.688 0.044 25068
3906 1 9 . 1 1 73 73 GLN H H 73 8.353 8.353 8.089 0.264 25068
3907 1 9 . 1 1 74 74 LEU N N 74 119.752 119.752 120.895 -1.143 25068
3908 1 9 . 1 1 74 74 LEU HA H 74 4.046 4.046 3.894 0.152 25068
3909 1 9 . 1 1 74 74 LEU C C 74 180.424 180.424 179.355 1.069 25068
3910 1 9 . 1 1 74 74 LEU CA C 74 58.675 58.675 58.678 -0.003 25068
3911 1 9 . 1 1 74 74 LEU CB C 74 42.376 42.376 41.575 0.800 25068
3912 1 9 . 1 1 74 74 LEU H H 74 8.160 8.160 8.247 -0.087 25068
3913 1 9 . 1 1 75 75 ASP N N 75 122.159 122.159 118.227 3.932 25068
3914 1 9 . 1 1 75 75 ASP HA H 75 4.988 4.988 4.319 0.669 25068
3915 1 9 . 1 1 75 75 ASP C C 75 178.046 178.046 178.410 -0.364 25068
3916 1 9 . 1 1 75 75 ASP CA C 75 58.191 58.191 57.816 0.376 25068
3917 1 9 . 1 1 75 75 ASP CB C 75 42.958 42.958 40.907 2.051 25068
3918 1 9 . 1 1 75 75 ASP H H 75 8.361 8.361 8.534 -0.173 25068
3919 1 9 . 1 1 76 76 LYS N N 76 119.861 119.861 121.288 -1.427 25068
3920 1 9 . 1 1 76 76 LYS HA H 76 3.988 3.988 4.079 -0.091 25068
3921 1 9 . 1 1 76 76 LYS C C 76 179.668 179.668 178.872 0.796 25068
3922 1 9 . 1 1 76 76 LYS CA C 76 60.984 60.984 59.607 1.377 25068
3923 1 9 . 1 1 76 76 LYS CB C 76 33.124 33.124 32.403 0.721 25068
3924 1 9 . 1 1 76 76 LYS H H 76 7.940 7.940 7.773 0.167 25068
3925 1 9 . 1 1 77 77 VAL N N 77 121.485 121.485 119.296 2.189 25068
3926 1 9 . 1 1 77 77 VAL HA H 77 3.687 3.687 3.671 0.016 25068
3927 1 9 . 1 1 77 77 VAL C C 77 178.070 178.070 177.650 0.420 25068
3928 1 9 . 1 1 77 77 VAL CA C 77 67.359 67.359 65.433 1.927 25068
3929 1 9 . 1 1 77 77 VAL CB C 77 32.645 32.645 31.801 0.844 25068
3930 1 9 . 1 1 77 77 VAL H H 77 7.401 7.401 8.110 -0.709 25068
3931 1 9 . 1 1 78 78 ARG N N 78 121.960 121.960 119.483 2.477 25068
3932 1 9 . 1 1 78 78 ARG HA H 78 4.010 4.010 3.921 0.089 25068
3933 1 9 . 1 1 78 78 ARG C C 78 179.144 179.144 178.682 0.462 25068
3934 1 9 . 1 1 78 78 ARG CA C 78 60.598 60.598 60.279 0.319 25068
3935 1 9 . 1 1 78 78 ARG CB C 78 28.352 28.352 30.117 -1.765 25068
3936 1 9 . 1 1 78 78 ARG H H 78 7.813 7.813 8.233 -0.420 25068
3937 1 9 . 1 1 79 79 TYR N N 79 120.411 120.411 121.633 -1.222 25068
3938 1 9 . 1 1 79 79 TYR HA H 79 3.878 3.878 4.507 -0.629 25068
3939 1 9 . 1 1 79 79 TYR C C 79 176.080 176.080 177.755 -1.675 25068
3940 1 9 . 1 1 79 79 TYR CA C 79 63.669 63.669 59.226 4.443 25068
3941 1 9 . 1 1 79 79 TYR CB C 79 39.758 39.758 38.267 1.491 25068
3942 1 9 . 1 1 79 79 TYR H H 79 8.608 8.608 8.428 0.180 25068
3943 1 9 . 1 1 80 80 SER N N 80 113.726 113.726 114.374 -0.648 25068
3944 1 9 . 1 1 80 80 SER HA H 80 3.880 3.880 3.758 0.122 25068
3945 1 9 . 1 1 80 80 SER C C 80 176.794 176.794 176.964 -0.170 25068
3946 1 9 . 1 1 80 80 SER CA C 80 62.969 62.969 62.022 0.947 25068
3947 1 9 . 1 1 80 80 SER CB C 80 63.605 63.605 62.824 0.781 25068
3948 1 9 . 1 1 80 80 SER H H 80 8.234 8.234 8.238 -0.004 25068
3949 1 9 . 1 1 81 81 LYS N N 81 121.920 121.920 120.732 1.188 25068
3950 1 9 . 1 1 81 81 LYS HA H 81 4.029 4.029 3.997 0.032 25068
3951 1 9 . 1 1 81 81 LYS C C 81 179.342 179.342 178.938 0.404 25068
3952 1 9 . 1 1 81 81 LYS CA C 81 60.138 60.138 59.075 1.063 25068
3953 1 9 . 1 1 81 81 LYS CB C 81 33.238 33.238 32.122 1.116 25068
3954 1 9 . 1 1 81 81 LYS H H 81 7.958 7.958 7.944 0.014 25068
3955 1 9 . 1 1 82 82 GLU N N 82 119.515 119.515 120.094 -0.579 25068
3956 1 9 . 1 1 82 82 GLU HA H 82 3.945 3.945 4.083 -0.138 25068
3957 1 9 . 1 1 82 82 GLU C C 82 180.689 180.689 179.239 1.450 25068
3958 1 9 . 1 1 82 82 GLU CA C 82 60.920 60.920 59.619 1.301 25068
3959 1 9 . 1 1 82 82 GLU CB C 82 30.885 30.885 29.529 1.356 25068
3960 1 9 . 1 1 82 82 GLU H H 82 8.310 8.310 8.139 0.171 25068
3961 1 9 . 1 1 83 83 ILE N N 83 121.362 121.362 119.969 1.393 25068
3962 1 9 . 1 1 83 83 ILE HA H 83 3.889 3.889 3.694 0.195 25068
3963 1 9 . 1 1 83 83 ILE C C 83 177.207 177.207 177.643 -0.436 25068
3964 1 9 . 1 1 83 83 ILE CA C 83 62.754 62.754 63.867 -1.113 25068
3965 1 9 . 1 1 83 83 ILE CB C 83 37.651 37.651 37.773 -0.122 25068
3966 1 9 . 1 1 83 83 ILE H H 83 8.887 8.887 7.934 0.953 25068
3967 1 9 . 1 1 84 84 GLU N N 84 122.327 122.327 119.891 2.436 25068
3968 1 9 . 1 1 84 84 GLU HA H 84 4.028 4.028 3.903 0.125 25068
3969 1 9 . 1 1 84 84 GLU C C 84 179.047 179.047 179.094 -0.047 25068
3970 1 9 . 1 1 84 84 GLU CA C 84 60.045 60.045 60.000 0.045 25068
3971 1 9 . 1 1 84 84 GLU CB C 84 30.099 30.099 29.191 0.908 25068
3972 1 9 . 1 1 84 84 GLU H H 84 7.289 7.289 8.132 -0.843 25068
3973 1 9 . 1 1 85 85 GLU N N 85 118.046 118.046 119.356 -1.310 25068
3974 1 9 . 1 1 85 85 GLU HA H 85 3.966 3.966 4.032 -0.066 25068
3975 1 9 . 1 1 85 85 GLU C C 85 178.614 178.614 179.156 -0.542 25068
3976 1 9 . 1 1 85 85 GLU CA C 85 59.997 59.997 59.120 0.877 25068
3977 1 9 . 1 1 85 85 GLU CB C 85 30.453 30.453 29.187 1.266 25068
3978 1 9 . 1 1 85 85 GLU H H 85 7.545 7.545 8.232 -0.687 25068
3979 1 9 . 1 1 86 86 TYR N N 86 121.050 121.050 120.135 0.915 25068
3980 1 9 . 1 1 86 86 TYR HA H 86 4.094 4.094 4.263 -0.169 25068
3981 1 9 . 1 1 86 86 TYR C C 86 177.815 177.815 178.298 -0.483 25068
3982 1 9 . 1 1 86 86 TYR CA C 86 62.072 62.072 61.792 0.280 25068
3983 1 9 . 1 1 86 86 TYR CB C 86 39.954 39.954 38.386 1.568 25068
3984 1 9 . 1 1 86 86 TYR H H 86 8.277 8.277 8.287 -0.010 25068
3985 1 9 . 1 1 87 87 ARG N N 87 118.353 118.353 118.291 0.062 25068
3986 1 9 . 1 1 87 87 ARG HA H 87 3.877 3.877 4.063 -0.186 25068
3987 1 9 . 1 1 87 87 ARG C C 87 178.067 178.067 178.657 -0.590 25068
3988 1 9 . 1 1 87 87 ARG CA C 87 59.513 59.513 59.015 0.498 25068
3989 1 9 . 1 1 87 87 ARG CB C 87 31.053 31.053 30.371 0.682 25068
3990 1 9 . 1 1 87 87 ARG H H 87 8.249 8.249 8.394 -0.145 25068
3991 1 9 . 1 1 88 88 LYS N N 88 118.205 118.205 118.709 -0.504 25068
3992 1 9 . 1 1 88 88 LYS HA H 88 3.982 3.982 4.066 -0.084 25068
3993 1 9 . 1 1 88 88 LYS C C 88 178.050 178.050 177.100 0.950 25068
3994 1 9 . 1 1 88 88 LYS CA C 88 59.265 59.265 58.576 0.689 25068
3995 1 9 . 1 1 88 88 LYS CB C 88 33.499 33.499 32.681 0.818 25068
3996 1 9 . 1 1 88 88 LYS H H 88 7.465 7.465 7.986 -0.521 25068
3997 1 9 . 1 1 89 89 LYS N N 89 118.341 118.341 114.577 3.764 25068
3998 1 9 . 1 1 89 89 LYS HA H 89 4.084 4.084 4.457 -0.373 25068
3999 1 9 . 1 1 89 89 LYS C C 89 176.691 176.691 175.877 0.814 25068
4000 1 9 . 1 1 89 89 LYS CA C 89 58.188 58.188 55.766 2.422 25068
4001 1 9 . 1 1 89 89 LYS CB C 89 33.809 33.809 31.830 1.979 25068
4002 1 9 . 1 1 89 89 LYS H H 89 7.580 7.580 7.775 -0.195 25068
4003 1 9 . 1 1 90 90 ASN N N 90 117.604 117.604 118.950 -1.346 25068
4004 1 9 . 1 1 90 90 ASN HA H 90 4.563 4.563 4.837 -0.274 25068
4005 1 9 . 1 1 90 90 ASN C C 90 174.419 174.419 175.523 -1.104 25068
4006 1 9 . 1 1 90 90 ASN CA C 90 54.433 54.433 54.003 0.430 25068
4007 1 9 . 1 1 90 90 ASN CB C 90 40.182 40.182 40.918 -0.736 25068
4008 1 9 . 1 1 90 90 ASN H H 90 7.741 7.741 7.912 -0.172 25068
4009 1 9 . 1 1 91 91 GLN N N 91 111.990 111.990 120.961 -8.971 25068
4010 1 9 . 1 1 91 91 GLN HA H 91 4.213 4.213 4.512 -0.299 25068
4011 1 9 . 1 1 91 91 GLN C C 91 174.970 174.970 174.962 0.008 25068
4012 1 9 . 1 1 91 91 GLN CA C 91 57.011 57.011 55.601 1.410 25068
4013 1 9 . 1 1 91 91 GLN CB C 91 30.358 30.358 30.002 0.356 25068
4014 1 9 . 1 1 91 91 GLN H H 91 7.925 7.925 7.858 0.067 25068
4015 1 10 . 1 1 14 14 PRO HA H 14 4.322 4.322 4.326 -0.004 25068
4016 1 10 . 1 1 14 14 PRO C C 14 176.783 176.783 176.712 0.071 25068
4017 1 10 . 1 1 14 14 PRO CA C 14 64.643 64.643 64.023 0.620 25068
4018 1 10 . 1 1 14 14 PRO CB C 14 33.114 33.114 32.208 0.906 25068
4019 1 10 . 1 1 15 15 LEU N N 15 120.158 120.158 117.360 2.798 25068
4020 1 10 . 1 1 15 15 LEU HA H 15 4.238 4.238 4.029 0.209 25068
4021 1 10 . 1 1 15 15 LEU C C 15 176.361 176.361 175.222 1.139 25068
4022 1 10 . 1 1 15 15 LEU CA C 15 55.395 55.395 54.907 0.487 25068
4023 1 10 . 1 1 15 15 LEU CB C 15 42.619 42.619 40.989 1.631 25068
4024 1 10 . 1 1 15 15 LEU H H 15 8.189 8.189 8.143 0.046 25068
4025 1 10 . 1 1 16 16 ALA N N 16 124.269 124.269 120.705 3.564 25068
4026 1 10 . 1 1 16 16 ALA HA H 16 3.496 3.496 4.589 -1.093 25068
4027 1 10 . 1 1 16 16 ALA C C 16 175.124 175.124 175.880 -0.756 25068
4028 1 10 . 1 1 16 16 ALA CA C 16 51.457 51.457 50.702 0.755 25068
4029 1 10 . 1 1 16 16 ALA CB C 16 18.105 18.105 19.579 -1.474 25068
4030 1 10 . 1 1 16 16 ALA H H 16 7.500 7.500 7.767 -0.267 25068
4031 1 10 . 1 1 17 17 PRO HA H 17 4.157 4.157 4.478 -0.321 25068
4032 1 10 . 1 1 17 17 PRO C C 17 176.396 176.396 175.658 0.738 25068
4033 1 10 . 1 1 17 17 PRO CA C 17 63.588 63.588 62.269 1.319 25068
4034 1 10 . 1 1 17 17 PRO CB C 17 32.850 32.850 32.262 0.588 25068
4035 1 10 . 1 1 18 18 LYS N N 18 124.070 124.070 122.301 1.769 25068
4036 1 10 . 1 1 18 18 LYS HA H 18 4.147 4.147 4.288 -0.141 25068
4037 1 10 . 1 1 18 18 LYS C C 18 177.543 177.543 176.377 1.166 25068
4038 1 10 . 1 1 18 18 LYS CA C 18 57.081 57.081 56.740 0.341 25068
4039 1 10 . 1 1 18 18 LYS CB C 18 33.573 33.573 32.452 1.121 25068
4040 1 10 . 1 1 18 18 LYS H H 18 8.886 8.886 8.478 0.408 25068
4041 1 10 . 1 1 19 19 ARG N N 19 122.242 122.242 122.533 -0.291 25068
4042 1 10 . 1 1 19 19 ARG HA H 19 3.437 3.437 4.646 -1.209 25068
4043 1 10 . 1 1 19 19 ARG C C 19 175.409 175.409 174.479 0.930 25068
4044 1 10 . 1 1 19 19 ARG CA C 19 57.545 57.545 55.314 2.231 25068
4045 1 10 . 1 1 19 19 ARG CB C 19 31.149 31.149 30.823 0.326 25068
4046 1 10 . 1 1 19 19 ARG H H 19 8.286 8.286 8.496 -0.210 25068
4047 1 10 . 1 1 20 20 ALA N N 20 123.176 123.176 122.498 0.678 25068
4048 1 10 . 1 1 20 20 ALA HA H 20 4.139 4.139 4.621 -0.482 25068
4049 1 10 . 1 1 20 20 ALA C C 20 177.843 177.843 176.043 1.800 25068
4050 1 10 . 1 1 20 20 ALA CA C 20 52.391 52.391 51.493 0.898 25068
4051 1 10 . 1 1 20 20 ALA CB C 20 19.397 19.397 20.053 -0.656 25068
4052 1 10 . 1 1 20 20 ALA H H 20 7.348 7.348 8.182 -0.834 25068
4053 1 10 . 1 1 21 21 LEU N N 21 125.680 125.680 121.237 4.443 25068
4054 1 10 . 1 1 21 21 LEU HA H 21 4.194 4.194 4.260 -0.066 25068
4055 1 10 . 1 1 21 21 LEU C C 21 177.091 177.091 177.371 -0.280 25068
4056 1 10 . 1 1 21 21 LEU CA C 21 55.472 55.472 54.077 1.395 25068
4057 1 10 . 1 1 21 21 LEU CB C 21 43.931 43.931 43.409 0.522 25068
4058 1 10 . 1 1 21 21 LEU H H 21 9.055 9.055 8.226 0.829 25068
4059 1 10 . 1 1 22 22 SER N N 22 116.686 116.686 114.620 2.066 25068
4060 1 10 . 1 1 22 22 SER HA H 22 4.427 4.427 4.178 0.249 25068
4061 1 10 . 1 1 22 22 SER C C 22 174.241 174.241 175.668 -1.427 25068
4062 1 10 . 1 1 22 22 SER CA C 22 57.564 57.564 58.082 -0.518 25068
4063 1 10 . 1 1 22 22 SER CB C 22 66.568 66.568 64.282 2.286 25068
4064 1 10 . 1 1 22 22 SER H H 22 7.549 7.549 8.190 -0.641 25068
4065 1 10 . 1 1 23 23 ALA N N 23 123.382 123.382 126.405 -3.023 25068
4066 1 10 . 1 1 23 23 ALA HA H 23 4.163 4.163 3.850 0.313 25068
4067 1 10 . 1 1 23 23 ALA C C 23 178.863 178.863 178.677 0.186 25068
4068 1 10 . 1 1 23 23 ALA CA C 23 57.124 57.124 54.734 2.390 25068
4069 1 10 . 1 1 23 23 ALA CB C 23 19.441 19.441 18.517 0.924 25068
4070 1 10 . 1 1 23 23 ALA H H 23 9.035 9.035 9.050 -0.015 25068
4071 1 10 . 1 1 24 24 TYR N N 24 115.979 115.979 117.622 -1.643 25068
4072 1 10 . 1 1 24 24 TYR HA H 24 2.590 2.590 4.415 -1.825 25068
4073 1 10 . 1 1 24 24 TYR C C 24 176.257 176.257 176.728 -0.471 25068
4074 1 10 . 1 1 24 24 TYR CA C 24 60.940 60.940 60.464 0.476 25068
4075 1 10 . 1 1 24 24 TYR CB C 24 39.106 39.106 38.728 0.378 25068
4076 1 10 . 1 1 24 24 TYR H H 24 8.206 8.206 8.275 -0.069 25068
4077 1 10 . 1 1 25 25 MET N N 25 116.391 116.391 120.528 -4.137 25068
4078 1 10 . 1 1 25 25 MET HA H 25 3.643 3.643 4.116 -0.473 25068
4079 1 10 . 1 1 25 25 MET C C 25 180.177 180.177 177.434 2.743 25068
4080 1 10 . 1 1 25 25 MET CA C 25 59.161 59.161 58.507 0.654 25068
4081 1 10 . 1 1 25 25 MET CB C 25 32.748 32.748 32.633 0.115 25068
4082 1 10 . 1 1 25 25 MET H H 25 7.433 7.433 7.875 -0.442 25068
4083 1 10 . 1 1 26 26 PHE N N 26 118.699 118.699 120.188 -1.489 25068
4084 1 10 . 1 1 26 26 PHE HA H 26 4.063 4.063 3.983 0.080 25068
4085 1 10 . 1 1 26 26 PHE C C 26 178.055 178.055 176.778 1.277 25068
4086 1 10 . 1 1 26 26 PHE CA C 26 64.840 64.840 62.227 2.613 25068
4087 1 10 . 1 1 26 26 PHE CB C 26 40.437 40.437 39.094 1.343 25068
4088 1 10 . 1 1 26 26 PHE H H 26 7.982 7.982 8.454 -0.472 25068
4089 1 10 . 1 1 27 27 TYR N N 27 123.888 123.888 118.702 5.186 25068
4090 1 10 . 1 1 27 27 TYR HA H 27 3.576 3.576 4.141 -0.565 25068
4091 1 10 . 1 1 27 27 TYR C C 27 176.691 176.691 176.892 -0.201 25068
4092 1 10 . 1 1 27 27 TYR CA C 27 62.831 62.831 61.528 1.303 25068
4093 1 10 . 1 1 27 27 TYR CB C 27 39.238 39.238 37.899 1.339 25068
4094 1 10 . 1 1 27 27 TYR H H 27 7.843 7.843 7.797 0.046 25068
4095 1 10 . 1 1 28 28 VAL N N 28 119.501 119.501 119.223 0.278 25068
4096 1 10 . 1 1 28 28 VAL HA H 28 2.912 2.912 3.330 -0.418 25068
4097 1 10 . 1 1 28 28 VAL C C 28 177.067 177.067 177.558 -0.491 25068
4098 1 10 . 1 1 28 28 VAL CA C 28 67.149 67.149 66.323 0.826 25068
4099 1 10 . 1 1 28 28 VAL CB C 28 32.599 32.599 31.396 1.203 25068
4100 1 10 . 1 1 28 28 VAL H H 28 8.370 8.370 7.257 1.113 25068
4101 1 10 . 1 1 29 29 LYS N N 29 114.512 114.512 119.186 -4.674 25068
4102 1 10 . 1 1 29 29 LYS HA H 29 3.676 3.676 3.789 -0.113 25068
4103 1 10 . 1 1 29 29 LYS C C 29 178.627 178.627 178.633 -0.006 25068
4104 1 10 . 1 1 29 29 LYS CA C 29 60.349 60.349 59.684 0.665 25068
4105 1 10 . 1 1 29 29 LYS CB C 29 33.278 33.278 31.558 1.720 25068
4106 1 10 . 1 1 29 29 LYS H H 29 6.821 6.821 8.137 -1.316 25068
4107 1 10 . 1 1 30 30 ASP N N 30 116.793 116.793 120.716 -3.923 25068
4108 1 10 . 1 1 30 30 ASP HA H 30 4.466 4.466 4.170 0.296 25068
4109 1 10 . 1 1 30 30 ASP C C 30 178.615 178.615 178.206 0.409 25068
4110 1 10 . 1 1 30 30 ASP CA C 30 57.223 57.223 57.607 -0.384 25068
4111 1 10 . 1 1 30 30 ASP CB C 30 42.066 42.066 40.252 1.814 25068
4112 1 10 . 1 1 30 30 ASP H H 30 6.875 6.875 8.038 -1.163 25068
4113 1 10 . 1 1 31 31 LYS N N 31 122.423 122.423 120.084 2.339 25068
4114 1 10 . 1 1 31 31 LYS HA H 31 3.813 3.813 3.695 0.118 25068
4115 1 10 . 1 1 31 31 LYS C C 31 178.443 178.443 178.686 -0.243 25068
4116 1 10 . 1 1 31 31 LYS CA C 31 57.494 57.494 59.857 -2.363 25068
4117 1 10 . 1 1 31 31 LYS CB C 31 32.539 32.539 32.278 0.261 25068
4118 1 10 . 1 1 31 31 LYS H H 31 8.910 8.910 7.835 1.075 25068
4119 1 10 . 1 1 32 32 ARG N N 32 117.823 117.823 119.511 -1.688 25068
4120 1 10 . 1 1 32 32 ARG HA H 32 3.540 3.540 3.984 -0.444 25068
4121 1 10 . 1 1 32 32 ARG C C 32 176.951 176.951 178.485 -1.534 25068
4122 1 10 . 1 1 32 32 ARG CA C 32 61.259 61.259 59.379 1.880 25068
4123 1 10 . 1 1 32 32 ARG CB C 32 30.668 30.668 29.943 0.725 25068
4124 1 10 . 1 1 32 32 ARG H H 32 8.501 8.501 7.856 0.645 25068
4125 1 10 . 1 1 33 33 LEU N N 33 114.878 114.878 119.938 -5.060 25068
4126 1 10 . 1 1 33 33 LEU HA H 33 3.871 3.871 3.801 0.070 25068
4127 1 10 . 1 1 33 33 LEU C C 33 179.180 179.180 179.390 -0.210 25068
4128 1 10 . 1 1 33 33 LEU CA C 33 58.377 58.377 57.989 0.388 25068
4129 1 10 . 1 1 33 33 LEU CB C 33 42.429 42.429 41.552 0.877 25068
4130 1 10 . 1 1 33 33 LEU H H 33 6.549 6.549 8.361 -1.812 25068
4131 1 10 . 1 1 34 34 GLU N N 34 118.637 118.637 119.156 -0.519 25068
4132 1 10 . 1 1 34 34 GLU HA H 34 3.866 3.866 3.968 -0.102 25068
4133 1 10 . 1 1 34 34 GLU C C 34 178.988 178.988 179.182 -0.194 25068
4134 1 10 . 1 1 34 34 GLU CA C 34 60.248 60.248 59.387 0.861 25068
4135 1 10 . 1 1 34 34 GLU CB C 34 31.325 31.325 29.345 1.980 25068
4136 1 10 . 1 1 34 34 GLU H H 34 7.135 7.135 7.998 -0.863 25068
4137 1 10 . 1 1 35 35 ILE N N 35 119.142 119.142 119.867 -0.725 25068
4138 1 10 . 1 1 35 35 ILE HA H 35 3.693 3.693 3.802 -0.109 25068
4139 1 10 . 1 1 35 35 ILE C C 35 177.789 177.789 178.872 -1.083 25068
4140 1 10 . 1 1 35 35 ILE CA C 35 65.753 65.753 65.419 0.334 25068
4141 1 10 . 1 1 35 35 ILE CB C 35 38.940 38.940 37.829 1.111 25068
4142 1 10 . 1 1 35 35 ILE H H 35 8.076 8.076 8.050 0.026 25068
4143 1 10 . 1 1 36 36 ILE N N 36 116.296 116.296 118.539 -2.243 25068
4144 1 10 . 1 1 36 36 ILE HA H 36 3.640 3.640 3.966 -0.326 25068
4145 1 10 . 1 1 36 36 ILE C C 36 177.270 177.270 177.729 -0.459 25068
4146 1 10 . 1 1 36 36 ILE CA C 36 64.633 64.633 64.216 0.417 25068
4147 1 10 . 1 1 36 36 ILE CB C 36 38.718 38.718 37.855 0.863 25068
4148 1 10 . 1 1 36 36 ILE H H 36 7.754 7.754 8.047 -0.293 25068
4149 1 10 . 1 1 37 37 LYS N N 37 119.626 119.626 120.587 -0.961 25068
4150 1 10 . 1 1 37 37 LYS HA H 37 3.922 3.922 4.094 -0.172 25068
4151 1 10 . 1 1 37 37 LYS C C 37 178.129 178.129 178.167 -0.038 25068
4152 1 10 . 1 1 37 37 LYS CA C 37 59.996 59.996 58.978 1.018 25068
4153 1 10 . 1 1 37 37 LYS CB C 37 33.487 33.487 32.663 0.824 25068
4154 1 10 . 1 1 37 37 LYS H H 37 7.413 7.413 7.809 -0.396 25068
4155 1 10 . 1 1 38 38 GLU N N 38 116.708 116.708 116.362 0.346 25068
4156 1 10 . 1 1 38 38 GLU HA H 38 4.060 4.060 4.269 -0.209 25068
4157 1 10 . 1 1 38 38 GLU C C 38 177.004 177.004 177.427 -0.423 25068
4158 1 10 . 1 1 38 38 GLU CA C 38 59.070 59.070 57.871 1.199 25068
4159 1 10 . 1 1 38 38 GLU CB C 38 31.665 31.665 30.442 1.223 25068
4160 1 10 . 1 1 38 38 GLU H H 38 7.354 7.354 8.090 -0.736 25068
4161 1 10 . 1 1 39 39 LYS N N 39 118.621 118.621 120.038 -1.417 25068
4162 1 10 . 1 1 39 39 LYS HA H 39 4.690 4.690 4.788 -0.098 25068
4163 1 10 . 1 1 39 39 LYS C C 39 172.792 172.792 175.086 -2.294 25068
4164 1 10 . 1 1 39 39 LYS CA C 39 54.596 54.596 53.421 1.175 25068
4165 1 10 . 1 1 39 39 LYS CB C 39 33.945 33.945 32.675 1.270 25068
4166 1 10 . 1 1 39 39 LYS H H 39 8.176 8.176 7.798 0.378 25068
4167 1 10 . 1 1 40 40 PRO HA H 40 4.429 4.429 4.440 -0.011 25068
4168 1 10 . 1 1 40 40 PRO C C 40 179.829 179.829 178.419 1.410 25068
4169 1 10 . 1 1 40 40 PRO CA C 40 66.040 66.040 64.617 1.423 25068
4170 1 10 . 1 1 40 40 PRO CB C 40 32.606 32.606 31.741 0.865 25068
4171 1 10 . 1 1 41 41 GLU N N 41 119.150 119.150 120.847 -1.697 25068
4172 1 10 . 1 1 41 41 GLU HA H 41 4.143 4.143 4.152 -0.009 25068
4173 1 10 . 1 1 41 41 GLU C C 41 178.502 178.502 177.834 0.668 25068
4174 1 10 . 1 1 41 41 GLU CA C 41 59.485 59.485 59.051 0.434 25068
4175 1 10 . 1 1 41 41 GLU CB C 41 28.574 28.574 29.270 -0.696 25068
4176 1 10 . 1 1 41 41 GLU H H 41 9.789 9.789 8.805 0.984 25068
4177 1 10 . 1 1 42 42 LEU N N 42 121.443 121.443 119.198 2.245 25068
4178 1 10 . 1 1 42 42 LEU HA H 42 4.185 4.185 4.718 -0.533 25068
4179 1 10 . 1 1 42 42 LEU C C 42 177.815 177.815 177.541 0.274 25068
4180 1 10 . 1 1 42 42 LEU CA C 42 56.730 56.730 54.362 2.368 25068
4181 1 10 . 1 1 42 42 LEU CB C 42 42.013 42.013 41.764 0.249 25068
4182 1 10 . 1 1 42 42 LEU H H 42 8.312 8.312 7.665 0.647 25068
4183 1 10 . 1 1 43 43 ALA N N 43 119.949 119.949 122.110 -2.161 25068
4184 1 10 . 1 1 43 43 ALA HA H 43 3.746 3.746 4.056 -0.310 25068
4185 1 10 . 1 1 43 43 ALA C C 43 178.635 178.635 177.974 0.661 25068
4186 1 10 . 1 1 43 43 ALA CA C 43 56.164 56.164 54.341 1.823 25068
4187 1 10 . 1 1 43 43 ALA CB C 43 19.670 19.670 18.581 1.089 25068
4188 1 10 . 1 1 43 43 ALA H H 43 7.554 7.554 7.325 0.229 25068
4189 1 10 . 1 1 44 44 LYS N N 44 112.690 112.690 116.287 -3.597 25068
4190 1 10 . 1 1 44 44 LYS HA H 44 4.232 4.232 4.431 -0.199 25068
4191 1 10 . 1 1 44 44 LYS C C 44 175.949 175.949 175.754 0.195 25068
4192 1 10 . 1 1 44 44 LYS CA C 44 56.987 56.987 55.282 1.706 25068
4193 1 10 . 1 1 44 44 LYS CB C 44 33.345 33.345 31.869 1.476 25068
4194 1 10 . 1 1 44 44 LYS H H 44 7.560 7.560 7.854 -0.294 25068
4195 1 10 . 1 1 45 45 ASP N N 45 122.529 122.529 122.200 0.329 25068
4196 1 10 . 1 1 45 45 ASP HA H 45 4.749 4.749 4.905 -0.156 25068
4197 1 10 . 1 1 45 45 ASP C C 45 174.677 174.677 176.081 -1.404 25068
4198 1 10 . 1 1 45 45 ASP CA C 45 53.030 53.030 53.036 -0.006 25068
4199 1 10 . 1 1 45 45 ASP CB C 45 41.549 41.549 40.188 1.361 25068
4200 1 10 . 1 1 45 45 ASP H H 45 7.672 7.672 8.028 -0.356 25068
4201 1 10 . 1 1 46 46 VAL N N 46 121.529 121.529 122.414 -0.885 25068
4202 1 10 . 1 1 46 46 VAL HA H 46 3.639 3.639 3.540 0.099 25068
4203 1 10 . 1 1 46 46 VAL C C 46 179.102 179.102 177.609 1.493 25068
4204 1 10 . 1 1 46 46 VAL CA C 46 66.430 66.430 66.800 -0.370 25068
4205 1 10 . 1 1 46 46 VAL CB C 46 32.650 32.650 31.741 0.909 25068
4206 1 10 . 1 1 46 46 VAL H H 46 7.808 7.808 8.094 -0.286 25068
4207 1 10 . 1 1 47 47 ALA N N 47 123.933 123.933 120.766 3.167 25068
4208 1 10 . 1 1 47 47 ALA HA H 47 4.112 4.112 3.959 0.153 25068
4209 1 10 . 1 1 47 47 ALA C C 47 180.665 180.665 179.551 1.114 25068
4210 1 10 . 1 1 47 47 ALA CA C 47 55.822 55.822 55.185 0.637 25068
4211 1 10 . 1 1 47 47 ALA CB C 47 19.129 19.129 18.132 0.997 25068
4212 1 10 . 1 1 47 47 ALA H H 47 8.505 8.505 8.206 0.299 25068
4213 1 10 . 1 1 48 48 GLN N N 48 120.047 120.047 119.242 0.805 25068
4214 1 10 . 1 1 48 48 GLN HA H 48 4.033 4.033 4.025 0.008 25068
4215 1 10 . 1 1 48 48 GLN C C 48 178.486 178.486 178.209 0.277 25068
4216 1 10 . 1 1 48 48 GLN CA C 48 59.436 59.436 58.726 0.710 25068
4217 1 10 . 1 1 48 48 GLN CB C 48 29.436 29.436 28.271 1.165 25068
4218 1 10 . 1 1 48 48 GLN H H 48 7.852 7.852 7.642 0.210 25068
4219 1 10 . 1 1 49 49 VAL N N 49 119.185 119.185 117.241 1.944 25068
4220 1 10 . 1 1 49 49 VAL HA H 49 3.424 3.424 3.615 -0.191 25068
4221 1 10 . 1 1 49 49 VAL C C 49 177.519 177.519 178.131 -0.612 25068
4222 1 10 . 1 1 49 49 VAL CA C 49 68.854 68.854 65.685 3.169 25068
4223 1 10 . 1 1 49 49 VAL CB C 49 32.454 32.454 30.358 2.096 25068
4224 1 10 . 1 1 49 49 VAL H H 49 7.984 7.984 7.982 0.002 25068
4225 1 10 . 1 1 50 50 GLY N N 50 104.919 104.919 108.253 -3.334 25068
4226 1 10 . 1 1 50 50 GLY C C 50 176.825 176.825 175.901 0.924 25068
4227 1 10 . 1 1 50 50 GLY CA C 50 48.398 48.398 47.411 0.987 25068
4228 1 10 . 1 1 50 50 GLY H H 50 8.020 8.020 8.372 -0.352 25068
4229 1 10 . 1 1 51 51 LYS N N 51 123.422 123.422 122.828 0.594 25068
4230 1 10 . 1 1 51 51 LYS HA H 51 4.032 4.032 4.086 -0.054 25068
4231 1 10 . 1 1 51 51 LYS C C 51 179.332 179.332 179.146 0.186 25068
4232 1 10 . 1 1 51 51 LYS CA C 51 60.246 60.246 59.030 1.216 25068
4233 1 10 . 1 1 51 51 LYS CB C 51 33.626 33.626 32.136 1.490 25068
4234 1 10 . 1 1 51 51 LYS H H 51 7.699 7.699 7.886 -0.187 25068
4235 1 10 . 1 1 52 52 LEU N N 52 120.442 120.442 120.474 -0.032 25068
4236 1 10 . 1 1 52 52 LEU HA H 52 4.041 4.041 3.956 0.085 25068
4237 1 10 . 1 1 52 52 LEU C C 52 180.984 180.984 178.697 2.287 25068
4238 1 10 . 1 1 52 52 LEU CA C 52 58.855 58.855 58.155 0.700 25068
4239 1 10 . 1 1 52 52 LEU CB C 52 43.046 43.046 41.577 1.469 25068
4240 1 10 . 1 1 52 52 LEU H H 52 8.088 8.088 7.858 0.230 25068
4241 1 10 . 1 1 53 53 ILE N N 53 121.249 121.249 119.371 1.878 25068
4242 1 10 . 1 1 53 53 ILE HA H 53 3.557 3.557 3.811 -0.254 25068
4243 1 10 . 1 1 53 53 ILE C C 53 177.945 177.945 178.811 -0.866 25068
4244 1 10 . 1 1 53 53 ILE CA C 53 67.431 67.431 62.979 4.452 25068
4245 1 10 . 1 1 53 53 ILE CB C 53 38.887 38.887 36.032 2.855 25068
4246 1 10 . 1 1 53 53 ILE H H 53 8.475 8.475 8.178 0.297 25068
4247 1 10 . 1 1 54 54 GLY N N 54 107.755 107.755 107.847 -0.092 25068
4248 1 10 . 1 1 54 54 GLY C C 54 177.691 177.691 176.342 1.349 25068
4249 1 10 . 1 1 54 54 GLY CA C 54 48.997 48.997 47.498 1.498 25068
4250 1 10 . 1 1 54 54 GLY H H 54 8.130 8.130 8.468 -0.338 25068
4251 1 10 . 1 1 55 55 GLU N N 55 122.138 122.138 122.613 -0.475 25068
4252 1 10 . 1 1 55 55 GLU HA H 55 4.032 4.032 3.978 0.054 25068
4253 1 10 . 1 1 55 55 GLU C C 55 179.146 179.146 179.038 0.108 25068
4254 1 10 . 1 1 55 55 GLU CA C 55 59.958 59.958 59.401 0.556 25068
4255 1 10 . 1 1 55 55 GLU CB C 55 30.551 30.551 29.738 0.813 25068
4256 1 10 . 1 1 55 55 GLU H H 55 8.089 8.089 8.245 -0.156 25068
4257 1 10 . 1 1 56 56 ALA N N 56 122.985 122.985 122.004 0.981 25068
4258 1 10 . 1 1 56 56 ALA HA H 56 4.107 4.107 4.405 -0.298 25068
4259 1 10 . 1 1 56 56 ALA C C 56 181.177 181.177 179.762 1.415 25068
4260 1 10 . 1 1 56 56 ALA CA C 56 56.414 56.414 54.919 1.495 25068
4261 1 10 . 1 1 56 56 ALA CB C 56 19.948 19.948 18.559 1.389 25068
4262 1 10 . 1 1 56 56 ALA H H 56 7.947 7.947 8.390 -0.443 25068
4263 1 10 . 1 1 57 57 TRP N N 57 120.485 120.485 120.988 -0.503 25068
4264 1 10 . 1 1 57 57 TRP HA H 57 3.940 3.940 4.499 -0.559 25068
4265 1 10 . 1 1 57 57 TRP C C 57 178.537 178.537 178.533 0.004 25068
4266 1 10 . 1 1 57 57 TRP CA C 57 60.633 60.633 59.551 1.081 25068
4267 1 10 . 1 1 57 57 TRP CB C 57 31.681 31.681 29.555 2.126 25068
4268 1 10 . 1 1 57 57 TRP H H 57 8.910 8.910 8.290 0.620 25068
4269 1 10 . 1 1 58 58 GLY N N 58 102.004 102.004 106.081 -4.077 25068
4270 1 10 . 1 1 58 58 GLY C C 58 174.723 174.723 176.267 -1.544 25068
4271 1 10 . 1 1 58 58 GLY CA C 58 47.091 47.091 46.675 0.416 25068
4272 1 10 . 1 1 58 58 GLY H H 58 7.668 7.668 8.211 -0.543 25068
4273 1 10 . 1 1 59 59 GLN N N 59 116.202 116.202 119.034 -2.832 25068
4274 1 10 . 1 1 59 59 GLN HA H 59 4.259 4.259 4.082 0.177 25068
4275 1 10 . 1 1 59 59 GLN C C 59 176.221 176.221 176.533 -0.312 25068
4276 1 10 . 1 1 59 59 GLN CA C 59 55.967 55.967 56.304 -0.337 25068
4277 1 10 . 1 1 59 59 GLN CB C 59 30.741 30.741 28.579 2.162 25068
4278 1 10 . 1 1 59 59 GLN H H 59 7.189 7.189 8.038 -0.849 25068
4279 1 10 . 1 1 60 60 LEU N N 60 120.776 120.776 122.515 -1.739 25068
4280 1 10 . 1 1 60 60 LEU HA H 60 4.185 4.185 4.121 0.064 25068
4281 1 10 . 1 1 60 60 LEU C C 60 177.372 177.372 176.242 1.130 25068
4282 1 10 . 1 1 60 60 LEU CA C 60 56.061 56.061 55.784 0.277 25068
4283 1 10 . 1 1 60 60 LEU CB C 60 43.696 43.696 42.709 0.987 25068
4284 1 10 . 1 1 60 60 LEU H H 60 6.968 6.968 7.459 -0.491 25068
4285 1 10 . 1 1 61 61 SER N N 61 120.432 120.432 120.395 0.037 25068
4286 1 10 . 1 1 61 61 SER HA H 61 4.582 4.582 4.545 0.037 25068
4287 1 10 . 1 1 61 61 SER C C 61 173.500 173.500 174.361 -0.861 25068
4288 1 10 . 1 1 61 61 SER CA C 61 57.204 57.204 58.365 -1.161 25068
4289 1 10 . 1 1 61 61 SER CB C 61 63.980 63.980 63.408 0.572 25068
4290 1 10 . 1 1 61 61 SER H H 61 8.885 8.885 8.320 0.565 25068
4291 1 10 . 1 1 63 63 ALA HA H 63 4.089 4.089 4.132 -0.043 25068
4292 1 10 . 1 1 63 63 ALA C C 63 180.570 180.570 178.931 1.639 25068
4293 1 10 . 1 1 63 63 ALA CA C 63 56.005 56.005 54.676 1.329 25068
4294 1 10 . 1 1 63 63 ALA CB C 63 19.317 19.317 18.179 1.138 25068
4295 1 10 . 1 1 64 64 GLN N N 64 116.774 116.774 116.968 -0.194 25068
4296 1 10 . 1 1 64 64 GLN HA H 64 4.122 4.122 4.158 -0.036 25068
4297 1 10 . 1 1 64 64 GLN C C 64 178.275 178.275 178.078 0.197 25068
4298 1 10 . 1 1 64 64 GLN CA C 64 58.622 58.622 57.819 0.803 25068
4299 1 10 . 1 1 64 64 GLN CB C 64 31.350 31.350 28.623 2.727 25068
4300 1 10 . 1 1 64 64 GLN H H 64 7.603 7.603 7.987 -0.384 25068
4301 1 10 . 1 1 65 65 LYS N N 65 117.203 117.203 120.492 -3.289 25068
4302 1 10 . 1 1 65 65 LYS HA H 65 4.129 4.129 4.130 -0.001 25068
4303 1 10 . 1 1 65 65 LYS C C 65 178.449 178.449 178.766 -0.317 25068
4304 1 10 . 1 1 65 65 LYS CA C 65 59.891 59.891 59.271 0.620 25068
4305 1 10 . 1 1 65 65 LYS CB C 65 34.351 34.351 32.395 1.956 25068
4306 1 10 . 1 1 65 65 LYS H H 65 7.810 7.810 7.917 -0.107 25068
4307 1 10 . 1 1 66 66 ALA N N 66 122.218 122.218 122.461 -0.243 25068
4308 1 10 . 1 1 66 66 ALA HA H 66 4.290 4.290 4.244 0.046 25068
4309 1 10 . 1 1 66 66 ALA C C 66 176.135 176.135 176.641 -0.506 25068
4310 1 10 . 1 1 66 66 ALA CA C 66 57.745 57.745 56.880 0.865 25068
4311 1 10 . 1 1 66 66 ALA CB C 66 17.033 17.033 16.375 0.658 25068
4312 1 10 . 1 1 66 66 ALA H H 66 7.469 7.469 8.202 -0.733 25068
4313 1 10 . 1 1 67 67 PRO HA H 67 4.142 4.142 4.396 -0.254 25068
4314 1 10 . 1 1 67 67 PRO C C 67 179.591 179.591 179.114 0.477 25068
4315 1 10 . 1 1 67 67 PRO CA C 67 66.960 66.960 65.699 1.261 25068
4316 1 10 . 1 1 67 67 PRO CB C 67 32.014 32.014 31.549 0.465 25068
4317 1 10 . 1 1 68 68 TYR N N 68 117.140 117.140 119.087 -1.947 25068
4318 1 10 . 1 1 68 68 TYR HA H 68 3.940 3.940 4.128 -0.188 25068
4319 1 10 . 1 1 68 68 TYR C C 68 177.733 177.733 178.434 -0.701 25068
4320 1 10 . 1 1 68 68 TYR CA C 68 63.505 63.505 61.346 2.159 25068
4321 1 10 . 1 1 68 68 TYR CB C 68 38.503 38.503 37.692 0.811 25068
4322 1 10 . 1 1 68 68 TYR H H 68 7.268 7.268 8.588 -1.320 25068
4323 1 10 . 1 1 69 69 GLU N N 69 120.747 120.747 118.743 2.004 25068
4324 1 10 . 1 1 69 69 GLU HA H 69 4.253 4.253 4.042 0.211 25068
4325 1 10 . 1 1 69 69 GLU C C 69 179.805 179.805 179.215 0.590 25068
4326 1 10 . 1 1 69 69 GLU CA C 69 60.145 60.145 59.606 0.539 25068
4327 1 10 . 1 1 69 69 GLU CB C 69 29.808 29.808 29.373 0.435 25068
4328 1 10 . 1 1 69 69 GLU H H 69 8.048 8.048 8.650 -0.602 25068
4329 1 10 . 1 1 70 70 LYS N N 70 120.938 120.938 120.198 0.740 25068
4330 1 10 . 1 1 70 70 LYS HA H 70 4.020 4.020 3.979 0.041 25068
4331 1 10 . 1 1 70 70 LYS C C 70 178.740 178.740 179.173 -0.433 25068
4332 1 10 . 1 1 70 70 LYS CA C 70 60.202 60.202 59.855 0.347 25068
4333 1 10 . 1 1 70 70 LYS CB C 70 32.419 32.419 32.399 0.020 25068
4334 1 10 . 1 1 70 70 LYS H H 70 8.301 8.301 8.184 0.117 25068
4335 1 10 . 1 1 71 71 LYS N N 71 118.427 118.427 118.705 -0.278 25068
4336 1 10 . 1 1 71 71 LYS HA H 71 3.528 3.528 4.030 -0.502 25068
4337 1 10 . 1 1 71 71 LYS C C 71 179.280 179.280 178.915 0.365 25068
4338 1 10 . 1 1 71 71 LYS CA C 71 61.146 61.146 59.130 2.017 25068
4339 1 10 . 1 1 71 71 LYS CB C 71 32.196 32.196 32.113 0.083 25068
4340 1 10 . 1 1 71 71 LYS H H 71 7.234 7.234 8.282 -1.048 25068
4341 1 10 . 1 1 72 72 ALA N N 72 122.126 122.126 121.498 0.628 25068
4342 1 10 . 1 1 72 72 ALA HA H 72 4.357 4.357 3.996 0.361 25068
4343 1 10 . 1 1 72 72 ALA C C 72 180.468 180.468 179.992 0.476 25068
4344 1 10 . 1 1 72 72 ALA CA C 72 56.457 56.457 55.164 1.293 25068
4345 1 10 . 1 1 72 72 ALA CB C 72 19.562 19.562 18.105 1.457 25068
4346 1 10 . 1 1 72 72 ALA H H 72 7.890 7.890 8.151 -0.261 25068
4347 1 10 . 1 1 73 73 GLN N N 73 121.659 121.659 119.233 2.426 25068
4348 1 10 . 1 1 73 73 GLN HA H 73 4.029 4.029 4.080 -0.051 25068
4349 1 10 . 1 1 73 73 GLN C C 73 179.576 179.576 178.223 1.353 25068
4350 1 10 . 1 1 73 73 GLN CA C 73 60.427 60.427 58.211 2.216 25068
4351 1 10 . 1 1 73 73 GLN CB C 73 28.732 28.732 28.243 0.489 25068
4352 1 10 . 1 1 73 73 GLN H H 73 8.353 8.353 7.960 0.393 25068
4353 1 10 . 1 1 74 74 LEU N N 74 119.752 119.752 120.517 -0.765 25068
4354 1 10 . 1 1 74 74 LEU HA H 74 4.046 4.046 3.860 0.186 25068
4355 1 10 . 1 1 74 74 LEU C C 74 180.424 180.424 179.239 1.185 25068
4356 1 10 . 1 1 74 74 LEU CA C 74 58.675 58.675 58.716 -0.041 25068
4357 1 10 . 1 1 74 74 LEU CB C 74 42.376 42.376 41.581 0.795 25068
4358 1 10 . 1 1 74 74 LEU H H 74 8.160 8.160 8.270 -0.110 25068
4359 1 10 . 1 1 75 75 ASP N N 75 122.159 122.159 118.672 3.487 25068
4360 1 10 . 1 1 75 75 ASP HA H 75 4.988 4.988 4.372 0.616 25068
4361 1 10 . 1 1 75 75 ASP C C 75 178.046 178.046 178.937 -0.891 25068
4362 1 10 . 1 1 75 75 ASP CA C 75 58.191 58.191 57.501 0.691 25068
4363 1 10 . 1 1 75 75 ASP CB C 75 42.958 42.958 40.210 2.748 25068
4364 1 10 . 1 1 75 75 ASP H H 75 8.361 8.361 8.569 -0.208 25068
4365 1 10 . 1 1 76 76 LYS N N 76 119.861 119.861 121.330 -1.469 25068
4366 1 10 . 1 1 76 76 LYS HA H 76 3.988 3.988 4.151 -0.163 25068
4367 1 10 . 1 1 76 76 LYS C C 76 179.668 179.668 178.791 0.877 25068
4368 1 10 . 1 1 76 76 LYS CA C 76 60.984 60.984 59.465 1.519 25068
4369 1 10 . 1 1 76 76 LYS CB C 76 33.124 33.124 32.455 0.669 25068
4370 1 10 . 1 1 76 76 LYS H H 76 7.940 7.940 7.722 0.218 25068
4371 1 10 . 1 1 77 77 VAL N N 77 121.485 121.485 119.206 2.279 25068
4372 1 10 . 1 1 77 77 VAL HA H 77 3.687 3.687 3.652 0.035 25068
4373 1 10 . 1 1 77 77 VAL C C 77 178.070 178.070 177.690 0.380 25068
4374 1 10 . 1 1 77 77 VAL CA C 77 67.359 67.359 67.409 -0.050 25068
4375 1 10 . 1 1 77 77 VAL CB C 77 32.645 32.645 31.531 1.114 25068
4376 1 10 . 1 1 77 77 VAL H H 77 7.401 7.401 8.161 -0.760 25068
4377 1 10 . 1 1 78 78 ARG N N 78 121.960 121.960 119.778 2.182 25068
4378 1 10 . 1 1 78 78 ARG HA H 78 4.010 4.010 3.963 0.047 25068
4379 1 10 . 1 1 78 78 ARG C C 78 179.144 179.144 178.547 0.597 25068
4380 1 10 . 1 1 78 78 ARG CA C 78 60.598 60.598 59.478 1.120 25068
4381 1 10 . 1 1 78 78 ARG CB C 78 28.352 28.352 29.542 -1.190 25068
4382 1 10 . 1 1 78 78 ARG H H 78 7.813 7.813 8.277 -0.464 25068
4383 1 10 . 1 1 79 79 TYR N N 79 120.411 120.411 121.620 -1.209 25068
4384 1 10 . 1 1 79 79 TYR HA H 79 3.878 3.878 4.237 -0.359 25068
4385 1 10 . 1 1 79 79 TYR C C 79 176.080 176.080 177.384 -1.304 25068
4386 1 10 . 1 1 79 79 TYR CA C 79 63.669 63.669 59.318 4.351 25068
4387 1 10 . 1 1 79 79 TYR CB C 79 39.758 39.758 38.189 1.569 25068
4388 1 10 . 1 1 79 79 TYR H H 79 8.608 8.608 8.229 0.379 25068
4389 1 10 . 1 1 80 80 SER N N 80 113.726 113.726 114.575 -0.849 25068
4390 1 10 . 1 1 80 80 SER HA H 80 3.880 3.880 3.638 0.242 25068
4391 1 10 . 1 1 80 80 SER C C 80 176.794 176.794 176.608 0.186 25068
4392 1 10 . 1 1 80 80 SER CA C 80 62.969 62.969 62.323 0.646 25068
4393 1 10 . 1 1 80 80 SER CB C 80 63.605 63.605 62.902 0.703 25068
4394 1 10 . 1 1 80 80 SER H H 80 8.234 8.234 8.125 0.109 25068
4395 1 10 . 1 1 81 81 LYS N N 81 121.920 121.920 121.219 0.701 25068
4396 1 10 . 1 1 81 81 LYS HA H 81 4.029 4.029 4.236 -0.207 25068
4397 1 10 . 1 1 81 81 LYS C C 81 179.342 179.342 178.714 0.628 25068
4398 1 10 . 1 1 81 81 LYS CA C 81 60.138 60.138 58.728 1.410 25068
4399 1 10 . 1 1 81 81 LYS CB C 81 33.238 33.238 32.122 1.116 25068
4400 1 10 . 1 1 81 81 LYS H H 81 7.958 7.958 7.923 0.035 25068
4401 1 10 . 1 1 82 82 GLU N N 82 119.515 119.515 119.454 0.061 25068
4402 1 10 . 1 1 82 82 GLU HA H 82 3.945 3.945 4.057 -0.112 25068
4403 1 10 . 1 1 82 82 GLU C C 82 180.689 180.689 178.952 1.737 25068
4404 1 10 . 1 1 82 82 GLU CA C 82 60.920 60.920 59.765 1.155 25068
4405 1 10 . 1 1 82 82 GLU CB C 82 30.885 30.885 29.379 1.506 25068
4406 1 10 . 1 1 82 82 GLU H H 82 8.310 8.310 7.808 0.502 25068
4407 1 10 . 1 1 83 83 ILE N N 83 121.362 121.362 120.091 1.271 25068
4408 1 10 . 1 1 83 83 ILE HA H 83 3.889 3.889 3.697 0.192 25068
4409 1 10 . 1 1 83 83 ILE C C 83 177.207 177.207 177.829 -0.622 25068
4410 1 10 . 1 1 83 83 ILE CA C 83 62.754 62.754 63.492 -0.738 25068
4411 1 10 . 1 1 83 83 ILE CB C 83 37.651 37.651 37.964 -0.313 25068
4412 1 10 . 1 1 83 83 ILE H H 83 8.887 8.887 7.980 0.907 25068
4413 1 10 . 1 1 84 84 GLU N N 84 122.327 122.327 120.424 1.903 25068
4414 1 10 . 1 1 84 84 GLU HA H 84 4.028 4.028 3.821 0.207 25068
4415 1 10 . 1 1 84 84 GLU C C 84 179.047 179.047 179.059 -0.012 25068
4416 1 10 . 1 1 84 84 GLU CA C 84 60.045 60.045 60.548 -0.503 25068
4417 1 10 . 1 1 84 84 GLU CB C 84 30.099 30.099 29.439 0.660 25068
4418 1 10 . 1 1 84 84 GLU H H 84 7.289 7.289 8.131 -0.842 25068
4419 1 10 . 1 1 85 85 GLU N N 85 118.046 118.046 119.475 -1.429 25068
4420 1 10 . 1 1 85 85 GLU HA H 85 3.966 3.966 4.060 -0.094 25068
4421 1 10 . 1 1 85 85 GLU C C 85 178.614 178.614 179.426 -0.812 25068
4422 1 10 . 1 1 85 85 GLU CA C 85 59.997 59.997 59.452 0.546 25068
4423 1 10 . 1 1 85 85 GLU CB C 85 30.453 30.453 29.788 0.664 25068
4424 1 10 . 1 1 85 85 GLU H H 85 7.545 7.545 8.096 -0.551 25068
4425 1 10 . 1 1 86 86 TYR N N 86 121.050 121.050 118.887 2.163 25068
4426 1 10 . 1 1 86 86 TYR HA H 86 4.094 4.094 4.280 -0.186 25068
4427 1 10 . 1 1 86 86 TYR C C 86 177.815 177.815 178.056 -0.241 25068
4428 1 10 . 1 1 86 86 TYR CA C 86 62.072 62.072 61.694 0.378 25068
4429 1 10 . 1 1 86 86 TYR CB C 86 39.954 39.954 38.307 1.647 25068
4430 1 10 . 1 1 86 86 TYR H H 86 8.277 8.277 8.358 -0.081 25068
4431 1 10 . 1 1 87 87 ARG N N 87 118.353 118.353 118.235 0.118 25068
4432 1 10 . 1 1 87 87 ARG HA H 87 3.877 3.877 3.948 -0.071 25068
4433 1 10 . 1 1 87 87 ARG C C 87 178.067 178.067 178.714 -0.647 25068
4434 1 10 . 1 1 87 87 ARG CA C 87 59.513 59.513 59.485 0.028 25068
4435 1 10 . 1 1 87 87 ARG CB C 87 31.053 31.053 30.308 0.745 25068
4436 1 10 . 1 1 87 87 ARG H H 87 8.249 8.249 8.473 -0.224 25068
4437 1 10 . 1 1 88 88 LYS N N 88 118.205 118.205 119.220 -1.015 25068
4438 1 10 . 1 1 88 88 LYS HA H 88 3.982 3.982 4.140 -0.158 25068
4439 1 10 . 1 1 88 88 LYS C C 88 178.050 178.050 177.859 0.191 25068
4440 1 10 . 1 1 88 88 LYS CA C 88 59.265 59.265 58.641 0.624 25068
4441 1 10 . 1 1 88 88 LYS CB C 88 33.499 33.499 32.675 0.824 25068
4442 1 10 . 1 1 88 88 LYS H H 88 7.465 7.465 7.988 -0.523 25068
4443 1 10 . 1 1 89 89 LYS N N 89 118.341 118.341 115.693 2.648 25068
4444 1 10 . 1 1 89 89 LYS HA H 89 4.084 4.084 4.438 -0.354 25068
4445 1 10 . 1 1 89 89 LYS C C 89 176.691 176.691 175.911 0.780 25068
4446 1 10 . 1 1 89 89 LYS CA C 89 58.188 58.188 55.286 2.902 25068
4447 1 10 . 1 1 89 89 LYS CB C 89 33.809 33.809 32.299 1.510 25068
4448 1 10 . 1 1 89 89 LYS H H 89 7.580 7.580 7.737 -0.157 25068
4449 1 10 . 1 1 90 90 ASN N N 90 117.604 117.604 120.780 -3.176 25068
4450 1 10 . 1 1 90 90 ASN HA H 90 4.563 4.563 4.820 -0.257 25068
4451 1 10 . 1 1 90 90 ASN C C 90 174.419 174.419 174.612 -0.193 25068
4452 1 10 . 1 1 90 90 ASN CA C 90 54.433 54.433 53.181 1.252 25068
4453 1 10 . 1 1 90 90 ASN CB C 90 40.182 40.182 38.240 1.942 25068
4454 1 10 . 1 1 90 90 ASN H H 90 7.741 7.741 7.736 0.005 25068
4455 1 10 . 1 1 91 91 GLN N N 91 111.990 111.990 120.677 -8.687 25068
4456 1 10 . 1 1 91 91 GLN HA H 91 4.213 4.213 4.543 -0.330 25068
4457 1 10 . 1 1 91 91 GLN C C 91 174.970 174.970 176.150 -1.180 25068
4458 1 10 . 1 1 91 91 GLN CA C 91 57.011 57.011 55.142 1.869 25068
4459 1 10 . 1 1 91 91 GLN CB C 91 30.358 30.358 28.552 1.806 25068
4460 1 10 . 1 1 91 91 GLN H H 91 7.925 7.925 8.438 -0.513 25068
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 72 2.339 0.162 2.349 25068
2 1 1 "Average Difference" HA 79 0.380 0.119 0.363 25068
3 1 1 "Average Difference" C 77 0.877 -0.140 0.871 25068
4 1 1 "Average Difference" CA 77 1.410 -1.085 0.907 25068
5 1 1 "Average Difference" CB 74 1.248 -0.937 0.831 25068
6 1 1 "Average Difference" HN 72 0.620 0.176 0.599 25068
7 1 2 "Average Difference" N 72 2.531 0.096 2.547 25068
8 1 2 "Average Difference" HA 79 0.394 0.129 0.374 25068
9 1 2 "Average Difference" C 77 0.937 -0.129 0.934 25068
10 1 2 "Average Difference" CA 77 1.450 -1.055 1.002 25068
11 1 2 "Average Difference" CB 74 1.248 -0.943 0.823 25068
12 1 2 "Average Difference" HN 72 0.568 0.143 0.553 25068
13 1 3 "Average Difference" N 72 2.475 0.089 2.490 25068
14 1 3 "Average Difference" HA 79 0.391 0.108 0.378 25068
15 1 3 "Average Difference" C 77 0.905 -0.137 0.901 25068
16 1 3 "Average Difference" CA 77 1.458 -1.100 0.963 25068
17 1 3 "Average Difference" CB 74 1.209 -0.931 0.776 25068
18 1 3 "Average Difference" HN 72 0.592 0.153 0.576 25068
19 1 4 "Average Difference" N 72 2.636 0.193 2.647 25068
20 1 4 "Average Difference" HA 79 0.401 0.115 0.387 25068
21 1 4 "Average Difference" C 77 0.965 -0.167 0.956 25068
22 1 4 "Average Difference" CA 77 1.344 -1.040 0.857 25068
23 1 4 "Average Difference" CB 74 1.232 -0.903 0.843 25068
24 1 4 "Average Difference" HN 72 0.576 0.176 0.552 25068
25 1 5 "Average Difference" N 72 2.360 0.094 2.374 25068
26 1 5 "Average Difference" HA 79 0.408 0.107 0.396 25068
27 1 5 "Average Difference" C 77 0.930 -0.156 0.923 25068
28 1 5 "Average Difference" CA 77 1.383 -1.016 0.945 25068
29 1 5 "Average Difference" CB 74 1.312 -0.955 0.906 25068
30 1 5 "Average Difference" HN 72 0.560 0.141 0.546 25068
31 1 6 "Average Difference" N 72 2.664 -0.113 2.680 25068
32 1 6 "Average Difference" HA 79 0.373 0.097 0.363 25068
33 1 6 "Average Difference" C 77 0.915 -0.156 0.908 25068
34 1 6 "Average Difference" CA 77 1.398 -1.021 0.961 25068
35 1 6 "Average Difference" CB 74 1.286 -0.970 0.850 25068
36 1 6 "Average Difference" HN 72 0.554 0.143 0.539 25068
37 1 7 "Average Difference" N 72 2.480 0.041 2.497 25068
38 1 7 "Average Difference" HA 79 0.381 0.102 0.370 25068
39 1 7 "Average Difference" C 77 0.990 -0.143 0.986 25068
40 1 7 "Average Difference" CA 77 1.365 -0.975 0.962 25068
41 1 7 "Average Difference" CB 74 1.299 -0.941 0.902 25068
42 1 7 "Average Difference" HN 72 0.613 0.184 0.589 25068
43 1 8 "Average Difference" N 72 2.333 0.039 2.349 25068
44 1 8 "Average Difference" HA 79 0.387 0.116 0.371 25068
45 1 8 "Average Difference" C 77 0.950 -0.129 0.947 25068
46 1 8 "Average Difference" CA 77 1.398 -1.028 0.953 25068
47 1 8 "Average Difference" CB 74 1.266 -0.969 0.820 25068
48 1 8 "Average Difference" HN 72 0.593 0.150 0.578 25068
49 1 9 "Average Difference" N 72 2.504 0.344 2.497 25068
50 1 9 "Average Difference" HA 79 0.347 0.109 0.332 25068
51 1 9 "Average Difference" C 77 0.942 -0.172 0.932 25068
52 1 9 "Average Difference" CA 77 1.395 -1.015 0.964 25068
53 1 9 "Average Difference" CB 74 1.218 -0.926 0.797 25068
54 1 9 "Average Difference" HN 72 0.599 0.151 0.584 25068
55 1 10 "Average Difference" N 72 2.444 0.274 2.446 25068
56 1 10 "Average Difference" HA 79 0.393 0.098 0.383 25068
57 1 10 "Average Difference" C 77 0.967 -0.156 0.960 25068
58 1 10 "Average Difference" CA 77 1.440 -0.970 1.071 25068
59 1 10 "Average Difference" CB 74 1.298 -1.018 0.811 25068
60 1 10 "Average Difference" HN 72 0.598 0.158 0.580 25068
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 25068
_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 14 14 PRO HA H 14 4.322 4.322 4.351 -0.029 25068
2 1 . 1 1 14 14 PRO C C 14 176.783 176.783 176.835 -0.052 25068
3 1 . 1 1 14 14 PRO CA C 14 64.643 64.643 63.876 0.767 25068
4 1 . 1 1 14 14 PRO CB C 14 33.114 33.114 32.134 0.980 25068
5 1 . 1 1 15 15 LEU N N 15 120.158 120.158 117.797 2.361 25068
6 1 . 1 1 15 15 LEU HA H 15 4.238 4.238 4.352 -0.114 25068
7 1 . 1 1 15 15 LEU C C 15 176.361 176.361 175.722 0.639 25068
8 1 . 1 1 15 15 LEU CA C 15 55.395 55.395 54.408 0.987 25068
9 1 . 1 1 15 15 LEU CB C 15 42.619 42.619 41.223 1.396 25068
10 1 . 1 1 15 15 LEU H H 15 8.189 8.189 7.832 0.357 25068
11 1 . 1 1 16 16 ALA N N 16 124.269 124.269 121.675 2.594 25068
12 1 . 1 1 16 16 ALA HA H 16 3.496 3.496 4.709 -1.213 25068
13 1 . 1 1 16 16 ALA C C 16 175.124 175.124 175.517 -0.393 25068
14 1 . 1 1 16 16 ALA CA C 16 51.457 51.457 50.342 1.115 25068
15 1 . 1 1 16 16 ALA CB C 16 18.105 18.105 19.486 -1.381 25068
16 1 . 1 1 16 16 ALA H H 16 7.500 7.500 7.497 0.003 25068
17 1 . 1 1 17 17 PRO HA H 17 4.157 4.157 4.412 -0.255 25068
18 1 . 1 1 17 17 PRO C C 17 176.396 176.396 175.814 0.581 25068
19 1 . 1 1 17 17 PRO CA C 17 63.588 63.588 62.266 1.322 25068
20 1 . 1 1 17 17 PRO CB C 17 32.850 32.850 32.117 0.733 25068
21 1 . 1 1 18 18 LYS N N 18 124.070 124.070 121.402 2.668 25068
22 1 . 1 1 18 18 LYS HA H 18 4.147 4.147 4.285 -0.138 25068
23 1 . 1 1 18 18 LYS C C 18 177.543 177.543 175.983 1.560 25068
24 1 . 1 1 18 18 LYS CA C 18 57.081 57.081 56.544 0.537 25068
25 1 . 1 1 18 18 LYS CB C 18 33.573 33.573 32.921 0.652 25068
26 1 . 1 1 18 18 LYS H H 18 8.886 8.886 8.339 0.547 25068
27 1 . 1 1 19 19 ARG N N 19 122.242 122.242 121.303 0.939 25068
28 1 . 1 1 19 19 ARG HA H 19 3.437 3.437 4.497 -1.060 25068
29 1 . 1 1 19 19 ARG C C 19 175.409 175.409 174.423 0.986 25068
30 1 . 1 1 19 19 ARG CA C 19 57.545 57.545 55.480 2.065 25068
31 1 . 1 1 19 19 ARG CB C 19 31.149 31.149 30.761 0.388 25068
32 1 . 1 1 19 19 ARG H H 19 8.286 8.286 8.297 -0.011 25068
33 1 . 1 1 20 20 ALA N N 20 123.176 123.176 123.768 -0.592 25068
34 1 . 1 1 20 20 ALA HA H 20 4.139 4.139 4.562 -0.423 25068
35 1 . 1 1 20 20 ALA C C 20 177.843 177.843 176.579 1.264 25068
36 1 . 1 1 20 20 ALA CA C 20 52.391 52.391 51.400 0.991 25068
37 1 . 1 1 20 20 ALA CB C 20 19.397 19.397 20.187 -0.790 25068
38 1 . 1 1 20 20 ALA H H 20 7.348 7.348 8.304 -0.956 25068
39 1 . 1 1 21 21 LEU N N 21 125.680 125.680 121.435 4.245 25068
40 1 . 1 1 21 21 LEU HA H 21 4.194 4.194 4.231 -0.037 25068
41 1 . 1 1 21 21 LEU C C 21 177.091 177.091 176.662 0.429 25068
42 1 . 1 1 21 21 LEU CA C 21 55.472 55.472 54.763 0.709 25068
43 1 . 1 1 21 21 LEU CB C 21 43.931 43.931 42.945 0.986 25068
44 1 . 1 1 21 21 LEU H H 21 9.055 9.055 8.281 0.774 25068
45 1 . 1 1 22 22 SER N N 22 116.686 116.686 114.405 2.281 25068
46 1 . 1 1 22 22 SER HA H 22 4.427 4.427 4.606 -0.179 25068
47 1 . 1 1 22 22 SER C C 22 174.241 174.241 175.471 -1.230 25068
48 1 . 1 1 22 22 SER CA C 22 57.564 57.564 57.116 0.448 25068
49 1 . 1 1 22 22 SER CB C 22 66.568 66.568 64.859 1.709 25068
50 1 . 1 1 22 22 SER H H 22 7.549 7.549 8.023 -0.474 25068
51 1 . 1 1 23 23 ALA N N 23 123.382 123.382 125.154 -1.772 25068
52 1 . 1 1 23 23 ALA HA H 23 4.163 4.163 4.040 0.123 25068
53 1 . 1 1 23 23 ALA C C 23 178.863 178.863 179.180 -0.317 25068
54 1 . 1 1 23 23 ALA CA C 23 57.124 57.124 54.877 2.247 25068
55 1 . 1 1 23 23 ALA CB C 23 19.441 19.441 18.332 1.109 25068
56 1 . 1 1 23 23 ALA H H 23 9.035 9.035 8.888 0.147 25068
57 1 . 1 1 24 24 TYR N N 24 115.979 115.979 118.471 -2.492 25068
58 1 . 1 1 24 24 TYR HA H 24 2.590 2.590 4.403 -1.812 25068
59 1 . 1 1 24 24 TYR C C 24 176.257 176.257 177.854 -1.597 25068
60 1 . 1 1 24 24 TYR CA C 24 60.940 60.940 61.167 -0.228 25068
61 1 . 1 1 24 24 TYR CB C 24 39.106 39.106 38.057 1.049 25068
62 1 . 1 1 24 24 TYR H H 24 8.206 8.206 8.152 0.054 25068
63 1 . 1 1 25 25 MET N N 25 116.391 116.391 118.293 -1.901 25068
64 1 . 1 1 25 25 MET HA H 25 3.643 3.643 4.091 -0.448 25068
65 1 . 1 1 25 25 MET C C 25 180.177 180.177 178.232 1.945 25068
66 1 . 1 1 25 25 MET CA C 25 59.161 59.161 58.172 0.989 25068
67 1 . 1 1 25 25 MET CB C 25 32.748 32.748 31.889 0.859 25068
68 1 . 1 1 25 25 MET H H 25 7.433 7.433 7.916 -0.483 25068
69 1 . 1 1 26 26 PHE N N 26 118.699 118.699 120.348 -1.649 25068
70 1 . 1 1 26 26 PHE HA H 26 4.063 4.063 4.091 -0.028 25068
71 1 . 1 1 26 26 PHE C C 26 178.055 178.055 177.517 0.538 25068
72 1 . 1 1 26 26 PHE CA C 26 64.840 64.840 62.259 2.581 25068
73 1 . 1 1 26 26 PHE CB C 26 40.437 40.437 38.741 1.696 25068
74 1 . 1 1 26 26 PHE H H 26 7.982 7.982 8.310 -0.328 25068
75 1 . 1 1 27 27 TYR N N 27 123.888 123.888 119.076 4.812 25068
76 1 . 1 1 27 27 TYR HA H 27 3.576 3.576 4.120 -0.544 25068
77 1 . 1 1 27 27 TYR C C 27 176.691 176.691 177.556 -0.865 25068
78 1 . 1 1 27 27 TYR CA C 27 62.831 62.831 61.774 1.057 25068
79 1 . 1 1 27 27 TYR CB C 27 39.238 39.238 38.189 1.049 25068
80 1 . 1 1 27 27 TYR H H 27 7.843 7.843 8.105 -0.262 25068
81 1 . 1 1 28 28 VAL N N 28 119.501 119.501 118.704 0.797 25068
82 1 . 1 1 28 28 VAL HA H 28 2.912 2.912 3.390 -0.478 25068
83 1 . 1 1 28 28 VAL C C 28 177.067 177.067 177.747 -0.680 25068
84 1 . 1 1 28 28 VAL CA C 28 67.149 67.149 67.111 0.038 25068
85 1 . 1 1 28 28 VAL CB C 28 32.599 32.599 31.349 1.250 25068
86 1 . 1 1 28 28 VAL H H 28 8.370 8.370 7.916 0.454 25068
87 1 . 1 1 29 29 LYS N N 29 114.512 114.512 119.322 -4.810 25068
88 1 . 1 1 29 29 LYS HA H 29 3.676 3.676 3.830 -0.154 25068
89 1 . 1 1 29 29 LYS C C 29 178.627 178.627 178.723 -0.096 25068
90 1 . 1 1 29 29 LYS CA C 29 60.349 60.349 59.851 0.498 25068
91 1 . 1 1 29 29 LYS CB C 29 33.278 33.278 31.768 1.510 25068
92 1 . 1 1 29 29 LYS H H 29 6.821 6.821 8.278 -1.457 25068
93 1 . 1 1 30 30 ASP N N 30 116.793 116.793 120.765 -3.972 25068
94 1 . 1 1 30 30 ASP HA H 30 4.466 4.466 4.253 0.213 25068
95 1 . 1 1 30 30 ASP C C 30 178.615 178.615 178.430 0.185 25068
96 1 . 1 1 30 30 ASP CA C 30 57.223 57.223 57.378 -0.155 25068
97 1 . 1 1 30 30 ASP CB C 30 42.066 42.066 40.294 1.772 25068
98 1 . 1 1 30 30 ASP H H 30 6.875 6.875 8.097 -1.222 25068
99 1 . 1 1 31 31 LYS N N 31 122.423 122.423 120.045 2.378 25068
100 1 . 1 1 31 31 LYS HA H 31 3.813 3.813 3.890 -0.077 25068
101 1 . 1 1 31 31 LYS C C 31 178.443 178.443 178.943 -0.500 25068
102 1 . 1 1 31 31 LYS CA C 31 57.494 57.494 59.227 -1.733 25068
103 1 . 1 1 31 31 LYS CB C 31 32.539 32.539 32.277 0.262 25068
104 1 . 1 1 31 31 LYS H H 31 8.910 8.910 8.007 0.903 25068
105 1 . 1 1 32 32 ARG N N 32 117.823 117.823 119.361 -1.538 25068
106 1 . 1 1 32 32 ARG HA H 32 3.540 3.540 3.982 -0.442 25068
107 1 . 1 1 32 32 ARG C C 32 176.951 176.951 178.703 -1.752 25068
108 1 . 1 1 32 32 ARG CA C 32 61.259 61.259 59.508 1.751 25068
109 1 . 1 1 32 32 ARG CB C 32 30.668 30.668 30.081 0.586 25068
110 1 . 1 1 32 32 ARG H H 32 8.501 8.501 8.022 0.479 25068
111 1 . 1 1 33 33 LEU N N 33 114.878 114.878 119.784 -4.906 25068
112 1 . 1 1 33 33 LEU HA H 33 3.871 3.871 3.853 0.018 25068
113 1 . 1 1 33 33 LEU C C 33 179.180 179.180 179.215 -0.035 25068
114 1 . 1 1 33 33 LEU CA C 33 58.377 58.377 58.063 0.314 25068
115 1 . 1 1 33 33 LEU CB C 33 42.429 42.429 41.623 0.806 25068
116 1 . 1 1 33 33 LEU H H 33 6.549 6.549 8.229 -1.680 25068
117 1 . 1 1 34 34 GLU N N 34 118.637 118.637 119.285 -0.648 25068
118 1 . 1 1 34 34 GLU HA H 34 3.866 3.866 3.965 -0.099 25068
119 1 . 1 1 34 34 GLU C C 34 178.988 178.988 179.232 -0.244 25068
120 1 . 1 1 34 34 GLU CA C 34 60.248 60.248 59.563 0.685 25068
121 1 . 1 1 34 34 GLU CB C 34 31.325 31.325 29.498 1.827 25068
122 1 . 1 1 34 34 GLU H H 34 7.135 7.135 7.982 -0.847 25068
123 1 . 1 1 35 35 ILE N N 35 119.142 119.142 119.844 -0.702 25068
124 1 . 1 1 35 35 ILE HA H 35 3.693 3.693 3.846 -0.153 25068
125 1 . 1 1 35 35 ILE C C 35 177.789 177.789 178.749 -0.960 25068
126 1 . 1 1 35 35 ILE CA C 35 65.753 65.753 65.267 0.486 25068
127 1 . 1 1 35 35 ILE CB C 35 38.940 38.940 37.872 1.068 25068
128 1 . 1 1 35 35 ILE H H 35 8.076 8.076 8.198 -0.122 25068
129 1 . 1 1 36 36 ILE N N 36 116.296 116.296 118.557 -2.261 25068
130 1 . 1 1 36 36 ILE HA H 36 3.640 3.640 3.998 -0.358 25068
131 1 . 1 1 36 36 ILE C C 36 177.270 177.270 177.395 -0.125 25068
132 1 . 1 1 36 36 ILE CA C 36 64.633 64.633 63.888 0.746 25068
133 1 . 1 1 36 36 ILE CB C 36 38.718 38.718 38.023 0.695 25068
134 1 . 1 1 36 36 ILE H H 36 7.754 7.754 8.028 -0.274 25068
135 1 . 1 1 37 37 LYS N N 37 119.626 119.626 119.519 0.107 25068
136 1 . 1 1 37 37 LYS HA H 37 3.922 3.922 4.110 -0.188 25068
137 1 . 1 1 37 37 LYS C C 37 178.129 178.129 177.957 0.172 25068
138 1 . 1 1 37 37 LYS CA C 37 59.996 59.996 58.694 1.302 25068
139 1 . 1 1 37 37 LYS CB C 37 33.487 33.487 32.747 0.740 25068
140 1 . 1 1 37 37 LYS H H 37 7.413 7.413 7.893 -0.480 25068
141 1 . 1 1 38 38 GLU N N 38 116.708 116.708 116.731 -0.023 25068
142 1 . 1 1 38 38 GLU HA H 38 4.060 4.060 4.285 -0.225 25068
143 1 . 1 1 38 38 GLU C C 38 177.004 177.004 177.117 -0.113 25068
144 1 . 1 1 38 38 GLU CA C 38 59.070 59.070 57.521 1.549 25068
145 1 . 1 1 38 38 GLU CB C 38 31.665 31.665 30.675 0.990 25068
146 1 . 1 1 38 38 GLU H H 38 7.354 7.354 8.072 -0.718 25068
147 1 . 1 1 39 39 LYS N N 39 118.621 118.621 119.883 -1.262 25068
148 1 . 1 1 39 39 LYS HA H 39 4.690 4.690 4.798 -0.108 25068
149 1 . 1 1 39 39 LYS C C 39 172.792 172.792 174.839 -2.047 25068
150 1 . 1 1 39 39 LYS CA C 39 54.596 54.596 53.189 1.407 25068
151 1 . 1 1 39 39 LYS CB C 39 33.945 33.945 33.687 0.257 25068
152 1 . 1 1 39 39 LYS H H 39 8.176 8.176 7.728 0.447 25068
153 1 . 1 1 40 40 PRO HA H 40 4.429 4.429 4.366 0.063 25068
154 1 . 1 1 40 40 PRO C C 40 179.829 179.829 177.977 1.852 25068
155 1 . 1 1 40 40 PRO CA C 40 66.040 66.040 64.579 1.461 25068
156 1 . 1 1 40 40 PRO CB C 40 32.606 32.606 31.949 0.657 25068
157 1 . 1 1 41 41 GLU N N 41 119.150 119.150 119.924 -0.774 25068
158 1 . 1 1 41 41 GLU HA H 41 4.143 4.143 4.185 -0.042 25068
159 1 . 1 1 41 41 GLU C C 41 178.502 178.502 178.018 0.485 25068
160 1 . 1 1 41 41 GLU CA C 41 59.485 59.485 58.853 0.632 25068
161 1 . 1 1 41 41 GLU CB C 41 28.574 28.574 29.349 -0.775 25068
162 1 . 1 1 41 41 GLU H H 41 9.789 9.789 8.730 1.059 25068
163 1 . 1 1 42 42 LEU N N 42 121.443 121.443 119.613 1.830 25068
164 1 . 1 1 42 42 LEU HA H 42 4.185 4.185 4.623 -0.438 25068
165 1 . 1 1 42 42 LEU C C 42 177.815 177.815 177.795 0.020 25068
166 1 . 1 1 42 42 LEU CA C 42 56.730 56.730 54.553 2.176 25068
167 1 . 1 1 42 42 LEU CB C 42 42.013 42.013 41.736 0.277 25068
168 1 . 1 1 42 42 LEU H H 42 8.312 8.312 7.616 0.696 25068
169 1 . 1 1 43 43 ALA N N 43 119.949 119.949 122.208 -2.259 25068
170 1 . 1 1 43 43 ALA HA H 43 3.746 3.746 4.016 -0.270 25068
171 1 . 1 1 43 43 ALA C C 43 178.635 178.635 177.850 0.785 25068
172 1 . 1 1 43 43 ALA CA C 43 56.164 56.164 54.411 1.753 25068
173 1 . 1 1 43 43 ALA CB C 43 19.670 19.670 18.550 1.120 25068
174 1 . 1 1 43 43 ALA H H 43 7.554 7.554 7.525 0.029 25068
175 1 . 1 1 44 44 LYS N N 44 112.690 112.690 116.189 -3.499 25068
176 1 . 1 1 44 44 LYS HA H 44 4.232 4.232 4.407 -0.175 25068
177 1 . 1 1 44 44 LYS C C 44 175.949 175.949 175.702 0.247 25068
178 1 . 1 1 44 44 LYS CA C 44 56.987 56.987 55.442 1.545 25068
179 1 . 1 1 44 44 LYS CB C 44 33.345 33.345 32.036 1.309 25068
180 1 . 1 1 44 44 LYS H H 44 7.560 7.560 7.870 -0.310 25068
181 1 . 1 1 45 45 ASP N N 45 122.529 122.529 122.081 0.448 25068
182 1 . 1 1 45 45 ASP HA H 45 4.749 4.749 4.885 -0.136 25068
183 1 . 1 1 45 45 ASP C C 45 174.677 174.677 176.033 -1.356 25068
184 1 . 1 1 45 45 ASP CA C 45 53.030 53.030 52.832 0.198 25068
185 1 . 1 1 45 45 ASP CB C 45 41.549 41.549 40.455 1.094 25068
186 1 . 1 1 45 45 ASP H H 45 7.672 7.672 8.040 -0.368 25068
187 1 . 1 1 46 46 VAL N N 46 121.529 121.529 123.065 -1.536 25068
188 1 . 1 1 46 46 VAL HA H 46 3.639 3.639 3.567 0.072 25068
189 1 . 1 1 46 46 VAL C C 46 179.102 179.102 177.521 1.581 25068
190 1 . 1 1 46 46 VAL CA C 46 66.430 66.430 66.409 0.021 25068
191 1 . 1 1 46 46 VAL CB C 46 32.650 32.650 31.706 0.944 25068
192 1 . 1 1 46 46 VAL H H 46 7.808 7.808 8.168 -0.360 25068
193 1 . 1 1 47 47 ALA N N 47 123.933 123.933 120.749 3.184 25068
194 1 . 1 1 47 47 ALA HA H 47 4.112 4.112 3.962 0.150 25068
195 1 . 1 1 47 47 ALA C C 47 180.665 180.665 179.637 1.028 25068
196 1 . 1 1 47 47 ALA CA C 47 55.822 55.822 55.167 0.655 25068
197 1 . 1 1 47 47 ALA CB C 47 19.129 19.129 18.078 1.050 25068
198 1 . 1 1 47 47 ALA H H 47 8.505 8.505 8.215 0.290 25068
199 1 . 1 1 48 48 GLN N N 48 120.047 120.047 118.872 1.175 25068
200 1 . 1 1 48 48 GLN HA H 48 4.033 4.033 4.087 -0.054 25068
201 1 . 1 1 48 48 GLN C C 48 178.486 178.486 178.195 0.291 25068
202 1 . 1 1 48 48 GLN CA C 48 59.436 59.436 58.415 1.021 25068
203 1 . 1 1 48 48 GLN CB C 48 29.436 29.436 28.193 1.243 25068
204 1 . 1 1 48 48 GLN H H 48 7.852 7.852 7.793 0.058 25068
205 1 . 1 1 49 49 VAL N N 49 119.185 119.185 116.781 2.404 25068
206 1 . 1 1 49 49 VAL HA H 49 3.424 3.424 3.600 -0.176 25068
207 1 . 1 1 49 49 VAL C C 49 177.519 177.519 178.026 -0.507 25068
208 1 . 1 1 49 49 VAL CA C 49 68.854 68.854 66.197 2.657 25068
209 1 . 1 1 49 49 VAL CB C 49 32.454 32.454 30.773 1.681 25068
210 1 . 1 1 49 49 VAL H H 49 7.984 7.984 7.996 -0.012 25068
211 1 . 1 1 50 50 GLY N N 50 104.919 104.919 108.237 -3.318 25068
212 1 . 1 1 50 50 GLY C C 50 176.825 176.825 175.919 0.906 25068
213 1 . 1 1 50 50 GLY CA C 50 48.398 48.398 47.384 1.014 25068
214 1 . 1 1 50 50 GLY H H 50 8.020 8.020 8.385 -0.365 25068
215 1 . 1 1 51 51 LYS N N 51 123.422 123.422 122.746 0.676 25068
216 1 . 1 1 51 51 LYS HA H 51 4.032 4.032 4.088 -0.056 25068
217 1 . 1 1 51 51 LYS C C 51 179.332 179.332 179.112 0.220 25068
218 1 . 1 1 51 51 LYS CA C 51 60.246 60.246 58.932 1.313 25068
219 1 . 1 1 51 51 LYS CB C 51 33.626 33.626 32.070 1.556 25068
220 1 . 1 1 51 51 LYS H H 51 7.699 7.699 7.904 -0.205 25068
221 1 . 1 1 52 52 LEU N N 52 120.442 120.442 120.517 -0.076 25068
222 1 . 1 1 52 52 LEU HA H 52 4.041 4.041 4.059 -0.018 25068
223 1 . 1 1 52 52 LEU C C 52 180.984 180.984 179.011 1.973 25068
224 1 . 1 1 52 52 LEU CA C 52 58.855 58.855 57.952 0.903 25068
225 1 . 1 1 52 52 LEU CB C 52 43.046 43.046 41.632 1.414 25068
226 1 . 1 1 52 52 LEU H H 52 8.088 8.088 7.888 0.200 25068
227 1 . 1 1 53 53 ILE N N 53 121.249 121.249 119.259 1.990 25068
228 1 . 1 1 53 53 ILE HA H 53 3.557 3.557 3.832 -0.275 25068
229 1 . 1 1 53 53 ILE C C 53 177.945 177.945 178.670 -0.725 25068
230 1 . 1 1 53 53 ILE CA C 53 67.431 67.431 62.986 4.445 25068
231 1 . 1 1 53 53 ILE CB C 53 38.887 38.887 36.145 2.742 25068
232 1 . 1 1 53 53 ILE H H 53 8.475 8.475 8.136 0.339 25068
233 1 . 1 1 54 54 GLY N N 54 107.755 107.755 108.015 -0.260 25068
234 1 . 1 1 54 54 GLY C C 54 177.691 177.691 176.334 1.357 25068
235 1 . 1 1 54 54 GLY CA C 54 48.997 48.997 47.537 1.460 25068
236 1 . 1 1 54 54 GLY H H 54 8.130 8.130 8.471 -0.341 25068
237 1 . 1 1 55 55 GLU N N 55 122.138 122.138 122.455 -0.317 25068
238 1 . 1 1 55 55 GLU HA H 55 4.032 4.032 3.951 0.081 25068
239 1 . 1 1 55 55 GLU C C 55 179.146 179.146 179.022 0.124 25068
240 1 . 1 1 55 55 GLU CA C 55 59.958 59.958 59.310 0.648 25068
241 1 . 1 1 55 55 GLU CB C 55 30.551 30.551 29.478 1.073 25068
242 1 . 1 1 55 55 GLU H H 55 8.089 8.089 8.221 -0.132 25068
243 1 . 1 1 56 56 ALA N N 56 122.985 122.985 121.961 1.023 25068
244 1 . 1 1 56 56 ALA HA H 56 4.107 4.107 4.140 -0.033 25068
245 1 . 1 1 56 56 ALA C C 56 181.177 181.177 179.393 1.783 25068
246 1 . 1 1 56 56 ALA CA C 56 56.414 56.414 54.902 1.512 25068
247 1 . 1 1 56 56 ALA CB C 56 19.948 19.948 18.349 1.599 25068
248 1 . 1 1 56 56 ALA H H 56 7.947 7.947 8.221 -0.274 25068
249 1 . 1 1 57 57 TRP N N 57 120.485 120.485 120.920 -0.435 25068
250 1 . 1 1 57 57 TRP HA H 57 3.940 3.940 4.305 -0.365 25068
251 1 . 1 1 57 57 TRP C C 57 178.537 178.537 178.970 -0.433 25068
252 1 . 1 1 57 57 TRP CA C 57 60.633 60.633 59.617 1.016 25068
253 1 . 1 1 57 57 TRP CB C 57 31.681 31.681 29.453 2.228 25068
254 1 . 1 1 57 57 TRP H H 57 8.910 8.910 8.217 0.693 25068
255 1 . 1 1 58 58 GLY N N 58 102.004 102.004 106.920 -4.917 25068
256 1 . 1 1 58 58 GLY C C 58 174.723 174.723 175.205 -0.482 25068
257 1 . 1 1 58 58 GLY CA C 58 47.091 47.091 46.390 0.700 25068
258 1 . 1 1 58 58 GLY H H 58 7.668 7.668 8.126 -0.458 25068
259 1 . 1 1 59 59 GLN N N 59 116.202 116.202 117.541 -1.339 25068
260 1 . 1 1 59 59 GLN HA H 59 4.259 4.259 4.242 0.017 25068
261 1 . 1 1 59 59 GLN C C 59 176.221 176.221 176.174 0.047 25068
262 1 . 1 1 59 59 GLN CA C 59 55.967 55.967 55.222 0.745 25068
263 1 . 1 1 59 59 GLN CB C 59 30.741 30.741 28.902 1.839 25068
264 1 . 1 1 59 59 GLN H H 59 7.189 7.189 7.822 -0.633 25068
265 1 . 1 1 60 60 LEU N N 60 120.776 120.776 122.236 -1.460 25068
266 1 . 1 1 60 60 LEU HA H 60 4.185 4.185 4.214 -0.029 25068
267 1 . 1 1 60 60 LEU C C 60 177.372 177.372 176.517 0.855 25068
268 1 . 1 1 60 60 LEU CA C 60 56.061 56.061 55.509 0.552 25068
269 1 . 1 1 60 60 LEU CB C 60 43.696 43.696 42.602 1.094 25068
270 1 . 1 1 60 60 LEU H H 60 6.968 6.968 7.467 -0.499 25068
271 1 . 1 1 61 61 SER N N 61 120.432 120.432 118.413 2.019 25068
272 1 . 1 1 61 61 SER HA H 61 4.582 4.582 4.672 -0.090 25068
273 1 . 1 1 61 61 SER C C 61 173.500 173.500 174.023 -0.523 25068
274 1 . 1 1 61 61 SER CA C 61 57.204 57.204 56.833 0.371 25068
275 1 . 1 1 61 61 SER CB C 61 63.980 63.980 63.665 0.316 25068
276 1 . 1 1 61 61 SER H H 61 8.885 8.885 8.264 0.621 25068
277 1 . 1 1 63 63 ALA HA H 63 4.089 4.089 4.152 -0.063 25068
278 1 . 1 1 63 63 ALA C C 63 180.570 180.570 179.039 1.531 25068
279 1 . 1 1 63 63 ALA CA C 63 56.005 56.005 54.673 1.332 25068
280 1 . 1 1 63 63 ALA CB C 63 19.317 19.317 18.177 1.140 25068
281 1 . 1 1 64 64 GLN N N 64 116.774 116.774 116.704 0.070 25068
282 1 . 1 1 64 64 GLN HA H 64 4.122 4.122 4.267 -0.145 25068
283 1 . 1 1 64 64 GLN C C 64 178.275 178.275 178.244 0.031 25068
284 1 . 1 1 64 64 GLN CA C 64 58.622 58.622 57.895 0.727 25068
285 1 . 1 1 64 64 GLN CB C 64 31.350 31.350 28.823 2.527 25068
286 1 . 1 1 64 64 GLN H H 64 7.603 7.603 7.979 -0.376 25068
287 1 . 1 1 65 65 LYS N N 65 117.203 117.203 120.433 -3.230 25068
288 1 . 1 1 65 65 LYS HA H 65 4.129 4.129 4.148 -0.019 25068
289 1 . 1 1 65 65 LYS C C 65 178.449 178.449 178.807 -0.358 25068
290 1 . 1 1 65 65 LYS CA C 65 59.891 59.891 59.007 0.884 25068
291 1 . 1 1 65 65 LYS CB C 65 34.351 34.351 32.221 2.130 25068
292 1 . 1 1 65 65 LYS H H 65 7.810 7.810 7.804 0.005 25068
293 1 . 1 1 66 66 ALA N N 66 122.218 122.218 122.528 -0.310 25068
294 1 . 1 1 66 66 ALA HA H 66 4.290 4.290 4.226 0.064 25068
295 1 . 1 1 66 66 ALA C C 66 176.135 176.135 176.712 -0.577 25068
296 1 . 1 1 66 66 ALA CA C 66 57.745 57.745 56.878 0.867 25068
297 1 . 1 1 66 66 ALA CB C 66 17.033 17.033 16.376 0.657 25068
298 1 . 1 1 66 66 ALA H H 66 7.469 7.469 8.336 -0.867 25068
299 1 . 1 1 67 67 PRO HA H 67 4.142 4.142 4.337 -0.195 25068
300 1 . 1 1 67 67 PRO C C 67 179.591 179.591 178.820 0.771 25068
301 1 . 1 1 67 67 PRO CA C 67 66.960 66.960 65.639 1.321 25068
302 1 . 1 1 67 67 PRO CB C 67 32.014 32.014 31.465 0.549 25068
303 1 . 1 1 68 68 TYR N N 68 117.140 117.140 120.106 -2.966 25068
304 1 . 1 1 68 68 TYR HA H 68 3.940 3.940 4.035 -0.095 25068
305 1 . 1 1 68 68 TYR C C 68 177.733 177.733 178.128 -0.395 25068
306 1 . 1 1 68 68 TYR CA C 68 63.505 63.505 61.846 1.659 25068
307 1 . 1 1 68 68 TYR CB C 68 38.503 38.503 38.131 0.372 25068
308 1 . 1 1 68 68 TYR H H 68 7.268 7.268 8.405 -1.137 25068
309 1 . 1 1 69 69 GLU N N 69 120.747 120.747 118.399 2.348 25068
310 1 . 1 1 69 69 GLU HA H 69 4.253 4.253 4.019 0.234 25068
311 1 . 1 1 69 69 GLU C C 69 179.805 179.805 178.966 0.839 25068
312 1 . 1 1 69 69 GLU CA C 69 60.145 60.145 59.575 0.570 25068
313 1 . 1 1 69 69 GLU CB C 69 29.808 29.808 29.393 0.416 25068
314 1 . 1 1 69 69 GLU H H 69 8.048 8.048 8.607 -0.559 25068
315 1 . 1 1 70 70 LYS N N 70 120.938 120.938 120.376 0.562 25068
316 1 . 1 1 70 70 LYS HA H 70 4.020 4.020 3.973 0.047 25068
317 1 . 1 1 70 70 LYS C C 70 178.740 178.740 179.106 -0.366 25068
318 1 . 1 1 70 70 LYS CA C 70 60.202 60.202 59.613 0.589 25068
319 1 . 1 1 70 70 LYS CB C 70 32.419 32.419 32.304 0.114 25068
320 1 . 1 1 70 70 LYS H H 70 8.301 8.301 8.139 0.162 25068
321 1 . 1 1 71 71 LYS N N 71 118.427 118.427 118.478 -0.051 25068
322 1 . 1 1 71 71 LYS HA H 71 3.528 3.528 4.029 -0.501 25068
323 1 . 1 1 71 71 LYS C C 71 179.280 179.280 178.829 0.451 25068
324 1 . 1 1 71 71 LYS CA C 71 61.146 61.146 59.038 2.108 25068
325 1 . 1 1 71 71 LYS CB C 71 32.196 32.196 32.011 0.185 25068
326 1 . 1 1 71 71 LYS H H 71 7.234 7.234 8.293 -1.059 25068
327 1 . 1 1 72 72 ALA N N 72 122.126 122.126 122.033 0.093 25068
328 1 . 1 1 72 72 ALA HA H 72 4.357 4.357 3.935 0.422 25068
329 1 . 1 1 72 72 ALA C C 72 180.468 180.468 179.832 0.636 25068
330 1 . 1 1 72 72 ALA CA C 72 56.457 56.457 55.161 1.296 25068
331 1 . 1 1 72 72 ALA CB C 72 19.562 19.562 17.893 1.669 25068
332 1 . 1 1 72 72 ALA H H 72 7.890 7.890 7.957 -0.067 25068
333 1 . 1 1 73 73 GLN N N 73 121.659 121.659 119.055 2.604 25068
334 1 . 1 1 73 73 GLN HA H 73 4.029 4.029 4.034 -0.005 25068
335 1 . 1 1 73 73 GLN C C 73 179.576 179.576 178.255 1.321 25068
336 1 . 1 1 73 73 GLN CA C 73 60.427 60.427 58.752 1.675 25068
337 1 . 1 1 73 73 GLN CB C 73 28.732 28.732 28.643 0.089 25068
338 1 . 1 1 73 73 GLN H H 73 8.353 8.353 8.118 0.235 25068
339 1 . 1 1 74 74 LEU N N 74 119.752 119.752 120.673 -0.921 25068
340 1 . 1 1 74 74 LEU HA H 74 4.046 4.046 3.859 0.187 25068
341 1 . 1 1 74 74 LEU C C 74 180.424 180.424 179.284 1.140 25068
342 1 . 1 1 74 74 LEU CA C 74 58.675 58.675 58.349 0.326 25068
343 1 . 1 1 74 74 LEU CB C 74 42.376 42.376 41.566 0.810 25068
344 1 . 1 1 74 74 LEU H H 74 8.160 8.160 8.246 -0.086 25068
345 1 . 1 1 75 75 ASP N N 75 122.159 122.159 118.755 3.404 25068
346 1 . 1 1 75 75 ASP HA H 75 4.988 4.988 4.359 0.629 25068
347 1 . 1 1 75 75 ASP C C 75 178.046 178.046 178.596 -0.550 25068
348 1 . 1 1 75 75 ASP CA C 75 58.191 58.191 57.616 0.575 25068
349 1 . 1 1 75 75 ASP CB C 75 42.958 42.958 40.446 2.512 25068
350 1 . 1 1 75 75 ASP H H 75 8.361 8.361 8.535 -0.173 25068
351 1 . 1 1 76 76 LYS N N 76 119.861 119.861 121.099 -1.238 25068
352 1 . 1 1 76 76 LYS HA H 76 3.988 3.988 4.046 -0.058 25068
353 1 . 1 1 76 76 LYS C C 76 179.668 179.668 178.948 0.720 25068
354 1 . 1 1 76 76 LYS CA C 76 60.984 60.984 59.574 1.410 25068
355 1 . 1 1 76 76 LYS CB C 76 33.124 33.124 32.433 0.691 25068
356 1 . 1 1 76 76 LYS H H 76 7.940 7.940 7.743 0.197 25068
357 1 . 1 1 77 77 VAL N N 77 121.485 121.485 119.263 2.222 25068
358 1 . 1 1 77 77 VAL HA H 77 3.687 3.687 3.658 0.029 25068
359 1 . 1 1 77 77 VAL C C 77 178.070 178.070 177.696 0.374 25068
360 1 . 1 1 77 77 VAL CA C 77 67.359 67.359 66.131 1.228 25068
361 1 . 1 1 77 77 VAL CB C 77 32.645 32.645 31.572 1.074 25068
362 1 . 1 1 77 77 VAL H H 77 7.401 7.401 8.257 -0.856 25068
363 1 . 1 1 78 78 ARG N N 78 121.960 121.960 120.041 1.919 25068
364 1 . 1 1 78 78 ARG HA H 78 4.010 4.010 3.944 0.066 25068
365 1 . 1 1 78 78 ARG C C 78 179.144 179.144 178.593 0.551 25068
366 1 . 1 1 78 78 ARG CA C 78 60.598 60.598 59.936 0.662 25068
367 1 . 1 1 78 78 ARG CB C 78 28.352 28.352 30.040 -1.688 25068
368 1 . 1 1 78 78 ARG H H 78 7.813 7.813 8.150 -0.337 25068
369 1 . 1 1 79 79 TYR N N 79 120.411 120.411 120.361 0.050 25068
370 1 . 1 1 79 79 TYR HA H 79 3.878 3.878 4.254 -0.376 25068
371 1 . 1 1 79 79 TYR C C 79 176.080 176.080 177.499 -1.419 25068
372 1 . 1 1 79 79 TYR CA C 79 63.669 63.669 59.950 3.719 25068
373 1 . 1 1 79 79 TYR CB C 79 39.758 39.758 38.174 1.584 25068
374 1 . 1 1 79 79 TYR H H 79 8.608 8.608 8.559 0.049 25068
375 1 . 1 1 80 80 SER N N 80 113.726 113.726 114.529 -0.803 25068
376 1 . 1 1 80 80 SER HA H 80 3.880 3.880 3.762 0.118 25068
377 1 . 1 1 80 80 SER C C 80 176.794 176.794 176.763 0.031 25068
378 1 . 1 1 80 80 SER CA C 80 62.969 62.969 62.023 0.946 25068
379 1 . 1 1 80 80 SER CB C 80 63.605 63.605 62.915 0.690 25068
380 1 . 1 1 80 80 SER H H 80 8.234 8.234 8.189 0.045 25068
381 1 . 1 1 81 81 LYS N N 81 121.920 121.920 120.853 1.067 25068
382 1 . 1 1 81 81 LYS HA H 81 4.029 4.029 4.070 -0.041 25068
383 1 . 1 1 81 81 LYS C C 81 179.342 179.342 178.847 0.495 25068
384 1 . 1 1 81 81 LYS CA C 81 60.138 60.138 59.027 1.111 25068
385 1 . 1 1 81 81 LYS CB C 81 33.238 33.238 32.155 1.083 25068
386 1 . 1 1 81 81 LYS H H 81 7.958 7.958 8.036 -0.078 25068
387 1 . 1 1 82 82 GLU N N 82 119.515 119.515 119.721 -0.206 25068
388 1 . 1 1 82 82 GLU HA H 82 3.945 3.945 4.035 -0.090 25068
389 1 . 1 1 82 82 GLU C C 82 180.689 180.689 179.100 1.589 25068
390 1 . 1 1 82 82 GLU CA C 82 60.920 60.920 59.577 1.343 25068
391 1 . 1 1 82 82 GLU CB C 82 30.885 30.885 29.457 1.429 25068
392 1 . 1 1 82 82 GLU H H 82 8.310 8.310 7.961 0.349 25068
393 1 . 1 1 83 83 ILE N N 83 121.362 121.362 120.132 1.230 25068
394 1 . 1 1 83 83 ILE HA H 83 3.889 3.889 3.692 0.197 25068
395 1 . 1 1 83 83 ILE C C 83 177.207 177.207 177.774 -0.567 25068
396 1 . 1 1 83 83 ILE CA C 83 62.754 62.754 63.656 -0.902 25068
397 1 . 1 1 83 83 ILE CB C 83 37.651 37.651 37.838 -0.187 25068
398 1 . 1 1 83 83 ILE H H 83 8.887 8.887 8.008 0.879 25068
399 1 . 1 1 84 84 GLU N N 84 122.327 122.327 120.198 2.129 25068
400 1 . 1 1 84 84 GLU HA H 84 4.028 4.028 3.880 0.148 25068
401 1 . 1 1 84 84 GLU C C 84 179.047 179.047 179.147 -0.100 25068
402 1 . 1 1 84 84 GLU CA C 84 60.045 60.045 60.167 -0.122 25068
403 1 . 1 1 84 84 GLU CB C 84 30.099 30.099 29.220 0.879 25068
404 1 . 1 1 84 84 GLU H H 84 7.289 7.289 8.129 -0.840 25068
405 1 . 1 1 85 85 GLU N N 85 118.046 118.046 119.312 -1.266 25068
406 1 . 1 1 85 85 GLU HA H 85 3.966 3.966 4.053 -0.087 25068
407 1 . 1 1 85 85 GLU C C 85 178.614 178.614 179.312 -0.698 25068
408 1 . 1 1 85 85 GLU CA C 85 59.997 59.997 59.211 0.786 25068
409 1 . 1 1 85 85 GLU CB C 85 30.453 30.453 29.489 0.964 25068
410 1 . 1 1 85 85 GLU H H 85 7.545 7.545 8.162 -0.617 25068
411 1 . 1 1 86 86 TYR N N 86 121.050 121.050 119.400 1.650 25068
412 1 . 1 1 86 86 TYR HA H 86 4.094 4.094 4.257 -0.163 25068
413 1 . 1 1 86 86 TYR C C 86 177.815 177.815 178.088 -0.273 25068
414 1 . 1 1 86 86 TYR CA C 86 62.072 62.072 61.716 0.356 25068
415 1 . 1 1 86 86 TYR CB C 86 39.954 39.954 38.311 1.643 25068
416 1 . 1 1 86 86 TYR H H 86 8.277 8.277 8.315 -0.038 25068
417 1 . 1 1 87 87 ARG N N 87 118.353 118.353 118.246 0.106 25068
418 1 . 1 1 87 87 ARG HA H 87 3.877 3.877 3.972 -0.095 25068
419 1 . 1 1 87 87 ARG C C 87 178.067 178.067 178.766 -0.699 25068
420 1 . 1 1 87 87 ARG CA C 87 59.513 59.513 59.276 0.237 25068
421 1 . 1 1 87 87 ARG CB C 87 31.053 31.053 30.304 0.749 25068
422 1 . 1 1 87 87 ARG H H 87 8.249 8.249 8.437 -0.188 25068
423 1 . 1 1 88 88 LYS N N 88 118.205 118.205 118.525 -0.320 25068
424 1 . 1 1 88 88 LYS HA H 88 3.982 3.982 4.088 -0.106 25068
425 1 . 1 1 88 88 LYS C C 88 178.050 178.050 177.567 0.483 25068
426 1 . 1 1 88 88 LYS CA C 88 59.265 59.265 58.719 0.546 25068
427 1 . 1 1 88 88 LYS CB C 88 33.499 33.499 32.645 0.854 25068
428 1 . 1 1 88 88 LYS H H 88 7.465 7.465 7.941 -0.476 25068
429 1 . 1 1 89 89 LYS N N 89 118.341 118.341 114.683 3.658 25068
430 1 . 1 1 89 89 LYS HA H 89 4.084 4.084 4.465 -0.381 25068
431 1 . 1 1 89 89 LYS C C 89 176.691 176.691 175.965 0.726 25068
432 1 . 1 1 89 89 LYS CA C 89 58.188 58.188 55.625 2.563 25068
433 1 . 1 1 89 89 LYS CB C 89 33.809 33.809 32.121 1.687 25068
434 1 . 1 1 89 89 LYS H H 89 7.580 7.580 7.757 -0.177 25068
435 1 . 1 1 90 90 ASN N N 90 117.604 117.604 119.132 -1.528 25068
436 1 . 1 1 90 90 ASN HA H 90 4.563 4.563 4.825 -0.262 25068
437 1 . 1 1 90 90 ASN C C 90 174.419 174.419 174.919 -0.500 25068
438 1 . 1 1 90 90 ASN CA C 90 54.433 54.433 53.714 0.719 25068
439 1 . 1 1 90 90 ASN CB C 90 40.182 40.182 40.241 -0.059 25068
440 1 . 1 1 90 90 ASN H H 90 7.741 7.741 7.842 -0.102 25068
441 1 . 1 1 91 91 GLN N N 91 111.990 111.990 120.261 -8.271 25068
442 1 . 1 1 91 91 GLN HA H 91 4.213 4.213 4.463 -0.250 25068
443 1 . 1 1 91 91 GLN C C 91 174.970 174.970 175.538 -0.568 25068
444 1 . 1 1 91 91 GLN CA C 91 57.011 57.011 55.490 1.521 25068
445 1 . 1 1 91 91 GLN CB C 91 30.358 30.358 29.329 1.029 25068
446 1 . 1 1 91 91 GLN H H 91 7.925 7.925 8.030 -0.105 25068
stop_
save_