data_25699
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25699
_Entry.PDB_ID 2N58
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 25699
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.493 -0.414 25699
2 1 1 . 1 1 2 2 ALA CA C 2 52.826 52.826 51.319 1.507 25699
3 1 1 . 1 1 2 2 ALA CB C 2 21.988 21.988 20.665 1.323 25699
4 1 1 . 1 1 2 2 ALA H H 2 8.067 8.067 7.936 0.131 25699
5 1 1 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.263 -0.231 25699
6 1 1 . 1 1 3 3 GLU CB C 3 29.563 29.563 29.801 -0.238 25699
7 1 1 . 1 1 3 3 GLU H H 3 8.592 8.592 8.459 0.133 25699
8 1 1 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.079 0.051 25699
9 1 1 . 1 1 4 4 LYS CA C 4 56.839 56.839 59.320 -2.481 25699
10 1 1 . 1 1 4 4 LYS CB C 4 32.806 32.806 32.592 0.214 25699
11 1 1 . 1 1 4 4 LYS H H 4 8.205 8.205 7.923 0.282 25699
12 1 1 . 1 1 5 5 VAL HA H 5 3.868 3.868 3.773 0.095 25699
13 1 1 . 1 1 5 5 VAL CA C 5 62.947 62.947 64.805 -1.858 25699
14 1 1 . 1 1 5 5 VAL CB C 5 32.536 32.536 31.213 1.323 25699
15 1 1 . 1 1 5 5 VAL H H 5 7.807 7.807 8.215 -0.408 25699
16 1 1 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.119 -0.041 25699
17 1 1 . 1 1 6 6 ALA CA C 6 53.076 53.076 55.321 -2.245 25699
18 1 1 . 1 1 6 6 ALA CB C 6 19.007 19.007 18.534 0.473 25699
19 1 1 . 1 1 6 6 ALA H H 6 8.101 8.101 8.359 -0.258 25699
20 1 1 . 1 1 7 7 GLN HA H 7 4.072 4.072 3.992 0.080 25699
21 1 1 . 1 1 7 7 GLN CB C 7 29.413 29.413 28.031 1.382 25699
22 1 1 . 1 1 7 7 GLN H H 7 8.065 8.065 7.883 0.182 25699
23 1 1 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.036 0.044 25699
24 1 1 . 1 1 8 8 GLU CA C 8 56.439 56.439 58.527 -2.088 25699
25 1 1 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.334 0.219 25699
26 1 1 . 1 1 8 8 GLU H H 8 8.182 8.182 7.791 0.391 25699
27 1 1 . 1 1 9 9 LYS HA H 9 4.007 4.007 4.039 -0.032 25699
28 1 1 . 1 1 9 9 LYS CA C 9 57.773 57.773 57.474 0.299 25699
29 1 1 . 1 1 9 9 LYS CB C 9 32.979 32.979 33.101 -0.122 25699
30 1 1 . 1 1 9 9 LYS H H 9 8.048 8.048 7.479 0.569 25699
31 1 1 . 1 1 10 10 GLY CA C 10 45.562 45.562 45.209 0.353 25699
32 1 1 . 1 1 10 10 GLY H H 10 8.305 8.305 7.518 0.787 25699
33 1 1 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.826 -0.742 25699
34 1 1 . 1 1 11 11 PHE CB C 11 39.831 39.831 40.208 -0.377 25699
35 1 1 . 1 1 11 11 PHE H H 11 8.761 8.761 8.316 0.445 25699
36 1 1 . 1 1 12 12 LEU HA H 12 3.776 3.776 4.081 -0.305 25699
37 1 1 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.680 0.432 25699
38 1 1 . 1 1 12 12 LEU CB C 12 41.197 41.197 41.258 -0.061 25699
39 1 1 . 1 1 12 12 LEU H H 12 8.728 8.728 8.172 0.556 25699
40 1 1 . 1 1 13 13 TYR HA H 13 4.042 4.042 4.112 -0.070 25699
41 1 1 . 1 1 13 13 TYR CA C 13 61.091 61.091 61.062 0.029 25699
42 1 1 . 1 1 13 13 TYR CB C 13 37.856 37.856 37.987 -0.131 25699
43 1 1 . 1 1 13 13 TYR H H 13 8.199 8.199 8.147 0.052 25699
44 1 1 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.720 0.054 25699
45 1 1 . 1 1 14 14 ARG CA C 14 59.719 59.719 58.038 1.681 25699
46 1 1 . 1 1 14 14 ARG H H 14 8.047 8.047 7.602 0.445 25699
47 1 1 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.174 -0.307 25699
48 1 1 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.492 3.626 25699
49 1 1 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.621 2.678 25699
50 1 1 . 1 1 15 15 LEU H H 15 8.048 8.048 7.152 0.896 25699
51 1 1 . 1 1 16 16 THR HA H 16 4.079 4.079 4.564 -0.485 25699
52 1 1 . 1 1 16 16 THR CA C 16 61.604 61.604 59.823 1.781 25699
53 1 1 . 1 1 16 16 THR CB C 16 66.014 66.014 71.730 -5.716 25699
54 1 1 . 1 1 16 16 THR H H 16 7.825 7.825 7.955 -0.130 25699
55 1 1 . 1 1 17 17 SER HA H 17 3.925 3.925 4.033 -0.108 25699
56 1 1 . 1 1 17 17 SER CA C 17 61.613 61.613 61.681 -0.068 25699
57 1 1 . 1 1 17 17 SER CB C 17 62.836 62.836 63.171 -0.335 25699
58 1 1 . 1 1 17 17 SER H H 17 7.824 7.824 8.696 -0.872 25699
59 1 1 . 1 1 18 18 ARG HA H 18 3.997 3.997 3.728 0.269 25699
60 1 1 . 1 1 18 18 ARG CA C 18 58.150 58.150 59.363 -1.213 25699
61 1 1 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.540 0.526 25699
62 1 1 . 1 1 18 18 ARG H H 18 7.580 7.580 8.569 -0.989 25699
63 1 1 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.189 0.069 25699
64 1 1 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.277 -0.780 25699
65 1 1 . 1 1 19 19 TYR H H 19 7.816 7.816 7.601 0.215 25699
66 1 1 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.798 -0.080 25699
67 1 1 . 1 1 20 20 ARG CA C 20 58.939 58.939 59.383 -0.444 25699
68 1 1 . 1 1 20 20 ARG CB C 20 30.009 30.009 29.971 0.038 25699
69 1 1 . 1 1 20 20 ARG H H 20 7.864 7.864 8.119 -0.255 25699
70 1 1 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.238 0.108 25699
71 1 1 . 1 1 21 21 HIS CA C 21 57.378 57.378 59.061 -1.683 25699
72 1 1 . 1 1 21 21 HIS CB C 21 28.660 28.660 29.634 -0.974 25699
73 1 1 . 1 1 21 21 HIS H H 21 7.900 7.900 8.058 -0.158 25699
74 1 1 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.194 -0.003 25699
75 1 1 . 1 1 22 22 TYR CA C 22 59.853 59.853 60.239 -0.386 25699
76 1 1 . 1 1 22 22 TYR H H 22 7.680 7.680 7.685 -0.005 25699
77 1 1 . 1 1 23 23 ALA HA H 23 3.880 3.880 3.936 -0.056 25699
78 1 1 . 1 1 23 23 ALA CA C 23 53.293 53.293 53.967 -0.673 25699
79 1 1 . 1 1 23 23 ALA CB C 23 18.596 18.596 17.558 1.038 25699
80 1 1 . 1 1 23 23 ALA H H 23 8.030 8.030 7.491 0.539 25699
81 1 1 . 1 1 24 24 ALA HA H 24 4.025 4.025 3.966 0.059 25699
82 1 1 . 1 1 24 24 ALA CA C 24 52.985 52.985 53.978 -0.994 25699
83 1 1 . 1 1 24 24 ALA CB C 24 18.873 18.873 19.265 -0.392 25699
84 1 1 . 1 1 24 24 ALA H H 24 7.390 7.390 7.621 -0.231 25699
85 1 1 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.293 0.075 25699
86 1 1 . 1 1 25 25 PHE CA C 25 58.247 58.247 61.554 -3.307 25699
87 1 1 . 1 1 25 25 PHE CB C 25 39.360 39.360 38.930 0.430 25699
88 1 1 . 1 1 25 25 PHE H H 25 7.694 7.694 7.687 0.007 25699
89 1 1 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.102 -0.036 25699
90 1 1 . 1 1 26 26 GLU CA C 26 57.011 57.011 59.072 -2.061 25699
91 1 1 . 1 1 26 26 GLU CB C 26 30.081 30.081 29.321 0.760 25699
92 1 1 . 1 1 26 26 GLU H H 26 8.068 8.068 8.250 -0.182 25699
93 1 1 . 1 1 27 27 ARG HA H 27 4.095 4.095 2.577 1.518 25699
94 1 1 . 1 1 27 27 ARG CA C 27 56.260 56.260 53.906 2.354 25699
95 1 1 . 1 1 27 27 ARG CB C 27 30.799 30.799 28.944 1.855 25699
96 1 1 . 1 1 27 27 ARG H H 27 7.976 7.976 7.298 0.678 25699
97 1 1 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.109 0.062 25699
98 1 1 . 1 1 28 28 ALA CA C 28 52.581 52.581 54.229 -1.648 25699
99 1 1 . 1 1 28 28 ALA CB C 28 19.382 19.382 18.303 1.079 25699
100 1 1 . 1 1 28 28 ALA H H 28 8.012 8.012 7.339 0.673 25699
101 1 1 . 1 1 29 29 THR HA H 29 4.112 4.112 4.178 -0.066 25699
102 1 1 . 1 1 29 29 THR CA C 29 61.661 61.661 63.451 -1.790 25699
103 1 1 . 1 1 29 29 THR CB C 29 70.032 70.032 69.194 0.838 25699
104 1 1 . 1 1 29 29 THR H H 29 7.723 7.723 8.396 -0.673 25699
105 1 2 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.637 -0.558 25699
106 1 2 . 1 1 2 2 ALA CA C 2 52.826 52.826 51.881 0.945 25699
107 1 2 . 1 1 2 2 ALA CB C 2 21.988 21.988 21.562 0.426 25699
108 1 2 . 1 1 2 2 ALA H H 2 8.067 8.067 7.853 0.214 25699
109 1 2 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.402 -0.370 25699
110 1 2 . 1 1 3 3 GLU CB C 3 29.563 29.563 30.293 -0.730 25699
111 1 2 . 1 1 3 3 GLU H H 3 8.592 8.592 8.636 -0.044 25699
112 1 2 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.526 -0.396 25699
113 1 2 . 1 1 4 4 LYS CA C 4 56.839 56.839 56.359 0.480 25699
114 1 2 . 1 1 4 4 LYS CB C 4 32.806 32.806 33.020 -0.214 25699
115 1 2 . 1 1 4 4 LYS H H 4 8.205 8.205 8.181 0.024 25699
116 1 2 . 1 1 5 5 VAL HA H 5 3.868 3.868 4.098 -0.230 25699
117 1 2 . 1 1 5 5 VAL CA C 5 62.947 62.947 62.627 0.320 25699
118 1 2 . 1 1 5 5 VAL CB C 5 32.536 32.536 32.317 0.219 25699
119 1 2 . 1 1 5 5 VAL H H 5 7.807 7.807 7.586 0.221 25699
120 1 2 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.346 -0.268 25699
121 1 2 . 1 1 6 6 ALA CA C 6 53.076 53.076 54.434 -1.358 25699
122 1 2 . 1 1 6 6 ALA CB C 6 19.007 19.007 18.681 0.326 25699
123 1 2 . 1 1 6 6 ALA H H 6 8.101 8.101 7.629 0.472 25699
124 1 2 . 1 1 7 7 GLN HA H 7 4.072 4.072 4.129 -0.057 25699
125 1 2 . 1 1 7 7 GLN CB C 7 29.413 29.413 28.883 0.530 25699
126 1 2 . 1 1 7 7 GLN H H 7 8.065 8.065 8.483 -0.418 25699
127 1 2 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.185 -0.105 25699
128 1 2 . 1 1 8 8 GLU CA C 8 56.439 56.439 56.778 -0.339 25699
129 1 2 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.710 -0.157 25699
130 1 2 . 1 1 8 8 GLU H H 8 8.182 8.182 7.966 0.216 25699
131 1 2 . 1 1 9 9 LYS HA H 9 4.007 4.007 3.949 0.058 25699
132 1 2 . 1 1 9 9 LYS CA C 9 57.773 57.773 56.445 1.328 25699
133 1 2 . 1 1 9 9 LYS CB C 9 32.979 32.979 30.419 2.560 25699
134 1 2 . 1 1 9 9 LYS H H 9 8.048 8.048 8.707 -0.659 25699
135 1 2 . 1 1 10 10 GLY CA C 10 45.562 45.562 45.252 0.310 25699
136 1 2 . 1 1 10 10 GLY H H 10 8.305 8.305 7.905 0.400 25699
137 1 2 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.402 -0.318 25699
138 1 2 . 1 1 11 11 PHE CB C 11 39.831 39.831 39.445 0.386 25699
139 1 2 . 1 1 11 11 PHE H H 11 8.761 8.761 8.456 0.305 25699
140 1 2 . 1 1 12 12 LEU HA H 12 3.776 3.776 3.899 -0.123 25699
141 1 2 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.510 0.603 25699
142 1 2 . 1 1 12 12 LEU CB C 12 41.197 41.197 41.025 0.172 25699
143 1 2 . 1 1 12 12 LEU H H 12 8.728 8.728 7.998 0.730 25699
144 1 2 . 1 1 13 13 TYR HA H 13 4.042 4.042 4.100 -0.058 25699
145 1 2 . 1 1 13 13 TYR CA C 13 61.091 61.091 60.818 0.273 25699
146 1 2 . 1 1 13 13 TYR CB C 13 37.856 37.856 38.575 -0.719 25699
147 1 2 . 1 1 13 13 TYR H H 13 8.199 8.199 7.479 0.720 25699
148 1 2 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.690 0.084 25699
149 1 2 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.421 2.298 25699
150 1 2 . 1 1 14 14 ARG H H 14 8.047 8.047 7.445 0.602 25699
151 1 2 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.125 -0.258 25699
152 1 2 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.135 3.983 25699
153 1 2 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.653 2.646 25699
154 1 2 . 1 1 15 15 LEU H H 15 8.048 8.048 6.886 1.162 25699
155 1 2 . 1 1 16 16 THR HA H 16 4.079 4.079 4.608 -0.529 25699
156 1 2 . 1 1 16 16 THR CA C 16 61.604 61.604 59.509 2.095 25699
157 1 2 . 1 1 16 16 THR CB C 16 66.014 66.014 71.131 -5.117 25699
158 1 2 . 1 1 16 16 THR H H 16 7.825 7.825 7.931 -0.106 25699
159 1 2 . 1 1 17 17 SER HA H 17 3.925 3.925 4.184 -0.259 25699
160 1 2 . 1 1 17 17 SER CA C 17 61.613 61.613 60.845 0.768 25699
161 1 2 . 1 1 17 17 SER CB C 17 62.836 62.836 62.763 0.073 25699
162 1 2 . 1 1 17 17 SER H H 17 7.824 7.824 8.690 -0.866 25699
163 1 2 . 1 1 18 18 ARG HA H 18 3.997 3.997 3.915 0.082 25699
164 1 2 . 1 1 18 18 ARG CA C 18 58.150 58.150 58.267 -0.117 25699
165 1 2 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.040 1.026 25699
166 1 2 . 1 1 18 18 ARG H H 18 7.580 7.580 8.169 -0.589 25699
167 1 2 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.344 -0.086 25699
168 1 2 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.755 -1.258 25699
169 1 2 . 1 1 19 19 TYR H H 19 7.816 7.816 7.536 0.280 25699
170 1 2 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.733 -0.015 25699
171 1 2 . 1 1 20 20 ARG CA C 20 58.939 58.939 59.110 -0.171 25699
172 1 2 . 1 1 20 20 ARG CB C 20 30.009 30.009 29.777 0.232 25699
173 1 2 . 1 1 20 20 ARG H H 20 7.864 7.864 7.694 0.170 25699
174 1 2 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.533 -0.187 25699
175 1 2 . 1 1 21 21 HIS CA C 21 57.378 57.378 57.905 -0.527 25699
176 1 2 . 1 1 21 21 HIS CB C 21 28.660 28.660 30.064 -1.404 25699
177 1 2 . 1 1 21 21 HIS H H 21 7.900 7.900 7.557 0.343 25699
178 1 2 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.429 -0.238 25699
179 1 2 . 1 1 22 22 TYR CA C 22 59.853 59.853 59.989 -0.136 25699
180 1 2 . 1 1 22 22 TYR H H 22 7.680 7.680 7.592 0.088 25699
181 1 2 . 1 1 23 23 ALA HA H 23 3.880 3.880 4.592 -0.712 25699
182 1 2 . 1 1 23 23 ALA CA C 23 53.293 53.293 54.306 -1.014 25699
183 1 2 . 1 1 23 23 ALA CB C 23 18.596 18.596 18.176 0.420 25699
184 1 2 . 1 1 23 23 ALA H H 23 8.030 8.030 8.575 -0.545 25699
185 1 2 . 1 1 24 24 ALA HA H 24 4.025 4.025 4.362 -0.337 25699
186 1 2 . 1 1 24 24 ALA CA C 24 52.985 52.985 53.022 -0.037 25699
187 1 2 . 1 1 24 24 ALA CB C 24 18.873 18.873 18.527 0.346 25699
188 1 2 . 1 1 24 24 ALA H H 24 7.390 7.390 8.137 -0.747 25699
189 1 2 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.709 -0.341 25699
190 1 2 . 1 1 25 25 PHE CA C 25 58.247 58.247 59.267 -1.020 25699
191 1 2 . 1 1 25 25 PHE CB C 25 39.360 39.360 40.965 -1.605 25699
192 1 2 . 1 1 25 25 PHE H H 25 7.694 7.694 7.845 -0.151 25699
193 1 2 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.181 -0.115 25699
194 1 2 . 1 1 26 26 GLU CA C 26 57.011 57.011 59.637 -2.626 25699
195 1 2 . 1 1 26 26 GLU CB C 26 30.081 30.081 30.268 -0.187 25699
196 1 2 . 1 1 26 26 GLU H H 26 8.068 8.068 8.705 -0.637 25699
197 1 2 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.494 -0.399 25699
198 1 2 . 1 1 27 27 ARG CA C 27 56.260 56.260 56.116 0.144 25699
199 1 2 . 1 1 27 27 ARG CB C 27 30.799 30.799 32.606 -1.807 25699
200 1 2 . 1 1 27 27 ARG H H 27 7.976 7.976 7.804 0.172 25699
201 1 2 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.276 -0.105 25699
202 1 2 . 1 1 28 28 ALA CA C 28 52.581 52.581 53.493 -0.912 25699
203 1 2 . 1 1 28 28 ALA CB C 28 19.382 19.382 16.943 2.439 25699
204 1 2 . 1 1 28 28 ALA H H 28 8.012 8.012 8.489 -0.477 25699
205 1 2 . 1 1 29 29 THR HA H 29 4.112 4.112 4.056 0.056 25699
206 1 2 . 1 1 29 29 THR CA C 29 61.661 61.661 63.242 -1.581 25699
207 1 2 . 1 1 29 29 THR CB C 29 70.032 70.032 69.128 0.904 25699
208 1 2 . 1 1 29 29 THR H H 29 7.723 7.723 7.899 -0.176 25699
209 1 3 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.494 -0.415 25699
210 1 3 . 1 1 2 2 ALA CA C 2 52.826 52.826 52.333 0.493 25699
211 1 3 . 1 1 2 2 ALA CB C 2 21.988 21.988 18.805 3.183 25699
212 1 3 . 1 1 2 2 ALA H H 2 8.067 8.067 7.488 0.579 25699
213 1 3 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.308 -0.276 25699
214 1 3 . 1 1 3 3 GLU CB C 3 29.563 29.563 30.329 -0.766 25699
215 1 3 . 1 1 3 3 GLU H H 3 8.592 8.592 8.749 -0.157 25699
216 1 3 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.166 -0.036 25699
217 1 3 . 1 1 4 4 LYS CA C 4 56.839 56.839 58.925 -2.086 25699
218 1 3 . 1 1 4 4 LYS CB C 4 32.806 32.806 32.541 0.265 25699
219 1 3 . 1 1 4 4 LYS H H 4 8.205 8.205 8.554 -0.349 25699
220 1 3 . 1 1 5 5 VAL HA H 5 3.868 3.868 3.982 -0.114 25699
221 1 3 . 1 1 5 5 VAL CA C 5 62.947 62.947 64.584 -1.637 25699
222 1 3 . 1 1 5 5 VAL CB C 5 32.536 32.536 31.417 1.119 25699
223 1 3 . 1 1 5 5 VAL H H 5 7.807 7.807 8.244 -0.437 25699
224 1 3 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.411 -0.333 25699
225 1 3 . 1 1 6 6 ALA CA C 6 53.076 53.076 51.441 1.635 25699
226 1 3 . 1 1 6 6 ALA CB C 6 19.007 19.007 18.297 0.710 25699
227 1 3 . 1 1 6 6 ALA H H 6 8.101 8.101 7.223 0.878 25699
228 1 3 . 1 1 7 7 GLN HA H 7 4.072 4.072 4.311 -0.239 25699
229 1 3 . 1 1 7 7 GLN CB C 7 29.413 29.413 29.241 0.172 25699
230 1 3 . 1 1 7 7 GLN H H 7 8.065 8.065 7.985 0.080 25699
231 1 3 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.042 0.038 25699
232 1 3 . 1 1 8 8 GLU CA C 8 56.439 56.439 58.438 -1.999 25699
233 1 3 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.706 -0.153 25699
234 1 3 . 1 1 8 8 GLU H H 8 8.182 8.182 8.057 0.125 25699
235 1 3 . 1 1 9 9 LYS HA H 9 4.007 4.007 4.428 -0.421 25699
236 1 3 . 1 1 9 9 LYS CA C 9 57.773 57.773 56.324 1.449 25699
237 1 3 . 1 1 9 9 LYS CB C 9 32.979 32.979 34.136 -1.157 25699
238 1 3 . 1 1 9 9 LYS H H 9 8.048 8.048 7.814 0.234 25699
239 1 3 . 1 1 10 10 GLY CA C 10 45.562 45.562 45.387 0.175 25699
240 1 3 . 1 1 10 10 GLY H H 10 8.305 8.305 7.531 0.774 25699
241 1 3 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.618 -0.534 25699
242 1 3 . 1 1 11 11 PHE CB C 11 39.831 39.831 39.788 0.043 25699
243 1 3 . 1 1 11 11 PHE H H 11 8.761 8.761 8.312 0.449 25699
244 1 3 . 1 1 12 12 LEU HA H 12 3.776 3.776 3.900 -0.124 25699
245 1 3 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.652 0.460 25699
246 1 3 . 1 1 12 12 LEU CB C 12 41.197 41.197 40.762 0.435 25699
247 1 3 . 1 1 12 12 LEU H H 12 8.728 8.728 8.134 0.594 25699
248 1 3 . 1 1 13 13 TYR HA H 13 4.042 4.042 4.007 0.035 25699
249 1 3 . 1 1 13 13 TYR CA C 13 61.091 61.091 60.978 0.113 25699
250 1 3 . 1 1 13 13 TYR CB C 13 37.856 37.856 37.959 -0.103 25699
251 1 3 . 1 1 13 13 TYR H H 13 8.199 8.199 8.266 -0.067 25699
252 1 3 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.598 0.176 25699
253 1 3 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.575 2.144 25699
254 1 3 . 1 1 14 14 ARG H H 14 8.047 8.047 7.470 0.577 25699
255 1 3 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.030 -0.163 25699
256 1 3 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.767 3.351 25699
257 1 3 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.577 2.723 25699
258 1 3 . 1 1 15 15 LEU H H 15 8.048 8.048 7.145 0.903 25699
259 1 3 . 1 1 16 16 THR HA H 16 4.079 4.079 4.463 -0.384 25699
260 1 3 . 1 1 16 16 THR CA C 16 61.604 61.604 60.192 1.412 25699
261 1 3 . 1 1 16 16 THR CB C 16 66.014 66.014 71.775 -5.761 25699
262 1 3 . 1 1 16 16 THR H H 16 7.825 7.825 7.946 -0.121 25699
263 1 3 . 1 1 17 17 SER HA H 17 3.925 3.925 4.056 -0.131 25699
264 1 3 . 1 1 17 17 SER CA C 17 61.613 61.613 61.741 -0.128 25699
265 1 3 . 1 1 17 17 SER CB C 17 62.836 62.836 63.172 -0.336 25699
266 1 3 . 1 1 17 17 SER H H 17 7.824 7.824 8.693 -0.869 25699
267 1 3 . 1 1 18 18 ARG HA H 18 3.997 3.997 3.910 0.087 25699
268 1 3 . 1 1 18 18 ARG CA C 18 58.150 58.150 59.200 -1.050 25699
269 1 3 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.578 0.488 25699
270 1 3 . 1 1 18 18 ARG H H 18 7.580 7.580 8.535 -0.955 25699
271 1 3 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.392 -0.134 25699
272 1 3 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.546 -1.049 25699
273 1 3 . 1 1 19 19 TYR H H 19 7.816 7.816 7.571 0.245 25699
274 1 3 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.849 -0.131 25699
275 1 3 . 1 1 20 20 ARG CA C 20 58.939 58.939 59.550 -0.611 25699
276 1 3 . 1 1 20 20 ARG CB C 20 30.009 30.009 29.911 0.098 25699
277 1 3 . 1 1 20 20 ARG H H 20 7.864 7.864 7.874 -0.010 25699
278 1 3 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.408 -0.062 25699
279 1 3 . 1 1 21 21 HIS CA C 21 57.378 57.378 58.965 -1.587 25699
280 1 3 . 1 1 21 21 HIS CB C 21 28.660 28.660 29.637 -0.977 25699
281 1 3 . 1 1 21 21 HIS H H 21 7.900 7.900 7.842 0.058 25699
282 1 3 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.455 -0.264 25699
283 1 3 . 1 1 22 22 TYR CA C 22 59.853 59.853 59.837 0.016 25699
284 1 3 . 1 1 22 22 TYR H H 22 7.680 7.680 7.433 0.247 25699
285 1 3 . 1 1 23 23 ALA HA H 23 3.880 3.880 4.508 -0.628 25699
286 1 3 . 1 1 23 23 ALA CA C 23 53.293 53.293 54.189 -0.896 25699
287 1 3 . 1 1 23 23 ALA CB C 23 18.596 18.596 18.097 0.499 25699
288 1 3 . 1 1 23 23 ALA H H 23 8.030 8.030 8.149 -0.119 25699
289 1 3 . 1 1 24 24 ALA HA H 24 4.025 4.025 4.423 -0.398 25699
290 1 3 . 1 1 24 24 ALA CA C 24 52.985 52.985 53.592 -0.607 25699
291 1 3 . 1 1 24 24 ALA CB C 24 18.873 18.873 18.685 0.188 25699
292 1 3 . 1 1 24 24 ALA H H 24 7.390 7.390 8.038 -0.648 25699
293 1 3 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.695 -0.327 25699
294 1 3 . 1 1 25 25 PHE CA C 25 58.247 58.247 59.244 -0.997 25699
295 1 3 . 1 1 25 25 PHE CB C 25 39.360 39.360 40.949 -1.589 25699
296 1 3 . 1 1 25 25 PHE H H 25 7.694 7.694 7.827 -0.133 25699
297 1 3 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.088 -0.022 25699
298 1 3 . 1 1 26 26 GLU CA C 26 57.011 57.011 59.507 -2.495 25699
299 1 3 . 1 1 26 26 GLU CB C 26 30.081 30.081 30.016 0.065 25699
300 1 3 . 1 1 26 26 GLU H H 26 8.068 8.068 8.643 -0.575 25699
301 1 3 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.446 -0.351 25699
302 1 3 . 1 1 27 27 ARG CA C 27 56.260 56.260 56.075 0.185 25699
303 1 3 . 1 1 27 27 ARG CB C 27 30.799 30.799 32.590 -1.791 25699
304 1 3 . 1 1 27 27 ARG H H 27 7.976 7.976 7.737 0.239 25699
305 1 3 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.277 -0.106 25699
306 1 3 . 1 1 28 28 ALA CA C 28 52.581 52.581 53.524 -0.943 25699
307 1 3 . 1 1 28 28 ALA CB C 28 19.382 19.382 16.923 2.459 25699
308 1 3 . 1 1 28 28 ALA H H 28 8.012 8.012 8.481 -0.469 25699
309 1 3 . 1 1 29 29 THR HA H 29 4.112 4.112 4.104 0.008 25699
310 1 3 . 1 1 29 29 THR CA C 29 61.661 61.661 62.848 -1.187 25699
311 1 3 . 1 1 29 29 THR CB C 29 70.032 70.032 68.945 1.087 25699
312 1 3 . 1 1 29 29 THR H H 29 7.723 7.723 7.877 -0.154 25699
313 1 4 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.504 -0.425 25699
314 1 4 . 1 1 2 2 ALA CA C 2 52.826 52.826 51.397 1.429 25699
315 1 4 . 1 1 2 2 ALA CB C 2 21.988 21.988 18.840 3.148 25699
316 1 4 . 1 1 2 2 ALA H H 2 8.067 8.067 7.357 0.710 25699
317 1 4 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.310 -0.278 25699
318 1 4 . 1 1 3 3 GLU CB C 3 29.563 29.563 29.035 0.528 25699
319 1 4 . 1 1 3 3 GLU H H 3 8.592 8.592 8.771 -0.179 25699
320 1 4 . 1 1 4 4 LYS HA H 4 4.130 4.130 3.990 0.140 25699
321 1 4 . 1 1 4 4 LYS CA C 4 56.839 56.839 57.367 -0.528 25699
322 1 4 . 1 1 4 4 LYS CB C 4 32.806 32.806 31.273 1.533 25699
323 1 4 . 1 1 4 4 LYS H H 4 8.205 8.205 8.415 -0.210 25699
324 1 4 . 1 1 5 5 VAL HA H 5 3.868 3.868 4.078 -0.210 25699
325 1 4 . 1 1 5 5 VAL CA C 5 62.947 62.947 63.561 -0.614 25699
326 1 4 . 1 1 5 5 VAL CB C 5 32.536 32.536 33.117 -0.581 25699
327 1 4 . 1 1 5 5 VAL H H 5 7.807 7.807 7.793 0.014 25699
328 1 4 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.242 -0.164 25699
329 1 4 . 1 1 6 6 ALA CA C 6 53.076 53.076 54.849 -1.774 25699
330 1 4 . 1 1 6 6 ALA CB C 6 19.007 19.007 18.601 0.406 25699
331 1 4 . 1 1 6 6 ALA H H 6 8.101 8.101 7.870 0.231 25699
332 1 4 . 1 1 7 7 GLN HA H 7 4.072 4.072 4.095 -0.023 25699
333 1 4 . 1 1 7 7 GLN CB C 7 29.413 29.413 28.731 0.682 25699
334 1 4 . 1 1 7 7 GLN H H 7 8.065 8.065 8.371 -0.306 25699
335 1 4 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.131 -0.051 25699
336 1 4 . 1 1 8 8 GLU CA C 8 56.439 56.439 57.060 -0.621 25699
337 1 4 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.542 0.011 25699
338 1 4 . 1 1 8 8 GLU H H 8 8.182 8.182 8.002 0.180 25699
339 1 4 . 1 1 9 9 LYS HA H 9 4.007 4.007 3.915 0.092 25699
340 1 4 . 1 1 9 9 LYS CA C 9 57.773 57.773 56.593 1.180 25699
341 1 4 . 1 1 9 9 LYS CB C 9 32.979 32.979 30.659 2.320 25699
342 1 4 . 1 1 9 9 LYS H H 9 8.048 8.048 8.721 -0.673 25699
343 1 4 . 1 1 10 10 GLY CA C 10 45.562 45.562 45.320 0.242 25699
344 1 4 . 1 1 10 10 GLY H H 10 8.305 8.305 7.546 0.759 25699
345 1 4 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.711 -0.627 25699
346 1 4 . 1 1 11 11 PHE CB C 11 39.831 39.831 39.842 -0.010 25699
347 1 4 . 1 1 11 11 PHE H H 11 8.761 8.761 8.393 0.368 25699
348 1 4 . 1 1 12 12 LEU HA H 12 3.776 3.776 4.013 -0.237 25699
349 1 4 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.545 0.567 25699
350 1 4 . 1 1 12 12 LEU CB C 12 41.197 41.197 40.949 0.248 25699
351 1 4 . 1 1 12 12 LEU H H 12 8.728 8.728 8.208 0.520 25699
352 1 4 . 1 1 13 13 TYR HA H 13 4.042 4.042 4.008 0.034 25699
353 1 4 . 1 1 13 13 TYR CA C 13 61.091 61.091 61.169 -0.078 25699
354 1 4 . 1 1 13 13 TYR CB C 13 37.856 37.856 38.260 -0.404 25699
355 1 4 . 1 1 13 13 TYR H H 13 8.199 8.199 7.808 0.391 25699
356 1 4 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.632 0.142 25699
357 1 4 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.540 2.179 25699
358 1 4 . 1 1 14 14 ARG H H 14 8.047 8.047 7.412 0.635 25699
359 1 4 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.056 -0.189 25699
360 1 4 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.721 3.397 25699
361 1 4 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.557 2.742 25699
362 1 4 . 1 1 15 15 LEU H H 15 8.048 8.048 7.263 0.785 25699
363 1 4 . 1 1 16 16 THR HA H 16 4.079 4.079 4.501 -0.422 25699
364 1 4 . 1 1 16 16 THR CA C 16 61.604 61.604 60.286 1.318 25699
365 1 4 . 1 1 16 16 THR CB C 16 66.014 66.014 71.293 -5.279 25699
366 1 4 . 1 1 16 16 THR H H 16 7.825 7.825 7.940 -0.115 25699
367 1 4 . 1 1 17 17 SER HA H 17 3.925 3.925 4.212 -0.287 25699
368 1 4 . 1 1 17 17 SER CA C 17 61.613 61.613 60.630 0.983 25699
369 1 4 . 1 1 17 17 SER CB C 17 62.836 62.836 62.994 -0.158 25699
370 1 4 . 1 1 17 17 SER H H 17 7.824 7.824 8.616 -0.792 25699
371 1 4 . 1 1 18 18 ARG HA H 18 3.997 3.997 3.776 0.221 25699
372 1 4 . 1 1 18 18 ARG CA C 18 58.150 58.150 59.116 -0.966 25699
373 1 4 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.531 0.535 25699
374 1 4 . 1 1 18 18 ARG H H 18 7.580 7.580 8.495 -0.915 25699
375 1 4 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.251 0.007 25699
376 1 4 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.673 -1.176 25699
377 1 4 . 1 1 19 19 TYR H H 19 7.816 7.816 7.533 0.283 25699
378 1 4 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.640 0.078 25699
379 1 4 . 1 1 20 20 ARG CA C 20 58.939 58.939 59.466 -0.527 25699
380 1 4 . 1 1 20 20 ARG CB C 20 30.009 30.009 29.857 0.152 25699
381 1 4 . 1 1 20 20 ARG H H 20 7.864 7.864 7.622 0.242 25699
382 1 4 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.393 -0.047 25699
383 1 4 . 1 1 21 21 HIS CA C 21 57.378 57.378 58.742 -1.364 25699
384 1 4 . 1 1 21 21 HIS CB C 21 28.660 28.660 29.584 -0.924 25699
385 1 4 . 1 1 21 21 HIS H H 21 7.900 7.900 7.859 0.041 25699
386 1 4 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.432 -0.241 25699
387 1 4 . 1 1 22 22 TYR CA C 22 59.853 59.853 59.392 0.460 25699
388 1 4 . 1 1 22 22 TYR H H 22 7.680 7.680 7.553 0.127 25699
389 1 4 . 1 1 23 23 ALA HA H 23 3.880 3.880 4.089 -0.209 25699
390 1 4 . 1 1 23 23 ALA CA C 23 53.293 53.293 54.305 -1.012 25699
391 1 4 . 1 1 23 23 ALA CB C 23 18.596 18.596 17.456 1.139 25699
392 1 4 . 1 1 23 23 ALA H H 23 8.030 8.030 8.472 -0.442 25699
393 1 4 . 1 1 24 24 ALA HA H 24 4.025 4.025 4.320 -0.295 25699
394 1 4 . 1 1 24 24 ALA CA C 24 52.985 52.985 53.006 -0.021 25699
395 1 4 . 1 1 24 24 ALA CB C 24 18.873 18.873 18.649 0.223 25699
396 1 4 . 1 1 24 24 ALA H H 24 7.390 7.390 7.914 -0.524 25699
397 1 4 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.680 -0.312 25699
398 1 4 . 1 1 25 25 PHE CA C 25 58.247 58.247 59.229 -0.982 25699
399 1 4 . 1 1 25 25 PHE CB C 25 39.360 39.360 40.943 -1.583 25699
400 1 4 . 1 1 25 25 PHE H H 25 7.694 7.694 7.772 -0.078 25699
401 1 4 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.149 -0.083 25699
402 1 4 . 1 1 26 26 GLU CA C 26 57.011 57.011 59.561 -2.550 25699
403 1 4 . 1 1 26 26 GLU CB C 26 30.081 30.081 30.164 -0.083 25699
404 1 4 . 1 1 26 26 GLU H H 26 8.068 8.068 8.632 -0.564 25699
405 1 4 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.439 -0.344 25699
406 1 4 . 1 1 27 27 ARG CA C 27 56.260 56.260 56.043 0.217 25699
407 1 4 . 1 1 27 27 ARG CB C 27 30.799 30.799 32.506 -1.707 25699
408 1 4 . 1 1 27 27 ARG H H 27 7.976 7.976 7.687 0.289 25699
409 1 4 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.221 -0.050 25699
410 1 4 . 1 1 28 28 ALA CA C 28 52.581 52.581 53.514 -0.933 25699
411 1 4 . 1 1 28 28 ALA CB C 28 19.382 19.382 16.526 2.856 25699
412 1 4 . 1 1 28 28 ALA H H 28 8.012 8.012 8.381 -0.369 25699
413 1 4 . 1 1 29 29 THR HA H 29 4.112 4.112 4.019 0.093 25699
414 1 4 . 1 1 29 29 THR CA C 29 61.661 61.661 62.852 -1.191 25699
415 1 4 . 1 1 29 29 THR CB C 29 70.032 70.032 68.991 1.041 25699
416 1 4 . 1 1 29 29 THR H H 29 7.723 7.723 7.865 -0.142 25699
417 1 5 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.548 -0.469 25699
418 1 5 . 1 1 2 2 ALA CA C 2 52.826 52.826 52.276 0.550 25699
419 1 5 . 1 1 2 2 ALA CB C 2 21.988 21.988 19.457 2.531 25699
420 1 5 . 1 1 2 2 ALA H H 2 8.067 8.067 8.043 0.024 25699
421 1 5 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.536 -0.504 25699
422 1 5 . 1 1 3 3 GLU CB C 3 29.563 29.563 30.159 -0.596 25699
423 1 5 . 1 1 3 3 GLU H H 3 8.592 8.592 8.719 -0.127 25699
424 1 5 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.303 -0.173 25699
425 1 5 . 1 1 4 4 LYS CA C 4 56.839 56.839 57.648 -0.809 25699
426 1 5 . 1 1 4 4 LYS CB C 4 32.806 32.806 32.944 -0.138 25699
427 1 5 . 1 1 4 4 LYS H H 4 8.205 8.205 8.012 0.193 25699
428 1 5 . 1 1 5 5 VAL HA H 5 3.868 3.868 4.237 -0.369 25699
429 1 5 . 1 1 5 5 VAL CA C 5 62.947 62.947 62.187 0.760 25699
430 1 5 . 1 1 5 5 VAL CB C 5 32.536 32.536 32.581 -0.045 25699
431 1 5 . 1 1 5 5 VAL H H 5 7.807 7.807 7.804 0.003 25699
432 1 5 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.259 -0.181 25699
433 1 5 . 1 1 6 6 ALA CA C 6 53.076 53.076 52.489 0.587 25699
434 1 5 . 1 1 6 6 ALA CB C 6 19.007 19.007 19.082 -0.075 25699
435 1 5 . 1 1 6 6 ALA H H 6 8.101 8.101 7.837 0.264 25699
436 1 5 . 1 1 7 7 GLN HA H 7 4.072 4.072 4.036 0.036 25699
437 1 5 . 1 1 7 7 GLN CB C 7 29.413 29.413 28.210 1.203 25699
438 1 5 . 1 1 7 7 GLN H H 7 8.065 8.065 9.074 -1.009 25699
439 1 5 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.429 -0.349 25699
440 1 5 . 1 1 8 8 GLU CA C 8 56.439 56.439 57.152 -0.713 25699
441 1 5 . 1 1 8 8 GLU CB C 8 29.553 29.553 30.388 -0.835 25699
442 1 5 . 1 1 8 8 GLU H H 8 8.182 8.182 7.896 0.286 25699
443 1 5 . 1 1 9 9 LYS HA H 9 4.007 4.007 4.025 -0.018 25699
444 1 5 . 1 1 9 9 LYS CA C 9 57.773 57.773 57.077 0.696 25699
445 1 5 . 1 1 9 9 LYS CB C 9 32.979 32.979 32.798 0.181 25699
446 1 5 . 1 1 9 9 LYS H H 9 8.048 8.048 7.988 0.060 25699
447 1 5 . 1 1 10 10 GLY CA C 10 45.562 45.562 44.626 0.936 25699
448 1 5 . 1 1 10 10 GLY H H 10 8.305 8.305 7.427 0.878 25699
449 1 5 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.552 -0.468 25699
450 1 5 . 1 1 11 11 PHE CB C 11 39.831 39.831 39.388 0.443 25699
451 1 5 . 1 1 11 11 PHE H H 11 8.761 8.761 8.546 0.215 25699
452 1 5 . 1 1 12 12 LEU HA H 12 3.776 3.776 3.742 0.034 25699
453 1 5 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.011 1.101 25699
454 1 5 . 1 1 12 12 LEU CB C 12 41.197 41.197 41.019 0.178 25699
455 1 5 . 1 1 12 12 LEU H H 12 8.728 8.728 8.034 0.694 25699
456 1 5 . 1 1 13 13 TYR HA H 13 4.042 4.042 4.129 -0.087 25699
457 1 5 . 1 1 13 13 TYR CA C 13 61.091 61.091 60.587 0.504 25699
458 1 5 . 1 1 13 13 TYR CB C 13 37.856 37.856 38.065 -0.209 25699
459 1 5 . 1 1 13 13 TYR H H 13 8.199 8.199 7.729 0.470 25699
460 1 5 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.458 0.316 25699
461 1 5 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.646 2.073 25699
462 1 5 . 1 1 14 14 ARG H H 14 8.047 8.047 7.609 0.438 25699
463 1 5 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.137 -0.270 25699
464 1 5 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.764 3.354 25699
465 1 5 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.448 2.851 25699
466 1 5 . 1 1 15 15 LEU H H 15 8.048 8.048 7.147 0.901 25699
467 1 5 . 1 1 16 16 THR HA H 16 4.079 4.079 4.576 -0.497 25699
468 1 5 . 1 1 16 16 THR CA C 16 61.604 61.604 59.804 1.800 25699
469 1 5 . 1 1 16 16 THR CB C 16 66.014 66.014 71.796 -5.782 25699
470 1 5 . 1 1 16 16 THR H H 16 7.825 7.825 8.101 -0.276 25699
471 1 5 . 1 1 17 17 SER HA H 17 3.925 3.925 4.186 -0.261 25699
472 1 5 . 1 1 17 17 SER CA C 17 61.613 61.613 61.019 0.594 25699
473 1 5 . 1 1 17 17 SER CB C 17 62.836 62.836 62.991 -0.155 25699
474 1 5 . 1 1 17 17 SER H H 17 7.824 7.824 8.865 -1.041 25699
475 1 5 . 1 1 18 18 ARG HA H 18 3.997 3.997 3.890 0.107 25699
476 1 5 . 1 1 18 18 ARG CA C 18 58.150 58.150 58.010 0.140 25699
477 1 5 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.070 0.996 25699
478 1 5 . 1 1 18 18 ARG H H 18 7.580 7.580 8.122 -0.542 25699
479 1 5 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.312 -0.054 25699
480 1 5 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.751 -1.254 25699
481 1 5 . 1 1 19 19 TYR H H 19 7.816 7.816 7.587 0.229 25699
482 1 5 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.728 -0.010 25699
483 1 5 . 1 1 20 20 ARG CA C 20 58.939 58.939 59.335 -0.396 25699
484 1 5 . 1 1 20 20 ARG CB C 20 30.009 30.009 29.915 0.094 25699
485 1 5 . 1 1 20 20 ARG H H 20 7.864 7.864 7.870 -0.006 25699
486 1 5 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.452 -0.106 25699
487 1 5 . 1 1 21 21 HIS CA C 21 57.378 57.378 58.349 -0.971 25699
488 1 5 . 1 1 21 21 HIS CB C 21 28.660 28.660 29.887 -1.227 25699
489 1 5 . 1 1 21 21 HIS H H 21 7.900 7.900 7.547 0.353 25699
490 1 5 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.363 -0.172 25699
491 1 5 . 1 1 22 22 TYR CA C 22 59.853 59.853 60.096 -0.243 25699
492 1 5 . 1 1 22 22 TYR H H 22 7.680 7.680 7.786 -0.106 25699
493 1 5 . 1 1 23 23 ALA HA H 23 3.880 3.880 4.315 -0.435 25699
494 1 5 . 1 1 23 23 ALA CA C 23 53.293 53.293 54.535 -1.242 25699
495 1 5 . 1 1 23 23 ALA CB C 23 18.596 18.596 17.550 1.046 25699
496 1 5 . 1 1 23 23 ALA H H 23 8.030 8.030 8.600 -0.570 25699
497 1 5 . 1 1 24 24 ALA HA H 24 4.025 4.025 4.354 -0.329 25699
498 1 5 . 1 1 24 24 ALA CA C 24 52.985 52.985 53.520 -0.535 25699
499 1 5 . 1 1 24 24 ALA CB C 24 18.873 18.873 18.557 0.316 25699
500 1 5 . 1 1 24 24 ALA H H 24 7.390 7.390 8.019 -0.629 25699
501 1 5 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.625 -0.257 25699
502 1 5 . 1 1 25 25 PHE CA C 25 58.247 58.247 59.170 -0.923 25699
503 1 5 . 1 1 25 25 PHE CB C 25 39.360 39.360 40.821 -1.461 25699
504 1 5 . 1 1 25 25 PHE H H 25 7.694 7.694 7.755 -0.061 25699
505 1 5 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.169 -0.103 25699
506 1 5 . 1 1 26 26 GLU CA C 26 57.011 57.011 59.655 -2.644 25699
507 1 5 . 1 1 26 26 GLU CB C 26 30.081 30.081 30.204 -0.123 25699
508 1 5 . 1 1 26 26 GLU H H 26 8.068 8.068 8.652 -0.584 25699
509 1 5 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.424 -0.329 25699
510 1 5 . 1 1 27 27 ARG CA C 27 56.260 56.260 56.316 -0.056 25699
511 1 5 . 1 1 27 27 ARG CB C 27 30.799 30.799 32.606 -1.807 25699
512 1 5 . 1 1 27 27 ARG H H 27 7.976 7.976 7.744 0.232 25699
513 1 5 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.224 -0.053 25699
514 1 5 . 1 1 28 28 ALA CA C 28 52.581 52.581 53.459 -0.878 25699
515 1 5 . 1 1 28 28 ALA CB C 28 19.382 19.382 16.969 2.413 25699
516 1 5 . 1 1 28 28 ALA H H 28 8.012 8.012 8.417 -0.405 25699
517 1 5 . 1 1 29 29 THR HA H 29 4.112 4.112 4.076 0.036 25699
518 1 5 . 1 1 29 29 THR CA C 29 61.661 61.661 62.843 -1.181 25699
519 1 5 . 1 1 29 29 THR CB C 29 70.032 70.032 68.907 1.125 25699
520 1 5 . 1 1 29 29 THR H H 29 7.723 7.723 7.838 -0.115 25699
521 1 6 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.922 -0.843 25699
522 1 6 . 1 1 2 2 ALA CA C 2 52.826 52.826 51.679 1.147 25699
523 1 6 . 1 1 2 2 ALA CB C 2 21.988 21.988 19.226 2.762 25699
524 1 6 . 1 1 2 2 ALA H H 2 8.067 8.067 7.894 0.173 25699
525 1 6 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.336 -0.304 25699
526 1 6 . 1 1 3 3 GLU CB C 3 29.563 29.563 30.068 -0.505 25699
527 1 6 . 1 1 3 3 GLU H H 3 8.592 8.592 8.933 -0.341 25699
528 1 6 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.304 -0.174 25699
529 1 6 . 1 1 4 4 LYS CA C 4 56.839 56.839 57.090 -0.251 25699
530 1 6 . 1 1 4 4 LYS CB C 4 32.806 32.806 32.620 0.186 25699
531 1 6 . 1 1 4 4 LYS H H 4 8.205 8.205 8.172 0.033 25699
532 1 6 . 1 1 5 5 VAL HA H 5 3.868 3.868 3.742 0.126 25699
533 1 6 . 1 1 5 5 VAL CA C 5 62.947 62.947 64.453 -1.506 25699
534 1 6 . 1 1 5 5 VAL CB C 5 32.536 32.536 31.984 0.552 25699
535 1 6 . 1 1 5 5 VAL H H 5 7.807 7.807 8.364 -0.557 25699
536 1 6 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.493 -0.415 25699
537 1 6 . 1 1 6 6 ALA CA C 6 53.076 53.076 51.711 1.365 25699
538 1 6 . 1 1 6 6 ALA CB C 6 19.007 19.007 17.945 1.062 25699
539 1 6 . 1 1 6 6 ALA H H 6 8.101 8.101 7.689 0.412 25699
540 1 6 . 1 1 7 7 GLN HA H 7 4.072 4.072 4.351 -0.279 25699
541 1 6 . 1 1 7 7 GLN CB C 7 29.413 29.413 29.755 -0.342 25699
542 1 6 . 1 1 7 7 GLN H H 7 8.065 8.065 7.463 0.602 25699
543 1 6 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.043 0.037 25699
544 1 6 . 1 1 8 8 GLU CA C 8 56.439 56.439 58.689 -2.250 25699
545 1 6 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.609 -0.056 25699
546 1 6 . 1 1 8 8 GLU H H 8 8.182 8.182 7.922 0.260 25699
547 1 6 . 1 1 9 9 LYS HA H 9 4.007 4.007 4.402 -0.395 25699
548 1 6 . 1 1 9 9 LYS CA C 9 57.773 57.773 56.493 1.280 25699
549 1 6 . 1 1 9 9 LYS CB C 9 32.979 32.979 32.955 0.024 25699
550 1 6 . 1 1 9 9 LYS H H 9 8.048 8.048 7.835 0.213 25699
551 1 6 . 1 1 10 10 GLY CA C 10 45.562 45.562 45.052 0.510 25699
552 1 6 . 1 1 10 10 GLY H H 10 8.305 8.305 7.503 0.802 25699
553 1 6 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.709 -0.625 25699
554 1 6 . 1 1 11 11 PHE CB C 11 39.831 39.831 40.076 -0.245 25699
555 1 6 . 1 1 11 11 PHE H H 11 8.761 8.761 8.342 0.419 25699
556 1 6 . 1 1 12 12 LEU HA H 12 3.776 3.776 4.096 -0.320 25699
557 1 6 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.560 0.552 25699
558 1 6 . 1 1 12 12 LEU CB C 12 41.197 41.197 41.090 0.107 25699
559 1 6 . 1 1 12 12 LEU H H 12 8.728 8.728 8.271 0.457 25699
560 1 6 . 1 1 13 13 TYR HA H 13 4.042 4.042 4.086 -0.044 25699
561 1 6 . 1 1 13 13 TYR CA C 13 61.091 61.091 60.592 0.499 25699
562 1 6 . 1 1 13 13 TYR CB C 13 37.856 37.856 38.054 -0.198 25699
563 1 6 . 1 1 13 13 TYR H H 13 8.199 8.199 8.085 0.114 25699
564 1 6 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.738 0.036 25699
565 1 6 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.336 2.384 25699
566 1 6 . 1 1 14 14 ARG H H 14 8.047 8.047 7.550 0.497 25699
567 1 6 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.085 -0.218 25699
568 1 6 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.611 3.507 25699
569 1 6 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.728 2.571 25699
570 1 6 . 1 1 15 15 LEU H H 15 8.048 8.048 7.420 0.628 25699
571 1 6 . 1 1 16 16 THR HA H 16 4.079 4.079 4.579 -0.500 25699
572 1 6 . 1 1 16 16 THR CA C 16 61.604 61.604 60.309 1.295 25699
573 1 6 . 1 1 16 16 THR CB C 16 66.014 66.014 71.433 -5.419 25699
574 1 6 . 1 1 16 16 THR H H 16 7.825 7.825 7.964 -0.139 25699
575 1 6 . 1 1 17 17 SER HA H 17 3.925 3.925 4.364 -0.439 25699
576 1 6 . 1 1 17 17 SER CA C 17 61.613 61.613 60.537 1.076 25699
577 1 6 . 1 1 17 17 SER CB C 17 62.836 62.836 62.975 -0.139 25699
578 1 6 . 1 1 17 17 SER H H 17 7.824 7.824 8.661 -0.837 25699
579 1 6 . 1 1 18 18 ARG HA H 18 3.997 3.997 4.020 -0.023 25699
580 1 6 . 1 1 18 18 ARG CA C 18 58.150 58.150 59.246 -1.096 25699
581 1 6 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.759 0.307 25699
582 1 6 . 1 1 18 18 ARG H H 18 7.580 7.580 8.469 -0.889 25699
583 1 6 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.388 -0.130 25699
584 1 6 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.629 -1.132 25699
585 1 6 . 1 1 19 19 TYR H H 19 7.816 7.816 7.785 0.031 25699
586 1 6 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.785 -0.067 25699
587 1 6 . 1 1 20 20 ARG CA C 20 58.939 58.939 59.593 -0.654 25699
588 1 6 . 1 1 20 20 ARG CB C 20 30.009 30.009 29.184 0.825 25699
589 1 6 . 1 1 20 20 ARG H H 20 7.864 7.864 7.634 0.230 25699
590 1 6 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.559 -0.213 25699
591 1 6 . 1 1 21 21 HIS CA C 21 57.378 57.378 58.869 -1.491 25699
592 1 6 . 1 1 21 21 HIS CB C 21 28.660 28.660 29.035 -0.375 25699
593 1 6 . 1 1 21 21 HIS H H 21 7.900 7.900 7.523 0.377 25699
594 1 6 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.264 -0.073 25699
595 1 6 . 1 1 22 22 TYR CA C 22 59.853 59.853 59.777 0.076 25699
596 1 6 . 1 1 22 22 TYR H H 22 7.680 7.680 7.711 -0.031 25699
597 1 6 . 1 1 23 23 ALA HA H 23 3.880 3.880 5.038 -1.158 25699
598 1 6 . 1 1 23 23 ALA CA C 23 53.293 53.293 51.824 1.469 25699
599 1 6 . 1 1 23 23 ALA CB C 23 18.596 18.596 19.096 -0.500 25699
600 1 6 . 1 1 23 23 ALA H H 23 8.030 8.030 7.752 0.278 25699
601 1 6 . 1 1 24 24 ALA HA H 24 4.025 4.025 4.468 -0.443 25699
602 1 6 . 1 1 24 24 ALA CA C 24 52.985 52.985 53.413 -0.428 25699
603 1 6 . 1 1 24 24 ALA CB C 24 18.873 18.873 19.375 -0.502 25699
604 1 6 . 1 1 24 24 ALA H H 24 7.390 7.390 7.944 -0.554 25699
605 1 6 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.638 -0.270 25699
606 1 6 . 1 1 25 25 PHE CA C 25 58.247 58.247 58.881 -0.634 25699
607 1 6 . 1 1 25 25 PHE CB C 25 39.360 39.360 40.067 -0.707 25699
608 1 6 . 1 1 25 25 PHE H H 25 7.694 7.694 7.874 -0.180 25699
609 1 6 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.099 -0.033 25699
610 1 6 . 1 1 26 26 GLU CA C 26 57.011 57.011 59.365 -2.354 25699
611 1 6 . 1 1 26 26 GLU CB C 26 30.081 30.081 29.607 0.474 25699
612 1 6 . 1 1 26 26 GLU H H 26 8.068 8.068 8.759 -0.691 25699
613 1 6 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.395 -0.300 25699
614 1 6 . 1 1 27 27 ARG CA C 27 56.260 56.260 56.246 0.014 25699
615 1 6 . 1 1 27 27 ARG CB C 27 30.799 30.799 32.185 -1.386 25699
616 1 6 . 1 1 27 27 ARG H H 27 7.976 7.976 8.073 -0.097 25699
617 1 6 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.302 -0.131 25699
618 1 6 . 1 1 28 28 ALA CA C 28 52.581 52.581 53.332 -0.751 25699
619 1 6 . 1 1 28 28 ALA CB C 28 19.382 19.382 16.962 2.420 25699
620 1 6 . 1 1 28 28 ALA H H 28 8.012 8.012 8.057 -0.045 25699
621 1 6 . 1 1 29 29 THR HA H 29 4.112 4.112 4.103 0.009 25699
622 1 6 . 1 1 29 29 THR CA C 29 61.661 61.661 62.858 -1.198 25699
623 1 6 . 1 1 29 29 THR CB C 29 70.032 70.032 68.893 1.139 25699
624 1 6 . 1 1 29 29 THR H H 29 7.723 7.723 7.747 -0.024 25699
625 1 7 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.493 -0.414 25699
626 1 7 . 1 1 2 2 ALA CA C 2 52.826 52.826 51.348 1.478 25699
627 1 7 . 1 1 2 2 ALA CB C 2 21.988 21.988 17.764 4.224 25699
628 1 7 . 1 1 2 2 ALA H H 2 8.067 8.067 7.521 0.546 25699
629 1 7 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.369 -0.337 25699
630 1 7 . 1 1 3 3 GLU CB C 3 29.563 29.563 30.530 -0.967 25699
631 1 7 . 1 1 3 3 GLU H H 3 8.592 8.592 8.277 0.315 25699
632 1 7 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.239 -0.109 25699
633 1 7 . 1 1 4 4 LYS CA C 4 56.839 56.839 58.082 -1.243 25699
634 1 7 . 1 1 4 4 LYS CB C 4 32.806 32.806 32.977 -0.171 25699
635 1 7 . 1 1 4 4 LYS H H 4 8.205 8.205 8.276 -0.071 25699
636 1 7 . 1 1 5 5 VAL HA H 5 3.868 3.868 4.334 -0.466 25699
637 1 7 . 1 1 5 5 VAL CA C 5 62.947 62.947 60.895 2.051 25699
638 1 7 . 1 1 5 5 VAL CB C 5 32.536 32.536 30.803 1.733 25699
639 1 7 . 1 1 5 5 VAL H H 5 7.807 7.807 7.978 -0.171 25699
640 1 7 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.640 -0.562 25699
641 1 7 . 1 1 6 6 ALA CA C 6 53.076 53.076 52.777 0.299 25699
642 1 7 . 1 1 6 6 ALA CB C 6 19.007 19.007 20.963 -1.956 25699
643 1 7 . 1 1 6 6 ALA H H 6 8.101 8.101 7.708 0.393 25699
644 1 7 . 1 1 7 7 GLN HA H 7 4.072 4.072 4.027 0.045 25699
645 1 7 . 1 1 7 7 GLN CB C 7 29.413 29.413 27.934 1.479 25699
646 1 7 . 1 1 7 7 GLN H H 7 8.065 8.065 8.271 -0.206 25699
647 1 7 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.022 0.058 25699
648 1 7 . 1 1 8 8 GLU CA C 8 56.439 56.439 58.295 -1.856 25699
649 1 7 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.442 0.111 25699
650 1 7 . 1 1 8 8 GLU H H 8 8.182 8.182 8.468 -0.286 25699
651 1 7 . 1 1 9 9 LYS HA H 9 4.007 4.007 4.337 -0.330 25699
652 1 7 . 1 1 9 9 LYS CA C 9 57.773 57.773 56.091 1.682 25699
653 1 7 . 1 1 9 9 LYS CB C 9 32.979 32.979 35.560 -2.581 25699
654 1 7 . 1 1 9 9 LYS H H 9 8.048 8.048 7.449 0.599 25699
655 1 7 . 1 1 10 10 GLY CA C 10 45.562 45.562 45.676 -0.114 25699
656 1 7 . 1 1 10 10 GLY H H 10 8.305 8.305 7.599 0.706 25699
657 1 7 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.715 -0.631 25699
658 1 7 . 1 1 11 11 PHE CB C 11 39.831 39.831 39.768 0.063 25699
659 1 7 . 1 1 11 11 PHE H H 11 8.761 8.761 8.391 0.370 25699
660 1 7 . 1 1 12 12 LEU HA H 12 3.776 3.776 3.810 -0.034 25699
661 1 7 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.335 0.777 25699
662 1 7 . 1 1 12 12 LEU CB C 12 41.197 41.197 41.109 0.088 25699
663 1 7 . 1 1 12 12 LEU H H 12 8.728 8.728 7.999 0.729 25699
664 1 7 . 1 1 13 13 TYR HA H 13 4.042 4.042 4.027 0.015 25699
665 1 7 . 1 1 13 13 TYR CA C 13 61.091 61.091 61.214 -0.123 25699
666 1 7 . 1 1 13 13 TYR CB C 13 37.856 37.856 37.970 -0.114 25699
667 1 7 . 1 1 13 13 TYR H H 13 8.199 8.199 8.175 0.024 25699
668 1 7 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.586 0.188 25699
669 1 7 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.662 2.057 25699
670 1 7 . 1 1 14 14 ARG H H 14 8.047 8.047 7.496 0.551 25699
671 1 7 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.011 -0.144 25699
672 1 7 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.570 3.548 25699
673 1 7 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.495 2.804 25699
674 1 7 . 1 1 15 15 LEU H H 15 8.048 8.048 7.076 0.972 25699
675 1 7 . 1 1 16 16 THR HA H 16 4.079 4.079 4.499 -0.420 25699
676 1 7 . 1 1 16 16 THR CA C 16 61.604 61.604 60.017 1.587 25699
677 1 7 . 1 1 16 16 THR CB C 16 66.014 66.014 71.885 -5.871 25699
678 1 7 . 1 1 16 16 THR H H 16 7.825 7.825 7.959 -0.134 25699
679 1 7 . 1 1 17 17 SER HA H 17 3.925 3.925 3.951 -0.026 25699
680 1 7 . 1 1 17 17 SER CA C 17 61.613 61.613 61.297 0.316 25699
681 1 7 . 1 1 17 17 SER CB C 17 62.836 62.836 62.937 -0.101 25699
682 1 7 . 1 1 17 17 SER H H 17 7.824 7.824 8.713 -0.889 25699
683 1 7 . 1 1 18 18 ARG HA H 18 3.997 3.997 3.662 0.335 25699
684 1 7 . 1 1 18 18 ARG CA C 18 58.150 58.150 59.106 -0.956 25699
685 1 7 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.402 0.664 25699
686 1 7 . 1 1 18 18 ARG H H 18 7.580 7.580 8.466 -0.886 25699
687 1 7 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.320 -0.062 25699
688 1 7 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.376 -0.879 25699
689 1 7 . 1 1 19 19 TYR H H 19 7.816 7.816 7.412 0.404 25699
690 1 7 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.780 -0.062 25699
691 1 7 . 1 1 20 20 ARG CA C 20 58.939 58.939 59.569 -0.630 25699
692 1 7 . 1 1 20 20 ARG CB C 20 30.009 30.009 30.055 -0.046 25699
693 1 7 . 1 1 20 20 ARG H H 20 7.864 7.864 8.068 -0.204 25699
694 1 7 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.003 0.343 25699
695 1 7 . 1 1 21 21 HIS CA C 21 57.378 57.378 57.589 -0.211 25699
696 1 7 . 1 1 21 21 HIS CB C 21 28.660 28.660 29.785 -1.125 25699
697 1 7 . 1 1 21 21 HIS H H 21 7.900 7.900 7.801 0.099 25699
698 1 7 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.227 -0.036 25699
699 1 7 . 1 1 22 22 TYR CA C 22 59.853 59.853 60.795 -0.942 25699
700 1 7 . 1 1 22 22 TYR H H 22 7.680 7.680 7.717 -0.037 25699
701 1 7 . 1 1 23 23 ALA HA H 23 3.880 3.880 4.439 -0.559 25699
702 1 7 . 1 1 23 23 ALA CA C 23 53.293 53.293 53.546 -0.253 25699
703 1 7 . 1 1 23 23 ALA CB C 23 18.596 18.596 17.796 0.800 25699
704 1 7 . 1 1 23 23 ALA H H 23 8.030 8.030 7.989 0.041 25699
705 1 7 . 1 1 24 24 ALA HA H 24 4.025 4.025 4.202 -0.177 25699
706 1 7 . 1 1 24 24 ALA CA C 24 52.985 52.985 52.829 0.156 25699
707 1 7 . 1 1 24 24 ALA CB C 24 18.873 18.873 18.671 0.202 25699
708 1 7 . 1 1 24 24 ALA H H 24 7.390 7.390 7.585 -0.195 25699
709 1 7 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.762 -0.394 25699
710 1 7 . 1 1 25 25 PHE CA C 25 58.247 58.247 57.974 0.274 25699
711 1 7 . 1 1 25 25 PHE CB C 25 39.360 39.360 39.891 -0.531 25699
712 1 7 . 1 1 25 25 PHE H H 25 7.694 7.694 7.511 0.183 25699
713 1 7 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.021 0.045 25699
714 1 7 . 1 1 26 26 GLU CA C 26 57.011 57.011 59.469 -2.458 25699
715 1 7 . 1 1 26 26 GLU CB C 26 30.081 30.081 29.838 0.243 25699
716 1 7 . 1 1 26 26 GLU H H 26 8.068 8.068 8.598 -0.530 25699
717 1 7 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.415 -0.320 25699
718 1 7 . 1 1 27 27 ARG CA C 27 56.260 56.260 56.204 0.056 25699
719 1 7 . 1 1 27 27 ARG CB C 27 30.799 30.799 32.463 -1.664 25699
720 1 7 . 1 1 27 27 ARG H H 27 7.976 7.976 7.813 0.163 25699
721 1 7 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.239 -0.068 25699
722 1 7 . 1 1 28 28 ALA CA C 28 52.581 52.581 53.474 -0.893 25699
723 1 7 . 1 1 28 28 ALA CB C 28 19.382 19.382 16.906 2.476 25699
724 1 7 . 1 1 28 28 ALA H H 28 8.012 8.012 8.254 -0.242 25699
725 1 7 . 1 1 29 29 THR HA H 29 4.112 4.112 4.096 0.016 25699
726 1 7 . 1 1 29 29 THR CA C 29 61.661 61.661 62.930 -1.269 25699
727 1 7 . 1 1 29 29 THR CB C 29 70.032 70.032 68.909 1.123 25699
728 1 7 . 1 1 29 29 THR H H 29 7.723 7.723 7.817 -0.094 25699
729 1 8 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.716 -0.637 25699
730 1 8 . 1 1 2 2 ALA CA C 2 52.826 52.826 52.037 0.789 25699
731 1 8 . 1 1 2 2 ALA CB C 2 21.988 21.988 20.285 1.703 25699
732 1 8 . 1 1 2 2 ALA H H 2 8.067 8.067 7.783 0.284 25699
733 1 8 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.490 -0.458 25699
734 1 8 . 1 1 3 3 GLU CB C 3 29.563 29.563 30.526 -0.963 25699
735 1 8 . 1 1 3 3 GLU H H 3 8.592 8.592 8.909 -0.317 25699
736 1 8 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.349 -0.219 25699
737 1 8 . 1 1 4 4 LYS CA C 4 56.839 56.839 57.410 -0.570 25699
738 1 8 . 1 1 4 4 LYS CB C 4 32.806 32.806 33.157 -0.351 25699
739 1 8 . 1 1 4 4 LYS H H 4 8.205 8.205 8.397 -0.192 25699
740 1 8 . 1 1 5 5 VAL HA H 5 3.868 3.868 4.047 -0.179 25699
741 1 8 . 1 1 5 5 VAL CA C 5 62.947 62.947 61.348 1.599 25699
742 1 8 . 1 1 5 5 VAL CB C 5 32.536 32.536 29.596 2.941 25699
743 1 8 . 1 1 5 5 VAL H H 5 7.807 7.807 8.325 -0.518 25699
744 1 8 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.381 -0.303 25699
745 1 8 . 1 1 6 6 ALA CA C 6 53.076 53.076 53.429 -0.353 25699
746 1 8 . 1 1 6 6 ALA CB C 6 19.007 19.007 20.469 -1.462 25699
747 1 8 . 1 1 6 6 ALA H H 6 8.101 8.101 7.119 0.982 25699
748 1 8 . 1 1 7 7 GLN HA H 7 4.072 4.072 4.212 -0.140 25699
749 1 8 . 1 1 7 7 GLN CB C 7 29.413 29.413 28.567 0.846 25699
750 1 8 . 1 1 7 7 GLN H H 7 8.065 8.065 8.200 -0.135 25699
751 1 8 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.003 0.077 25699
752 1 8 . 1 1 8 8 GLU CA C 8 56.439 56.439 57.295 -0.856 25699
753 1 8 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.513 0.040 25699
754 1 8 . 1 1 8 8 GLU H H 8 8.182 8.182 7.403 0.779 25699
755 1 8 . 1 1 9 9 LYS HA H 9 4.007 4.007 3.964 0.043 25699
756 1 8 . 1 1 9 9 LYS CA C 9 57.773 57.773 56.752 1.021 25699
757 1 8 . 1 1 9 9 LYS CB C 9 32.979 32.979 31.152 1.827 25699
758 1 8 . 1 1 9 9 LYS H H 9 8.048 8.048 8.812 -0.764 25699
759 1 8 . 1 1 10 10 GLY CA C 10 45.562 45.562 44.702 0.860 25699
760 1 8 . 1 1 10 10 GLY H H 10 8.305 8.305 7.583 0.722 25699
761 1 8 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.273 -0.189 25699
762 1 8 . 1 1 11 11 PHE CB C 11 39.831 39.831 39.523 0.308 25699
763 1 8 . 1 1 11 11 PHE H H 11 8.761 8.761 8.707 0.054 25699
764 1 8 . 1 1 12 12 LEU HA H 12 3.776 3.776 3.951 -0.175 25699
765 1 8 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.409 0.703 25699
766 1 8 . 1 1 12 12 LEU CB C 12 41.197 41.197 41.079 0.118 25699
767 1 8 . 1 1 12 12 LEU H H 12 8.728 8.728 7.794 0.934 25699
768 1 8 . 1 1 13 13 TYR HA H 13 4.042 4.042 3.907 0.135 25699
769 1 8 . 1 1 13 13 TYR CA C 13 61.091 61.091 61.871 -0.780 25699
770 1 8 . 1 1 13 13 TYR CB C 13 37.856 37.856 38.322 -0.466 25699
771 1 8 . 1 1 13 13 TYR H H 13 8.199 8.199 7.587 0.612 25699
772 1 8 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.624 0.150 25699
773 1 8 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.996 1.723 25699
774 1 8 . 1 1 14 14 ARG H H 14 8.047 8.047 7.499 0.548 25699
775 1 8 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.111 -0.244 25699
776 1 8 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.492 3.626 25699
777 1 8 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.629 2.670 25699
778 1 8 . 1 1 15 15 LEU H H 15 8.048 8.048 7.428 0.620 25699
779 1 8 . 1 1 16 16 THR HA H 16 4.079 4.079 4.492 -0.413 25699
780 1 8 . 1 1 16 16 THR CA C 16 61.604 61.604 59.620 1.984 25699
781 1 8 . 1 1 16 16 THR CB C 16 66.014 66.014 71.217 -5.203 25699
782 1 8 . 1 1 16 16 THR H H 16 7.825 7.825 7.921 -0.096 25699
783 1 8 . 1 1 17 17 SER HA H 17 3.925 3.925 4.315 -0.390 25699
784 1 8 . 1 1 17 17 SER CA C 17 61.613 61.613 60.146 1.467 25699
785 1 8 . 1 1 17 17 SER CB C 17 62.836 62.836 62.879 -0.043 25699
786 1 8 . 1 1 17 17 SER H H 17 7.824 7.824 8.648 -0.824 25699
787 1 8 . 1 1 18 18 ARG HA H 18 3.997 3.997 3.856 0.141 25699
788 1 8 . 1 1 18 18 ARG CA C 18 58.150 58.150 58.014 0.136 25699
789 1 8 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.112 0.954 25699
790 1 8 . 1 1 18 18 ARG H H 18 7.580 7.580 8.428 -0.848 25699
791 1 8 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.325 -0.067 25699
792 1 8 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.869 -1.372 25699
793 1 8 . 1 1 19 19 TYR H H 19 7.816 7.816 7.592 0.224 25699
794 1 8 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.805 -0.087 25699
795 1 8 . 1 1 20 20 ARG CA C 20 58.939 58.939 58.930 0.009 25699
796 1 8 . 1 1 20 20 ARG CB C 20 30.009 30.009 30.075 -0.066 25699
797 1 8 . 1 1 20 20 ARG H H 20 7.864 7.864 7.543 0.321 25699
798 1 8 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.172 0.174 25699
799 1 8 . 1 1 21 21 HIS CA C 21 57.378 57.378 57.682 -0.304 25699
800 1 8 . 1 1 21 21 HIS CB C 21 28.660 28.660 30.183 -1.523 25699
801 1 8 . 1 1 21 21 HIS H H 21 7.900 7.900 7.495 0.405 25699
802 1 8 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.146 0.045 25699
803 1 8 . 1 1 22 22 TYR CA C 22 59.853 59.853 61.386 -1.533 25699
804 1 8 . 1 1 22 22 TYR H H 22 7.680 7.680 8.618 -0.938 25699
805 1 8 . 1 1 23 23 ALA HA H 23 3.880 3.880 4.343 -0.463 25699
806 1 8 . 1 1 23 23 ALA CA C 23 53.293 53.293 54.015 -0.722 25699
807 1 8 . 1 1 23 23 ALA CB C 23 18.596 18.596 17.398 1.198 25699
808 1 8 . 1 1 23 23 ALA H H 23 8.030 8.030 8.242 -0.212 25699
809 1 8 . 1 1 24 24 ALA HA H 24 4.025 4.025 4.253 -0.228 25699
810 1 8 . 1 1 24 24 ALA CA C 24 52.985 52.985 53.282 -0.297 25699
811 1 8 . 1 1 24 24 ALA CB C 24 18.873 18.873 18.660 0.212 25699
812 1 8 . 1 1 24 24 ALA H H 24 7.390 7.390 7.572 -0.182 25699
813 1 8 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.755 -0.387 25699
814 1 8 . 1 1 25 25 PHE CA C 25 58.247 58.247 57.963 0.284 25699
815 1 8 . 1 1 25 25 PHE CB C 25 39.360 39.360 39.886 -0.526 25699
816 1 8 . 1 1 25 25 PHE H H 25 7.694 7.694 7.491 0.203 25699
817 1 8 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.053 0.013 25699
818 1 8 . 1 1 26 26 GLU CA C 26 57.011 57.011 59.513 -2.502 25699
819 1 8 . 1 1 26 26 GLU CB C 26 30.081 30.081 29.900 0.181 25699
820 1 8 . 1 1 26 26 GLU H H 26 8.068 8.068 8.470 -0.402 25699
821 1 8 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.429 -0.334 25699
822 1 8 . 1 1 27 27 ARG CA C 27 56.260 56.260 56.245 0.015 25699
823 1 8 . 1 1 27 27 ARG CB C 27 30.799 30.799 32.454 -1.655 25699
824 1 8 . 1 1 27 27 ARG H H 27 7.976 7.976 7.857 0.119 25699
825 1 8 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.248 -0.077 25699
826 1 8 . 1 1 28 28 ALA CA C 28 52.581 52.581 53.435 -0.855 25699
827 1 8 . 1 1 28 28 ALA CB C 28 19.382 19.382 16.919 2.463 25699
828 1 8 . 1 1 28 28 ALA H H 28 8.012 8.012 8.223 -0.211 25699
829 1 8 . 1 1 29 29 THR HA H 29 4.112 4.112 4.056 0.056 25699
830 1 8 . 1 1 29 29 THR CA C 29 61.661 61.661 63.328 -1.667 25699
831 1 8 . 1 1 29 29 THR CB C 29 70.032 70.032 69.082 0.950 25699
832 1 8 . 1 1 29 29 THR H H 29 7.723 7.723 7.851 -0.128 25699
833 1 9 . 1 1 2 2 ALA HA H 2 4.079 4.079 3.750 0.329 25699
834 1 9 . 1 1 2 2 ALA CA C 2 52.826 52.826 53.575 -0.749 25699
835 1 9 . 1 1 2 2 ALA CB C 2 21.988 21.988 17.410 4.578 25699
836 1 9 . 1 1 2 2 ALA H H 2 8.067 8.067 7.994 0.073 25699
837 1 9 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.321 -0.289 25699
838 1 9 . 1 1 3 3 GLU CB C 3 29.563 29.563 29.558 0.005 25699
839 1 9 . 1 1 3 3 GLU H H 3 8.592 8.592 8.049 0.543 25699
840 1 9 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.102 0.028 25699
841 1 9 . 1 1 4 4 LYS CA C 4 56.839 56.839 56.736 0.103 25699
842 1 9 . 1 1 4 4 LYS CB C 4 32.806 32.806 32.182 0.624 25699
843 1 9 . 1 1 4 4 LYS H H 4 8.205 8.205 8.024 0.181 25699
844 1 9 . 1 1 5 5 VAL HA H 5 3.868 3.868 4.084 -0.216 25699
845 1 9 . 1 1 5 5 VAL CA C 5 62.947 62.947 63.701 -0.754 25699
846 1 9 . 1 1 5 5 VAL CB C 5 32.536 32.536 32.552 -0.016 25699
847 1 9 . 1 1 5 5 VAL H H 5 7.807 7.807 7.786 0.021 25699
848 1 9 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.346 -0.268 25699
849 1 9 . 1 1 6 6 ALA CA C 6 53.076 53.076 54.579 -1.503 25699
850 1 9 . 1 1 6 6 ALA CB C 6 19.007 19.007 18.697 0.310 25699
851 1 9 . 1 1 6 6 ALA H H 6 8.101 8.101 7.817 0.284 25699
852 1 9 . 1 1 7 7 GLN HA H 7 4.072 4.072 4.120 -0.048 25699
853 1 9 . 1 1 7 7 GLN CB C 7 29.413 29.413 28.401 1.012 25699
854 1 9 . 1 1 7 7 GLN H H 7 8.065 8.065 8.483 -0.418 25699
855 1 9 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.341 -0.261 25699
856 1 9 . 1 1 8 8 GLU CA C 8 56.439 56.439 55.538 0.901 25699
857 1 9 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.879 -0.326 25699
858 1 9 . 1 1 8 8 GLU H H 8 8.182 8.182 7.774 0.408 25699
859 1 9 . 1 1 9 9 LYS HA H 9 4.007 4.007 3.973 0.034 25699
860 1 9 . 1 1 9 9 LYS CA C 9 57.773 57.773 56.582 1.191 25699
861 1 9 . 1 1 9 9 LYS CB C 9 32.979 32.979 30.435 2.544 25699
862 1 9 . 1 1 9 9 LYS H H 9 8.048 8.048 8.721 -0.673 25699
863 1 9 . 1 1 10 10 GLY CA C 10 45.562 45.562 45.202 0.360 25699
864 1 9 . 1 1 10 10 GLY H H 10 8.305 8.305 7.927 0.378 25699
865 1 9 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.705 -0.621 25699
866 1 9 . 1 1 11 11 PHE CB C 11 39.831 39.831 39.774 0.057 25699
867 1 9 . 1 1 11 11 PHE H H 11 8.761 8.761 8.395 0.366 25699
868 1 9 . 1 1 12 12 LEU HA H 12 3.776 3.776 3.918 -0.142 25699
869 1 9 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.556 0.556 25699
870 1 9 . 1 1 12 12 LEU CB C 12 41.197 41.197 40.936 0.261 25699
871 1 9 . 1 1 12 12 LEU H H 12 8.728 8.728 8.199 0.529 25699
872 1 9 . 1 1 13 13 TYR HA H 13 4.042 4.042 3.972 0.070 25699
873 1 9 . 1 1 13 13 TYR CA C 13 61.091 61.091 61.508 -0.417 25699
874 1 9 . 1 1 13 13 TYR CB C 13 37.856 37.856 38.128 -0.272 25699
875 1 9 . 1 1 13 13 TYR H H 13 8.199 8.199 7.829 0.370 25699
876 1 9 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.676 0.098 25699
877 1 9 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.950 1.769 25699
878 1 9 . 1 1 14 14 ARG H H 14 8.047 8.047 7.606 0.441 25699
879 1 9 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.150 -0.283 25699
880 1 9 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.635 3.483 25699
881 1 9 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.672 2.627 25699
882 1 9 . 1 1 15 15 LEU H H 15 8.048 8.048 7.181 0.867 25699
883 1 9 . 1 1 16 16 THR HA H 16 4.079 4.079 4.542 -0.463 25699
884 1 9 . 1 1 16 16 THR CA C 16 61.604 61.604 60.020 1.584 25699
885 1 9 . 1 1 16 16 THR CB C 16 66.014 66.014 71.492 -5.478 25699
886 1 9 . 1 1 16 16 THR H H 16 7.825 7.825 8.025 -0.200 25699
887 1 9 . 1 1 17 17 SER HA H 17 3.925 3.925 3.993 -0.068 25699
888 1 9 . 1 1 17 17 SER CA C 17 61.613 61.613 61.323 0.290 25699
889 1 9 . 1 1 17 17 SER CB C 17 62.836 62.836 63.064 -0.228 25699
890 1 9 . 1 1 17 17 SER H H 17 7.824 7.824 8.596 -0.772 25699
891 1 9 . 1 1 18 18 ARG HA H 18 3.997 3.997 3.837 0.160 25699
892 1 9 . 1 1 18 18 ARG CA C 18 58.150 58.150 59.409 -1.259 25699
893 1 9 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.509 0.557 25699
894 1 9 . 1 1 18 18 ARG H H 18 7.580 7.580 8.526 -0.946 25699
895 1 9 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.273 -0.015 25699
896 1 9 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.355 -0.858 25699
897 1 9 . 1 1 19 19 TYR H H 19 7.816 7.816 7.602 0.214 25699
898 1 9 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.720 -0.002 25699
899 1 9 . 1 1 20 20 ARG CA C 20 58.939 58.939 58.989 -0.050 25699
900 1 9 . 1 1 20 20 ARG CB C 20 30.009 30.009 29.791 0.218 25699
901 1 9 . 1 1 20 20 ARG H H 20 7.864 7.864 7.677 0.187 25699
902 1 9 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.289 0.057 25699
903 1 9 . 1 1 21 21 HIS CA C 21 57.378 57.378 58.789 -1.411 25699
904 1 9 . 1 1 21 21 HIS CB C 21 28.660 28.660 30.410 -1.750 25699
905 1 9 . 1 1 21 21 HIS H H 21 7.900 7.900 7.632 0.268 25699
906 1 9 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.396 -0.205 25699
907 1 9 . 1 1 22 22 TYR CA C 22 59.853 59.853 60.044 -0.191 25699
908 1 9 . 1 1 22 22 TYR H H 22 7.680 7.680 8.622 -0.942 25699
909 1 9 . 1 1 23 23 ALA HA H 23 3.880 3.880 3.859 0.021 25699
910 1 9 . 1 1 23 23 ALA CA C 23 53.293 53.293 53.403 -0.110 25699
911 1 9 . 1 1 23 23 ALA CB C 23 18.596 18.596 17.359 1.237 25699
912 1 9 . 1 1 23 23 ALA H H 23 8.030 8.030 7.533 0.497 25699
913 1 9 . 1 1 24 24 ALA HA H 24 4.025 4.025 3.951 0.074 25699
914 1 9 . 1 1 24 24 ALA CA C 24 52.985 52.985 53.707 -0.722 25699
915 1 9 . 1 1 24 24 ALA CB C 24 18.873 18.873 18.766 0.107 25699
916 1 9 . 1 1 24 24 ALA H H 24 7.390 7.390 7.466 -0.076 25699
917 1 9 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.576 -0.208 25699
918 1 9 . 1 1 25 25 PHE CA C 25 58.247 58.247 60.194 -1.947 25699
919 1 9 . 1 1 25 25 PHE CB C 25 39.360 39.360 39.200 0.160 25699
920 1 9 . 1 1 25 25 PHE H H 25 7.694 7.694 7.475 0.219 25699
921 1 9 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.292 -0.226 25699
922 1 9 . 1 1 26 26 GLU CA C 26 57.011 57.011 58.483 -1.472 25699
923 1 9 . 1 1 26 26 GLU CB C 26 30.081 30.081 29.497 0.584 25699
924 1 9 . 1 1 26 26 GLU H H 26 8.068 8.068 8.385 -0.317 25699
925 1 9 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.227 -0.132 25699
926 1 9 . 1 1 27 27 ARG CA C 27 56.260 56.260 54.616 1.644 25699
927 1 9 . 1 1 27 27 ARG CB C 27 30.799 30.799 29.350 1.449 25699
928 1 9 . 1 1 27 27 ARG H H 27 7.976 7.976 7.391 0.585 25699
929 1 9 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.128 0.043 25699
930 1 9 . 1 1 28 28 ALA CA C 28 52.581 52.581 54.556 -1.974 25699
931 1 9 . 1 1 28 28 ALA CB C 28 19.382 19.382 18.438 0.944 25699
932 1 9 . 1 1 28 28 ALA H H 28 8.012 8.012 7.460 0.552 25699
933 1 9 . 1 1 29 29 THR HA H 29 4.112 4.112 4.254 -0.142 25699
934 1 9 . 1 1 29 29 THR CA C 29 61.661 61.661 64.112 -2.451 25699
935 1 9 . 1 1 29 29 THR CB C 29 70.032 70.032 69.207 0.825 25699
936 1 9 . 1 1 29 29 THR H H 29 7.723 7.723 8.649 -0.926 25699
937 1 10 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.526 -0.447 25699
938 1 10 . 1 1 2 2 ALA CA C 2 52.826 52.826 51.479 1.347 25699
939 1 10 . 1 1 2 2 ALA CB C 2 21.988 21.988 18.447 3.541 25699
940 1 10 . 1 1 2 2 ALA H H 2 8.067 8.067 7.434 0.633 25699
941 1 10 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.378 -0.346 25699
942 1 10 . 1 1 3 3 GLU CB C 3 29.563 29.563 30.302 -0.739 25699
943 1 10 . 1 1 3 3 GLU H H 3 8.592 8.592 8.678 -0.086 25699
944 1 10 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.435 -0.305 25699
945 1 10 . 1 1 4 4 LYS CA C 4 56.839 56.839 57.611 -0.772 25699
946 1 10 . 1 1 4 4 LYS CB C 4 32.806 32.806 32.476 0.330 25699
947 1 10 . 1 1 4 4 LYS H H 4 8.205 8.205 8.365 -0.160 25699
948 1 10 . 1 1 5 5 VAL HA H 5 3.868 3.868 3.734 0.134 25699
949 1 10 . 1 1 5 5 VAL CA C 5 62.947 62.947 64.138 -1.191 25699
950 1 10 . 1 1 5 5 VAL CB C 5 32.536 32.536 31.295 1.241 25699
951 1 10 . 1 1 5 5 VAL H H 5 7.807 7.807 7.865 -0.058 25699
952 1 10 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.080 -0.002 25699
953 1 10 . 1 1 6 6 ALA CA C 6 53.076 53.076 55.006 -1.930 25699
954 1 10 . 1 1 6 6 ALA CB C 6 19.007 19.007 18.526 0.481 25699
955 1 10 . 1 1 6 6 ALA H H 6 8.101 8.101 7.778 0.323 25699
956 1 10 . 1 1 7 7 GLN HA H 7 4.072 4.072 4.096 -0.024 25699
957 1 10 . 1 1 7 7 GLN CB C 7 29.413 29.413 28.323 1.090 25699
958 1 10 . 1 1 7 7 GLN H H 7 8.065 8.065 8.349 -0.284 25699
959 1 10 . 1 1 8 8 GLU HA H 8 4.080 4.080 3.997 0.083 25699
960 1 10 . 1 1 8 8 GLU CA C 8 56.439 56.439 57.114 -0.675 25699
961 1 10 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.721 -0.168 25699
962 1 10 . 1 1 8 8 GLU H H 8 8.182 8.182 7.600 0.582 25699
963 1 10 . 1 1 9 9 LYS HA H 9 4.007 4.007 3.891 0.116 25699
964 1 10 . 1 1 9 9 LYS CA C 9 57.773 57.773 56.539 1.234 25699
965 1 10 . 1 1 9 9 LYS CB C 9 32.979 32.979 31.257 1.722 25699
966 1 10 . 1 1 9 9 LYS H H 9 8.048 8.048 8.684 -0.636 25699
967 1 10 . 1 1 10 10 GLY CA C 10 45.562 45.562 44.701 0.861 25699
968 1 10 . 1 1 10 10 GLY H H 10 8.305 8.305 7.459 0.846 25699
969 1 10 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.489 -0.405 25699
970 1 10 . 1 1 11 11 PHE CB C 11 39.831 39.831 39.598 0.233 25699
971 1 10 . 1 1 11 11 PHE H H 11 8.761 8.761 8.448 0.313 25699
972 1 10 . 1 1 12 12 LEU HA H 12 3.776 3.776 3.982 -0.206 25699
973 1 10 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.370 0.742 25699
974 1 10 . 1 1 12 12 LEU CB C 12 41.197 41.197 40.915 0.282 25699
975 1 10 . 1 1 12 12 LEU H H 12 8.728 8.728 8.144 0.584 25699
976 1 10 . 1 1 13 13 TYR HA H 13 4.042 4.042 4.067 -0.025 25699
977 1 10 . 1 1 13 13 TYR CA C 13 61.091 61.091 61.016 0.075 25699
978 1 10 . 1 1 13 13 TYR CB C 13 37.856 37.856 38.264 -0.408 25699
979 1 10 . 1 1 13 13 TYR H H 13 8.199 8.199 7.906 0.293 25699
980 1 10 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.631 0.143 25699
981 1 10 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.581 2.138 25699
982 1 10 . 1 1 14 14 ARG H H 14 8.047 8.047 7.426 0.621 25699
983 1 10 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.181 -0.314 25699
984 1 10 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.372 3.746 25699
985 1 10 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.430 2.869 25699
986 1 10 . 1 1 15 15 LEU H H 15 8.048 8.048 7.276 0.772 25699
987 1 10 . 1 1 16 16 THR HA H 16 4.079 4.079 4.615 -0.536 25699
988 1 10 . 1 1 16 16 THR CA C 16 61.604 61.604 60.071 1.533 25699
989 1 10 . 1 1 16 16 THR CB C 16 66.014 66.014 71.337 -5.323 25699
990 1 10 . 1 1 16 16 THR H H 16 7.825 7.825 7.995 -0.170 25699
991 1 10 . 1 1 17 17 SER HA H 17 3.925 3.925 4.426 -0.501 25699
992 1 10 . 1 1 17 17 SER CA C 17 61.613 61.613 60.151 1.462 25699
993 1 10 . 1 1 17 17 SER CB C 17 62.836 62.836 62.847 -0.011 25699
994 1 10 . 1 1 17 17 SER H H 17 7.824 7.824 8.660 -0.836 25699
995 1 10 . 1 1 18 18 ARG HA H 18 3.997 3.997 3.852 0.145 25699
996 1 10 . 1 1 18 18 ARG CA C 18 58.150 58.150 57.585 0.565 25699
997 1 10 . 1 1 18 18 ARG CB C 18 30.066 30.066 28.944 1.122 25699
998 1 10 . 1 1 18 18 ARG H H 18 7.580 7.580 8.146 -0.566 25699
999 1 10 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.414 -0.156 25699
1000 1 10 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.401 -0.904 25699
1001 1 10 . 1 1 19 19 TYR H H 19 7.816 7.816 7.639 0.177 25699
1002 1 10 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.670 0.048 25699
1003 1 10 . 1 1 20 20 ARG CA C 20 58.939 58.939 59.411 -0.472 25699
1004 1 10 . 1 1 20 20 ARG CB C 20 30.009 30.009 29.753 0.256 25699
1005 1 10 . 1 1 20 20 ARG H H 20 7.864 7.864 7.709 0.155 25699
1006 1 10 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.315 0.031 25699
1007 1 10 . 1 1 21 21 HIS CA C 21 57.378 57.378 59.534 -2.156 25699
1008 1 10 . 1 1 21 21 HIS CB C 21 28.660 28.660 29.766 -1.106 25699
1009 1 10 . 1 1 21 21 HIS H H 21 7.900 7.900 7.385 0.515 25699
1010 1 10 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.264 -0.073 25699
1011 1 10 . 1 1 22 22 TYR CA C 22 59.853 59.853 59.076 0.777 25699
1012 1 10 . 1 1 22 22 TYR H H 22 7.680 7.680 7.763 -0.083 25699
1013 1 10 . 1 1 23 23 ALA HA H 23 3.880 3.880 4.233 -0.353 25699
1014 1 10 . 1 1 23 23 ALA CA C 23 53.293 53.293 54.058 -0.765 25699
1015 1 10 . 1 1 23 23 ALA CB C 23 18.596 18.596 17.852 0.744 25699
1016 1 10 . 1 1 23 23 ALA H H 23 8.030 8.030 7.958 0.072 25699
1017 1 10 . 1 1 24 24 ALA HA H 24 4.025 4.025 4.120 -0.095 25699
1018 1 10 . 1 1 24 24 ALA CA C 24 52.985 52.985 54.108 -1.123 25699
1019 1 10 . 1 1 24 24 ALA CB C 24 18.873 18.873 19.079 -0.206 25699
1020 1 10 . 1 1 24 24 ALA H H 24 7.390 7.390 7.903 -0.513 25699
1021 1 10 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.574 -0.206 25699
1022 1 10 . 1 1 25 25 PHE CA C 25 58.247 58.247 60.302 -2.055 25699
1023 1 10 . 1 1 25 25 PHE CB C 25 39.360 39.360 39.857 -0.497 25699
1024 1 10 . 1 1 25 25 PHE H H 25 7.694 7.694 7.621 0.073 25699
1025 1 10 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.327 -0.261 25699
1026 1 10 . 1 1 26 26 GLU CA C 26 57.011 57.011 58.840 -1.829 25699
1027 1 10 . 1 1 26 26 GLU CB C 26 30.081 30.081 29.723 0.358 25699
1028 1 10 . 1 1 26 26 GLU H H 26 8.068 8.068 8.517 -0.449 25699
1029 1 10 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.491 -0.396 25699
1030 1 10 . 1 1 27 27 ARG CA C 27 56.260 56.260 54.926 1.334 25699
1031 1 10 . 1 1 27 27 ARG CB C 27 30.799 30.799 29.945 0.854 25699
1032 1 10 . 1 1 27 27 ARG H H 27 7.976 7.976 7.523 0.453 25699
1033 1 10 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.160 0.011 25699
1034 1 10 . 1 1 28 28 ALA CA C 28 52.581 52.581 54.398 -1.817 25699
1035 1 10 . 1 1 28 28 ALA CB C 28 19.382 19.382 18.381 1.001 25699
1036 1 10 . 1 1 28 28 ALA H H 28 8.012 8.012 7.400 0.612 25699
1037 1 10 . 1 1 29 29 THR HA H 29 4.112 4.112 4.201 -0.089 25699
1038 1 10 . 1 1 29 29 THR CA C 29 61.661 61.661 63.773 -2.112 25699
1039 1 10 . 1 1 29 29 THR CB C 29 70.032 70.032 69.157 0.875 25699
1040 1 10 . 1 1 29 29 THR H H 29 7.723 7.723 8.570 -0.847 25699
1041 1 11 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.697 -0.618 25699
1042 1 11 . 1 1 2 2 ALA CA C 2 52.826 52.826 51.205 1.621 25699
1043 1 11 . 1 1 2 2 ALA CB C 2 21.988 21.988 21.680 0.308 25699
1044 1 11 . 1 1 2 2 ALA H H 2 8.067 8.067 7.985 0.082 25699
1045 1 11 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.292 -0.260 25699
1046 1 11 . 1 1 3 3 GLU CB C 3 29.563 29.563 30.181 -0.618 25699
1047 1 11 . 1 1 3 3 GLU H H 3 8.592 8.592 8.230 0.362 25699
1048 1 11 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.077 0.053 25699
1049 1 11 . 1 1 4 4 LYS CA C 4 56.839 56.839 58.864 -2.025 25699
1050 1 11 . 1 1 4 4 LYS CB C 4 32.806 32.806 32.306 0.500 25699
1051 1 11 . 1 1 4 4 LYS H H 4 8.205 8.205 8.030 0.175 25699
1052 1 11 . 1 1 5 5 VAL HA H 5 3.868 3.868 4.006 -0.138 25699
1053 1 11 . 1 1 5 5 VAL CA C 5 62.947 62.947 63.665 -0.718 25699
1054 1 11 . 1 1 5 5 VAL CB C 5 32.536 32.536 31.867 0.669 25699
1055 1 11 . 1 1 5 5 VAL H H 5 7.807 7.807 8.316 -0.509 25699
1056 1 11 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.372 -0.294 25699
1057 1 11 . 1 1 6 6 ALA CA C 6 53.076 53.076 51.608 1.468 25699
1058 1 11 . 1 1 6 6 ALA CB C 6 19.007 19.007 17.809 1.198 25699
1059 1 11 . 1 1 6 6 ALA H H 6 8.101 8.101 8.126 -0.025 25699
1060 1 11 . 1 1 7 7 GLN HA H 7 4.072 4.072 4.236 -0.164 25699
1061 1 11 . 1 1 7 7 GLN CB C 7 29.413 29.413 29.524 -0.111 25699
1062 1 11 . 1 1 7 7 GLN H H 7 8.065 8.065 7.969 0.096 25699
1063 1 11 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.293 -0.213 25699
1064 1 11 . 1 1 8 8 GLU CA C 8 56.439 56.439 56.370 0.069 25699
1065 1 11 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.750 -0.197 25699
1066 1 11 . 1 1 8 8 GLU H H 8 8.182 8.182 7.648 0.534 25699
1067 1 11 . 1 1 9 9 LYS HA H 9 4.007 4.007 3.951 0.056 25699
1068 1 11 . 1 1 9 9 LYS CA C 9 57.773 57.773 56.598 1.175 25699
1069 1 11 . 1 1 9 9 LYS CB C 9 32.979 32.979 31.353 1.626 25699
1070 1 11 . 1 1 9 9 LYS H H 9 8.048 8.048 8.872 -0.824 25699
1071 1 11 . 1 1 10 10 GLY CA C 10 45.562 45.562 45.028 0.534 25699
1072 1 11 . 1 1 10 10 GLY H H 10 8.305 8.305 7.545 0.760 25699
1073 1 11 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.467 -0.383 25699
1074 1 11 . 1 1 11 11 PHE CB C 11 39.831 39.831 39.657 0.174 25699
1075 1 11 . 1 1 11 11 PHE H H 11 8.761 8.761 8.608 0.153 25699
1076 1 11 . 1 1 12 12 LEU HA H 12 3.776 3.776 3.882 -0.106 25699
1077 1 11 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.800 0.312 25699
1078 1 11 . 1 1 12 12 LEU CB C 12 41.197 41.197 41.272 -0.075 25699
1079 1 11 . 1 1 12 12 LEU H H 12 8.728 8.728 7.831 0.897 25699
1080 1 11 . 1 1 13 13 TYR HA H 13 4.042 4.042 4.063 -0.021 25699
1081 1 11 . 1 1 13 13 TYR CA C 13 61.091 61.091 61.024 0.067 25699
1082 1 11 . 1 1 13 13 TYR CB C 13 37.856 37.856 38.343 -0.487 25699
1083 1 11 . 1 1 13 13 TYR H H 13 8.199 8.199 7.546 0.653 25699
1084 1 11 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.674 0.100 25699
1085 1 11 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.620 2.099 25699
1086 1 11 . 1 1 14 14 ARG H H 14 8.047 8.047 7.534 0.513 25699
1087 1 11 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.153 -0.286 25699
1088 1 11 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.153 3.965 25699
1089 1 11 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.650 2.649 25699
1090 1 11 . 1 1 15 15 LEU H H 15 8.048 8.048 7.145 0.903 25699
1091 1 11 . 1 1 16 16 THR HA H 16 4.079 4.079 4.632 -0.553 25699
1092 1 11 . 1 1 16 16 THR CA C 16 61.604 61.604 59.484 2.120 25699
1093 1 11 . 1 1 16 16 THR CB C 16 66.014 66.014 72.184 -6.170 25699
1094 1 11 . 1 1 16 16 THR H H 16 7.825 7.825 7.797 0.028 25699
1095 1 11 . 1 1 17 17 SER HA H 17 3.925 3.925 3.990 -0.065 25699
1096 1 11 . 1 1 17 17 SER CA C 17 61.613 61.613 61.841 -0.228 25699
1097 1 11 . 1 1 17 17 SER CB C 17 62.836 62.836 63.226 -0.390 25699
1098 1 11 . 1 1 17 17 SER H H 17 7.824 7.824 8.954 -1.130 25699
1099 1 11 . 1 1 18 18 ARG HA H 18 3.997 3.997 3.949 0.048 25699
1100 1 11 . 1 1 18 18 ARG CA C 18 58.150 58.150 59.134 -0.984 25699
1101 1 11 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.494 0.572 25699
1102 1 11 . 1 1 18 18 ARG H H 18 7.580 7.580 8.551 -0.971 25699
1103 1 11 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.346 -0.088 25699
1104 1 11 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.485 -0.988 25699
1105 1 11 . 1 1 19 19 TYR H H 19 7.816 7.816 7.638 0.178 25699
1106 1 11 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.781 -0.064 25699
1107 1 11 . 1 1 20 20 ARG CA C 20 58.939 58.939 58.998 -0.059 25699
1108 1 11 . 1 1 20 20 ARG CB C 20 30.009 30.009 29.615 0.394 25699
1109 1 11 . 1 1 20 20 ARG H H 20 7.864 7.864 7.880 -0.016 25699
1110 1 11 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.582 -0.236 25699
1111 1 11 . 1 1 21 21 HIS CA C 21 57.378 57.378 58.572 -1.194 25699
1112 1 11 . 1 1 21 21 HIS CB C 21 28.660 28.660 30.947 -2.287 25699
1113 1 11 . 1 1 21 21 HIS H H 21 7.900 7.900 7.610 0.290 25699
1114 1 11 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.370 -0.179 25699
1115 1 11 . 1 1 22 22 TYR CA C 22 59.853 59.853 60.505 -0.652 25699
1116 1 11 . 1 1 22 22 TYR H H 22 7.680 7.680 8.657 -0.977 25699
1117 1 11 . 1 1 23 23 ALA HA H 23 3.880 3.880 4.304 -0.424 25699
1118 1 11 . 1 1 23 23 ALA CA C 23 53.293 53.293 52.349 0.944 25699
1119 1 11 . 1 1 23 23 ALA CB C 23 18.596 18.596 17.324 1.272 25699
1120 1 11 . 1 1 23 23 ALA H H 23 8.030 8.030 8.476 -0.446 25699
1121 1 11 . 1 1 24 24 ALA HA H 24 4.025 4.025 3.950 0.075 25699
1122 1 11 . 1 1 24 24 ALA CA C 24 52.985 52.985 53.301 -0.316 25699
1123 1 11 . 1 1 24 24 ALA CB C 24 18.873 18.873 18.518 0.355 25699
1124 1 11 . 1 1 24 24 ALA H H 24 7.390 7.390 7.873 -0.483 25699
1125 1 11 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.673 -0.305 25699
1126 1 11 . 1 1 25 25 PHE CA C 25 58.247 58.247 59.051 -0.804 25699
1127 1 11 . 1 1 25 25 PHE CB C 25 39.360 39.360 41.048 -1.688 25699
1128 1 11 . 1 1 25 25 PHE H H 25 7.694 7.694 7.481 0.213 25699
1129 1 11 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.564 -0.498 25699
1130 1 11 . 1 1 26 26 GLU CA C 26 57.011 57.011 58.201 -1.190 25699
1131 1 11 . 1 1 26 26 GLU CB C 26 30.081 30.081 30.381 -0.300 25699
1132 1 11 . 1 1 26 26 GLU H H 26 8.068 8.068 8.297 -0.229 25699
1133 1 11 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.762 -0.667 25699
1134 1 11 . 1 1 27 27 ARG CA C 27 56.260 56.260 55.244 1.016 25699
1135 1 11 . 1 1 27 27 ARG CB C 27 30.799 30.799 30.797 0.001 25699
1136 1 11 . 1 1 27 27 ARG H H 27 7.976 7.976 7.729 0.247 25699
1137 1 11 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.002 0.169 25699
1138 1 11 . 1 1 28 28 ALA CA C 28 52.581 52.581 54.085 -1.504 25699
1139 1 11 . 1 1 28 28 ALA CB C 28 19.382 19.382 18.248 1.134 25699
1140 1 11 . 1 1 28 28 ALA H H 28 8.012 8.012 7.796 0.216 25699
1141 1 11 . 1 1 29 29 THR HA H 29 4.112 4.112 4.021 0.091 25699
1142 1 11 . 1 1 29 29 THR CA C 29 61.661 61.661 62.247 -0.586 25699
1143 1 11 . 1 1 29 29 THR CB C 29 70.032 70.032 68.627 1.405 25699
1144 1 11 . 1 1 29 29 THR H H 29 7.723 7.723 7.705 0.018 25699
1145 1 12 . 1 1 2 2 ALA HA H 2 4.079 4.079 3.858 0.221 25699
1146 1 12 . 1 1 2 2 ALA CA C 2 52.826 52.826 53.241 -0.415 25699
1147 1 12 . 1 1 2 2 ALA CB C 2 21.988 21.988 18.285 3.703 25699
1148 1 12 . 1 1 2 2 ALA H H 2 8.067 8.067 7.646 0.421 25699
1149 1 12 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.275 -0.243 25699
1150 1 12 . 1 1 3 3 GLU CB C 3 29.563 29.563 30.382 -0.819 25699
1151 1 12 . 1 1 3 3 GLU H H 3 8.592 8.592 8.460 0.132 25699
1152 1 12 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.385 -0.255 25699
1153 1 12 . 1 1 4 4 LYS CA C 4 56.839 56.839 57.045 -0.206 25699
1154 1 12 . 1 1 4 4 LYS CB C 4 32.806 32.806 32.966 -0.160 25699
1155 1 12 . 1 1 4 4 LYS H H 4 8.205 8.205 7.878 0.327 25699
1156 1 12 . 1 1 5 5 VAL HA H 5 3.868 3.868 3.835 0.033 25699
1157 1 12 . 1 1 5 5 VAL CA C 5 62.947 62.947 65.207 -2.260 25699
1158 1 12 . 1 1 5 5 VAL CB C 5 32.536 32.536 31.559 0.977 25699
1159 1 12 . 1 1 5 5 VAL H H 5 7.807 7.807 7.702 0.105 25699
1160 1 12 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.098 -0.020 25699
1161 1 12 . 1 1 6 6 ALA CA C 6 53.076 53.076 55.426 -2.350 25699
1162 1 12 . 1 1 6 6 ALA CB C 6 19.007 19.007 18.126 0.881 25699
1163 1 12 . 1 1 6 6 ALA H H 6 8.101 8.101 8.096 0.005 25699
1164 1 12 . 1 1 7 7 GLN HA H 7 4.072 4.072 3.970 0.102 25699
1165 1 12 . 1 1 7 7 GLN CB C 7 29.413 29.413 27.797 1.615 25699
1166 1 12 . 1 1 7 7 GLN H H 7 8.065 8.065 8.550 -0.485 25699
1167 1 12 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.096 -0.016 25699
1168 1 12 . 1 1 8 8 GLU CA C 8 56.439 56.439 58.134 -1.695 25699
1169 1 12 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.527 0.025 25699
1170 1 12 . 1 1 8 8 GLU H H 8 8.182 8.182 7.672 0.510 25699
1171 1 12 . 1 1 9 9 LYS HA H 9 4.007 4.007 3.954 0.053 25699
1172 1 12 . 1 1 9 9 LYS CA C 9 57.773 57.773 57.541 0.232 25699
1173 1 12 . 1 1 9 9 LYS CB C 9 32.979 32.979 32.596 0.383 25699
1174 1 12 . 1 1 9 9 LYS H H 9 8.048 8.048 7.642 0.406 25699
1175 1 12 . 1 1 10 10 GLY CA C 10 45.562 45.562 44.878 0.684 25699
1176 1 12 . 1 1 10 10 GLY H H 10 8.305 8.305 7.572 0.733 25699
1177 1 12 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.569 -0.485 25699
1178 1 12 . 1 1 11 11 PHE CB C 11 39.831 39.831 39.482 0.349 25699
1179 1 12 . 1 1 11 11 PHE H H 11 8.761 8.761 8.437 0.324 25699
1180 1 12 . 1 1 12 12 LEU HA H 12 3.776 3.776 3.774 0.002 25699
1181 1 12 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.506 0.606 25699
1182 1 12 . 1 1 12 12 LEU CB C 12 41.197 41.197 40.919 0.279 25699
1183 1 12 . 1 1 12 12 LEU H H 12 8.728 8.728 8.095 0.633 25699
1184 1 12 . 1 1 13 13 TYR HA H 13 4.042 4.042 4.083 -0.041 25699
1185 1 12 . 1 1 13 13 TYR CA C 13 61.091 61.091 61.045 0.046 25699
1186 1 12 . 1 1 13 13 TYR CB C 13 37.856 37.856 38.125 -0.269 25699
1187 1 12 . 1 1 13 13 TYR H H 13 8.199 8.199 8.160 0.039 25699
1188 1 12 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.695 0.079 25699
1189 1 12 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.570 2.149 25699
1190 1 12 . 1 1 14 14 ARG H H 14 8.047 8.047 7.884 0.163 25699
1191 1 12 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.112 -0.245 25699
1192 1 12 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.744 3.374 25699
1193 1 12 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.788 2.510 25699
1194 1 12 . 1 1 15 15 LEU H H 15 8.048 8.048 7.144 0.904 25699
1195 1 12 . 1 1 16 16 THR HA H 16 4.079 4.079 4.491 -0.412 25699
1196 1 12 . 1 1 16 16 THR CA C 16 61.604 61.604 60.139 1.464 25699
1197 1 12 . 1 1 16 16 THR CB C 16 66.014 66.014 71.416 -5.402 25699
1198 1 12 . 1 1 16 16 THR H H 16 7.825 7.825 8.062 -0.237 25699
1199 1 12 . 1 1 17 17 SER HA H 17 3.925 3.925 4.133 -0.208 25699
1200 1 12 . 1 1 17 17 SER CA C 17 61.613 61.613 60.978 0.635 25699
1201 1 12 . 1 1 17 17 SER CB C 17 62.836 62.836 62.903 -0.067 25699
1202 1 12 . 1 1 17 17 SER H H 17 7.824 7.824 8.528 -0.704 25699
1203 1 12 . 1 1 18 18 ARG HA H 18 3.997 3.997 3.665 0.332 25699
1204 1 12 . 1 1 18 18 ARG CA C 18 58.150 58.150 59.064 -0.914 25699
1205 1 12 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.415 0.651 25699
1206 1 12 . 1 1 18 18 ARG H H 18 7.580 7.580 8.368 -0.788 25699
1207 1 12 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.401 -0.143 25699
1208 1 12 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.430 -0.933 25699
1209 1 12 . 1 1 19 19 TYR H H 19 7.816 7.816 7.591 0.225 25699
1210 1 12 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.631 0.087 25699
1211 1 12 . 1 1 20 20 ARG CA C 20 58.939 58.939 59.326 -0.387 25699
1212 1 12 . 1 1 20 20 ARG CB C 20 30.009 30.009 29.929 0.080 25699
1213 1 12 . 1 1 20 20 ARG H H 20 7.864 7.864 7.600 0.264 25699
1214 1 12 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.349 -0.003 25699
1215 1 12 . 1 1 21 21 HIS CA C 21 57.378 57.378 58.121 -0.743 25699
1216 1 12 . 1 1 21 21 HIS CB C 21 28.660 28.660 29.910 -1.250 25699
1217 1 12 . 1 1 21 21 HIS H H 21 7.900 7.900 7.911 -0.011 25699
1218 1 12 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.323 -0.132 25699
1219 1 12 . 1 1 22 22 TYR CA C 22 59.853 59.853 60.055 -0.202 25699
1220 1 12 . 1 1 22 22 TYR H H 22 7.680 7.680 8.571 -0.891 25699
1221 1 12 . 1 1 23 23 ALA HA H 23 3.880 3.880 4.526 -0.646 25699
1222 1 12 . 1 1 23 23 ALA CA C 23 53.293 53.293 51.996 1.297 25699
1223 1 12 . 1 1 23 23 ALA CB C 23 18.596 18.596 17.426 1.170 25699
1224 1 12 . 1 1 23 23 ALA H H 23 8.030 8.030 8.381 -0.351 25699
1225 1 12 . 1 1 24 24 ALA HA H 24 4.025 4.025 3.997 0.028 25699
1226 1 12 . 1 1 24 24 ALA CA C 24 52.985 52.985 53.545 -0.561 25699
1227 1 12 . 1 1 24 24 ALA CB C 24 18.873 18.873 18.668 0.205 25699
1228 1 12 . 1 1 24 24 ALA H H 24 7.390 7.390 7.873 -0.483 25699
1229 1 12 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.699 -0.331 25699
1230 1 12 . 1 1 25 25 PHE CA C 25 58.247 58.247 58.986 -0.739 25699
1231 1 12 . 1 1 25 25 PHE CB C 25 39.360 39.360 40.827 -1.467 25699
1232 1 12 . 1 1 25 25 PHE H H 25 7.694 7.694 7.491 0.203 25699
1233 1 12 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.590 -0.524 25699
1234 1 12 . 1 1 26 26 GLU CA C 26 57.011 57.011 58.209 -1.198 25699
1235 1 12 . 1 1 26 26 GLU CB C 26 30.081 30.081 30.349 -0.268 25699
1236 1 12 . 1 1 26 26 GLU H H 26 8.068 8.068 8.183 -0.115 25699
1237 1 12 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.731 -0.636 25699
1238 1 12 . 1 1 27 27 ARG CA C 27 56.260 56.260 55.029 1.231 25699
1239 1 12 . 1 1 27 27 ARG CB C 27 30.799 30.799 30.539 0.260 25699
1240 1 12 . 1 1 27 27 ARG H H 27 7.976 7.976 7.737 0.239 25699
1241 1 12 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.051 0.120 25699
1242 1 12 . 1 1 28 28 ALA CA C 28 52.581 52.581 54.404 -1.823 25699
1243 1 12 . 1 1 28 28 ALA CB C 28 19.382 19.382 18.219 1.163 25699
1244 1 12 . 1 1 28 28 ALA H H 28 8.012 8.012 7.829 0.183 25699
1245 1 12 . 1 1 29 29 THR HA H 29 4.112 4.112 4.141 -0.029 25699
1246 1 12 . 1 1 29 29 THR CA C 29 61.661 61.661 62.340 -0.679 25699
1247 1 12 . 1 1 29 29 THR CB C 29 70.032 70.032 68.672 1.360 25699
1248 1 12 . 1 1 29 29 THR H H 29 7.723 7.723 7.719 0.004 25699
1249 1 13 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.627 -0.548 25699
1250 1 13 . 1 1 2 2 ALA CA C 2 52.826 52.826 51.700 1.126 25699
1251 1 13 . 1 1 2 2 ALA CB C 2 21.988 21.988 20.626 1.362 25699
1252 1 13 . 1 1 2 2 ALA H H 2 8.067 8.067 7.770 0.297 25699
1253 1 13 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.610 -0.578 25699
1254 1 13 . 1 1 3 3 GLU CB C 3 29.563 29.563 31.116 -1.553 25699
1255 1 13 . 1 1 3 3 GLU H H 3 8.592 8.592 8.631 -0.039 25699
1256 1 13 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.438 -0.308 25699
1257 1 13 . 1 1 4 4 LYS CA C 4 56.839 56.839 56.777 0.062 25699
1258 1 13 . 1 1 4 4 LYS CB C 4 32.806 32.806 33.182 -0.376 25699
1259 1 13 . 1 1 4 4 LYS H H 4 8.205 8.205 8.280 -0.075 25699
1260 1 13 . 1 1 5 5 VAL HA H 5 3.868 3.868 4.323 -0.455 25699
1261 1 13 . 1 1 5 5 VAL CA C 5 62.947 62.947 61.380 1.567 25699
1262 1 13 . 1 1 5 5 VAL CB C 5 32.536 32.536 33.056 -0.520 25699
1263 1 13 . 1 1 5 5 VAL H H 5 7.807 7.807 7.629 0.178 25699
1264 1 13 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.346 -0.268 25699
1265 1 13 . 1 1 6 6 ALA CA C 6 53.076 53.076 53.514 -0.438 25699
1266 1 13 . 1 1 6 6 ALA CB C 6 19.007 19.007 19.152 -0.145 25699
1267 1 13 . 1 1 6 6 ALA H H 6 8.101 8.101 7.619 0.482 25699
1268 1 13 . 1 1 7 7 GLN HA H 7 4.072 4.072 4.213 -0.141 25699
1269 1 13 . 1 1 7 7 GLN CB C 7 29.413 29.413 28.155 1.258 25699
1270 1 13 . 1 1 7 7 GLN H H 7 8.065 8.065 8.459 -0.394 25699
1271 1 13 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.118 -0.038 25699
1272 1 13 . 1 1 8 8 GLU CA C 8 56.439 56.439 56.861 -0.422 25699
1273 1 13 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.556 -0.003 25699
1274 1 13 . 1 1 8 8 GLU H H 8 8.182 8.182 7.991 0.191 25699
1275 1 13 . 1 1 9 9 LYS HA H 9 4.007 4.007 3.942 0.065 25699
1276 1 13 . 1 1 9 9 LYS CA C 9 57.773 57.773 56.546 1.227 25699
1277 1 13 . 1 1 9 9 LYS CB C 9 32.979 32.979 30.587 2.392 25699
1278 1 13 . 1 1 9 9 LYS H H 9 8.048 8.048 8.738 -0.690 25699
1279 1 13 . 1 1 10 10 GLY CA C 10 45.562 45.562 45.010 0.552 25699
1280 1 13 . 1 1 10 10 GLY H H 10 8.305 8.305 7.585 0.720 25699
1281 1 13 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.549 -0.465 25699
1282 1 13 . 1 1 11 11 PHE CB C 11 39.831 39.831 39.577 0.254 25699
1283 1 13 . 1 1 11 11 PHE H H 11 8.761 8.761 8.469 0.292 25699
1284 1 13 . 1 1 12 12 LEU HA H 12 3.776 3.776 3.935 -0.159 25699
1285 1 13 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.477 0.634 25699
1286 1 13 . 1 1 12 12 LEU CB C 12 41.197 41.197 40.808 0.389 25699
1287 1 13 . 1 1 12 12 LEU H H 12 8.728 8.728 8.148 0.580 25699
1288 1 13 . 1 1 13 13 TYR HA H 13 4.042 4.042 3.923 0.119 25699
1289 1 13 . 1 1 13 13 TYR CA C 13 61.091 61.091 61.469 -0.379 25699
1290 1 13 . 1 1 13 13 TYR CB C 13 37.856 37.856 38.158 -0.302 25699
1291 1 13 . 1 1 13 13 TYR H H 13 8.199 8.199 7.733 0.466 25699
1292 1 13 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.566 0.208 25699
1293 1 13 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.540 2.179 25699
1294 1 13 . 1 1 14 14 ARG H H 14 8.047 8.047 7.483 0.564 25699
1295 1 13 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.116 -0.249 25699
1296 1 13 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.045 4.073 25699
1297 1 13 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.529 2.770 25699
1298 1 13 . 1 1 15 15 LEU H H 15 8.048 8.048 7.148 0.900 25699
1299 1 13 . 1 1 16 16 THR HA H 16 4.079 4.079 4.557 -0.478 25699
1300 1 13 . 1 1 16 16 THR CA C 16 61.604 61.604 59.487 2.117 25699
1301 1 13 . 1 1 16 16 THR CB C 16 66.014 66.014 71.636 -5.622 25699
1302 1 13 . 1 1 16 16 THR H H 16 7.825 7.825 7.738 0.087 25699
1303 1 13 . 1 1 17 17 SER HA H 17 3.925 3.925 3.882 0.043 25699
1304 1 13 . 1 1 17 17 SER CA C 17 61.613 61.613 61.304 0.309 25699
1305 1 13 . 1 1 17 17 SER CB C 17 62.836 62.836 63.069 -0.233 25699
1306 1 13 . 1 1 17 17 SER H H 17 7.824 7.824 8.675 -0.851 25699
1307 1 13 . 1 1 18 18 ARG HA H 18 3.997 3.997 3.857 0.140 25699
1308 1 13 . 1 1 18 18 ARG CA C 18 58.150 58.150 59.461 -1.310 25699
1309 1 13 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.500 0.566 25699
1310 1 13 . 1 1 18 18 ARG H H 18 7.580 7.580 8.529 -0.949 25699
1311 1 13 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.089 0.169 25699
1312 1 13 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.229 -0.732 25699
1313 1 13 . 1 1 19 19 TYR H H 19 7.816 7.816 7.591 0.225 25699
1314 1 13 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.756 -0.038 25699
1315 1 13 . 1 1 20 20 ARG CA C 20 58.939 58.939 59.497 -0.558 25699
1316 1 13 . 1 1 20 20 ARG CB C 20 30.009 30.009 29.866 0.143 25699
1317 1 13 . 1 1 20 20 ARG H H 20 7.864 7.864 7.934 -0.070 25699
1318 1 13 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.215 0.131 25699
1319 1 13 . 1 1 21 21 HIS CA C 21 57.378 57.378 59.050 -1.672 25699
1320 1 13 . 1 1 21 21 HIS CB C 21 28.660 28.660 29.704 -1.044 25699
1321 1 13 . 1 1 21 21 HIS H H 21 7.900 7.900 8.005 -0.105 25699
1322 1 13 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.536 -0.345 25699
1323 1 13 . 1 1 22 22 TYR CA C 22 59.853 59.853 60.101 -0.248 25699
1324 1 13 . 1 1 22 22 TYR H H 22 7.680 7.680 8.076 -0.396 25699
1325 1 13 . 1 1 23 23 ALA HA H 23 3.880 3.880 4.095 -0.215 25699
1326 1 13 . 1 1 23 23 ALA CA C 23 53.293 53.293 53.593 -0.300 25699
1327 1 13 . 1 1 23 23 ALA CB C 23 18.596 18.596 17.476 1.120 25699
1328 1 13 . 1 1 23 23 ALA H H 23 8.030 8.030 7.765 0.265 25699
1329 1 13 . 1 1 24 24 ALA HA H 24 4.025 4.025 3.993 0.032 25699
1330 1 13 . 1 1 24 24 ALA CA C 24 52.985 52.985 53.713 -0.728 25699
1331 1 13 . 1 1 24 24 ALA CB C 24 18.873 18.873 18.549 0.324 25699
1332 1 13 . 1 1 24 24 ALA H H 24 7.390 7.390 7.676 -0.286 25699
1333 1 13 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.720 -0.352 25699
1334 1 13 . 1 1 25 25 PHE CA C 25 58.247 58.247 60.140 -1.893 25699
1335 1 13 . 1 1 25 25 PHE CB C 25 39.360 39.360 39.734 -0.374 25699
1336 1 13 . 1 1 25 25 PHE H H 25 7.694 7.694 7.577 0.117 25699
1337 1 13 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.309 -0.243 25699
1338 1 13 . 1 1 26 26 GLU CA C 26 57.011 57.011 58.755 -1.744 25699
1339 1 13 . 1 1 26 26 GLU CB C 26 30.081 30.081 29.624 0.457 25699
1340 1 13 . 1 1 26 26 GLU H H 26 8.068 8.068 8.584 -0.516 25699
1341 1 13 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.555 -0.460 25699
1342 1 13 . 1 1 27 27 ARG CA C 27 56.260 56.260 53.758 2.502 25699
1343 1 13 . 1 1 27 27 ARG CB C 27 30.799 30.799 28.985 1.814 25699
1344 1 13 . 1 1 27 27 ARG H H 27 7.976 7.976 7.673 0.303 25699
1345 1 13 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.066 0.105 25699
1346 1 13 . 1 1 28 28 ALA CA C 28 52.581 52.581 54.554 -1.973 25699
1347 1 13 . 1 1 28 28 ALA CB C 28 19.382 19.382 18.478 0.904 25699
1348 1 13 . 1 1 28 28 ALA H H 28 8.012 8.012 7.420 0.592 25699
1349 1 13 . 1 1 29 29 THR HA H 29 4.112 4.112 4.173 -0.061 25699
1350 1 13 . 1 1 29 29 THR CA C 29 61.661 61.661 64.240 -2.579 25699
1351 1 13 . 1 1 29 29 THR CB C 29 70.032 70.032 69.224 0.808 25699
1352 1 13 . 1 1 29 29 THR H H 29 7.723 7.723 8.521 -0.798 25699
1353 1 14 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.601 -0.522 25699
1354 1 14 . 1 1 2 2 ALA CA C 2 52.826 52.826 51.626 1.200 25699
1355 1 14 . 1 1 2 2 ALA CB C 2 21.988 21.988 20.763 1.225 25699
1356 1 14 . 1 1 2 2 ALA H H 2 8.067 8.067 7.635 0.432 25699
1357 1 14 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.380 -0.348 25699
1358 1 14 . 1 1 3 3 GLU CB C 3 29.563 29.563 30.397 -0.834 25699
1359 1 14 . 1 1 3 3 GLU H H 3 8.592 8.592 8.800 -0.208 25699
1360 1 14 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.369 -0.239 25699
1361 1 14 . 1 1 4 4 LYS CA C 4 56.839 56.839 56.923 -0.084 25699
1362 1 14 . 1 1 4 4 LYS CB C 4 32.806 32.806 32.918 -0.112 25699
1363 1 14 . 1 1 4 4 LYS H H 4 8.205 8.205 8.132 0.073 25699
1364 1 14 . 1 1 5 5 VAL HA H 5 3.868 3.868 3.653 0.215 25699
1365 1 14 . 1 1 5 5 VAL CA C 5 62.947 62.947 64.749 -1.802 25699
1366 1 14 . 1 1 5 5 VAL CB C 5 32.536 32.536 31.756 0.780 25699
1367 1 14 . 1 1 5 5 VAL H H 5 7.807 7.807 7.776 0.031 25699
1368 1 14 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.199 -0.121 25699
1369 1 14 . 1 1 6 6 ALA CA C 6 53.076 53.076 53.618 -0.542 25699
1370 1 14 . 1 1 6 6 ALA CB C 6 19.007 19.007 19.107 -0.100 25699
1371 1 14 . 1 1 6 6 ALA H H 6 8.101 8.101 7.619 0.482 25699
1372 1 14 . 1 1 7 7 GLN HA H 7 4.072 4.072 4.062 0.010 25699
1373 1 14 . 1 1 7 7 GLN CB C 7 29.413 29.413 27.907 1.506 25699
1374 1 14 . 1 1 7 7 GLN H H 7 8.065 8.065 7.641 0.424 25699
1375 1 14 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.062 0.018 25699
1376 1 14 . 1 1 8 8 GLU CA C 8 56.439 56.439 58.255 -1.816 25699
1377 1 14 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.909 -0.356 25699
1378 1 14 . 1 1 8 8 GLU H H 8 8.182 8.182 8.178 0.004 25699
1379 1 14 . 1 1 9 9 LYS HA H 9 4.007 4.007 4.441 -0.434 25699
1380 1 14 . 1 1 9 9 LYS CA C 9 57.773 57.773 56.352 1.421 25699
1381 1 14 . 1 1 9 9 LYS CB C 9 32.979 32.979 35.025 -2.046 25699
1382 1 14 . 1 1 9 9 LYS H H 9 8.048 8.048 7.283 0.765 25699
1383 1 14 . 1 1 10 10 GLY CA C 10 45.562 45.562 45.364 0.199 25699
1384 1 14 . 1 1 10 10 GLY H H 10 8.305 8.305 7.503 0.802 25699
1385 1 14 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.540 -0.456 25699
1386 1 14 . 1 1 11 11 PHE CB C 11 39.831 39.831 39.474 0.357 25699
1387 1 14 . 1 1 11 11 PHE H H 11 8.761 8.761 8.418 0.343 25699
1388 1 14 . 1 1 12 12 LEU HA H 12 3.776 3.776 3.896 -0.120 25699
1389 1 14 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.867 0.245 25699
1390 1 14 . 1 1 12 12 LEU CB C 12 41.197 41.197 41.056 0.141 25699
1391 1 14 . 1 1 12 12 LEU H H 12 8.728 8.728 8.134 0.594 25699
1392 1 14 . 1 1 13 13 TYR HA H 13 4.042 4.042 4.061 -0.019 25699
1393 1 14 . 1 1 13 13 TYR CA C 13 61.091 61.091 61.074 0.017 25699
1394 1 14 . 1 1 13 13 TYR CB C 13 37.856 37.856 38.158 -0.302 25699
1395 1 14 . 1 1 13 13 TYR H H 13 8.199 8.199 8.263 -0.064 25699
1396 1 14 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.726 0.048 25699
1397 1 14 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.443 2.276 25699
1398 1 14 . 1 1 14 14 ARG H H 14 8.047 8.047 7.608 0.439 25699
1399 1 14 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.164 -0.297 25699
1400 1 14 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.543 3.575 25699
1401 1 14 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.546 2.753 25699
1402 1 14 . 1 1 15 15 LEU H H 15 8.048 8.048 7.240 0.808 25699
1403 1 14 . 1 1 16 16 THR HA H 16 4.079 4.079 4.555 -0.476 25699
1404 1 14 . 1 1 16 16 THR CA C 16 61.604 61.604 59.919 1.685 25699
1405 1 14 . 1 1 16 16 THR CB C 16 66.014 66.014 71.769 -5.755 25699
1406 1 14 . 1 1 16 16 THR H H 16 7.825 7.825 8.069 -0.244 25699
1407 1 14 . 1 1 17 17 SER HA H 17 3.925 3.925 4.232 -0.307 25699
1408 1 14 . 1 1 17 17 SER CA C 17 61.613 61.613 61.311 0.302 25699
1409 1 14 . 1 1 17 17 SER CB C 17 62.836 62.836 63.079 -0.243 25699
1410 1 14 . 1 1 17 17 SER H H 17 7.824 7.824 8.875 -1.051 25699
1411 1 14 . 1 1 18 18 ARG HA H 18 3.997 3.997 4.053 -0.056 25699
1412 1 14 . 1 1 18 18 ARG CA C 18 58.150 58.150 58.965 -0.815 25699
1413 1 14 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.513 0.553 25699
1414 1 14 . 1 1 18 18 ARG H H 18 7.580 7.580 8.128 -0.548 25699
1415 1 14 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.454 -0.196 25699
1416 1 14 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.820 -1.323 25699
1417 1 14 . 1 1 19 19 TYR H H 19 7.816 7.816 7.689 0.127 25699
1418 1 14 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.821 -0.103 25699
1419 1 14 . 1 1 20 20 ARG CA C 20 58.939 58.939 59.380 -0.441 25699
1420 1 14 . 1 1 20 20 ARG CB C 20 30.009 30.009 29.922 0.088 25699
1421 1 14 . 1 1 20 20 ARG H H 20 7.864 7.864 8.054 -0.190 25699
1422 1 14 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.467 -0.121 25699
1423 1 14 . 1 1 21 21 HIS CA C 21 57.378 57.378 58.219 -0.842 25699
1424 1 14 . 1 1 21 21 HIS CB C 21 28.660 28.660 30.045 -1.385 25699
1425 1 14 . 1 1 21 21 HIS H H 21 7.900 7.900 7.711 0.189 25699
1426 1 14 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.228 -0.037 25699
1427 1 14 . 1 1 22 22 TYR CA C 22 59.853 59.853 60.974 -1.121 25699
1428 1 14 . 1 1 22 22 TYR H H 22 7.680 7.680 7.817 -0.137 25699
1429 1 14 . 1 1 23 23 ALA HA H 23 3.880 3.880 4.193 -0.313 25699
1430 1 14 . 1 1 23 23 ALA CA C 23 53.293 53.293 55.003 -1.710 25699
1431 1 14 . 1 1 23 23 ALA CB C 23 18.596 18.596 17.856 0.740 25699
1432 1 14 . 1 1 23 23 ALA H H 23 8.030 8.030 8.274 -0.244 25699
1433 1 14 . 1 1 24 24 ALA HA H 24 4.025 4.025 4.242 -0.217 25699
1434 1 14 . 1 1 24 24 ALA CA C 24 52.985 52.985 53.931 -0.946 25699
1435 1 14 . 1 1 24 24 ALA CB C 24 18.873 18.873 18.900 -0.027 25699
1436 1 14 . 1 1 24 24 ALA H H 24 7.390 7.390 7.762 -0.372 25699
1437 1 14 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.821 -0.453 25699
1438 1 14 . 1 1 25 25 PHE CA C 25 58.247 58.247 58.716 -0.469 25699
1439 1 14 . 1 1 25 25 PHE CB C 25 39.360 39.360 41.188 -1.828 25699
1440 1 14 . 1 1 25 25 PHE H H 25 7.694 7.694 8.079 -0.385 25699
1441 1 14 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.685 -0.619 25699
1442 1 14 . 1 1 26 26 GLU CA C 26 57.011 57.011 57.661 -0.650 25699
1443 1 14 . 1 1 26 26 GLU CB C 26 30.081 30.081 32.080 -1.999 25699
1444 1 14 . 1 1 26 26 GLU H H 26 8.068 8.068 8.168 -0.100 25699
1445 1 14 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.722 -0.627 25699
1446 1 14 . 1 1 27 27 ARG CA C 27 56.260 56.260 56.170 0.090 25699
1447 1 14 . 1 1 27 27 ARG CB C 27 30.799 30.799 30.303 0.496 25699
1448 1 14 . 1 1 27 27 ARG H H 27 7.976 7.976 8.401 -0.425 25699
1449 1 14 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.098 0.073 25699
1450 1 14 . 1 1 28 28 ALA CA C 28 52.581 52.581 54.236 -1.655 25699
1451 1 14 . 1 1 28 28 ALA CB C 28 19.382 19.382 18.089 1.293 25699
1452 1 14 . 1 1 28 28 ALA H H 28 8.012 8.012 8.048 -0.036 25699
1453 1 14 . 1 1 29 29 THR HA H 29 4.112 4.112 4.156 -0.044 25699
1454 1 14 . 1 1 29 29 THR CA C 29 61.661 61.661 62.315 -0.654 25699
1455 1 14 . 1 1 29 29 THR CB C 29 70.032 70.032 68.912 1.120 25699
1456 1 14 . 1 1 29 29 THR H H 29 7.723 7.723 7.665 0.058 25699
1457 1 15 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.358 -0.279 25699
1458 1 15 . 1 1 2 2 ALA CA C 2 52.826 52.826 51.944 0.882 25699
1459 1 15 . 1 1 2 2 ALA CB C 2 21.988 21.988 18.946 3.042 25699
1460 1 15 . 1 1 2 2 ALA H H 2 8.067 8.067 7.661 0.406 25699
1461 1 15 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.067 -0.035 25699
1462 1 15 . 1 1 3 3 GLU CB C 3 29.563 29.563 29.587 -0.024 25699
1463 1 15 . 1 1 3 3 GLU H H 3 8.592 8.592 8.984 -0.392 25699
1464 1 15 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.243 -0.113 25699
1465 1 15 . 1 1 4 4 LYS CA C 4 56.839 56.839 58.514 -1.675 25699
1466 1 15 . 1 1 4 4 LYS CB C 4 32.806 32.806 32.450 0.356 25699
1467 1 15 . 1 1 4 4 LYS H H 4 8.205 8.205 8.154 0.051 25699
1468 1 15 . 1 1 5 5 VAL HA H 5 3.868 3.868 4.289 -0.421 25699
1469 1 15 . 1 1 5 5 VAL CA C 5 62.947 62.947 61.468 1.479 25699
1470 1 15 . 1 1 5 5 VAL CB C 5 32.536 32.536 30.265 2.271 25699
1471 1 15 . 1 1 5 5 VAL H H 5 7.807 7.807 7.563 0.244 25699
1472 1 15 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.577 -0.499 25699
1473 1 15 . 1 1 6 6 ALA CA C 6 53.076 53.076 53.087 -0.011 25699
1474 1 15 . 1 1 6 6 ALA CB C 6 19.007 19.007 20.313 -1.306 25699
1475 1 15 . 1 1 6 6 ALA H H 6 8.101 8.101 7.958 0.143 25699
1476 1 15 . 1 1 7 7 GLN HA H 7 4.072 4.072 4.599 -0.527 25699
1477 1 15 . 1 1 7 7 GLN CB C 7 29.413 29.413 29.757 -0.344 25699
1478 1 15 . 1 1 7 7 GLN H H 7 8.065 8.065 8.461 -0.396 25699
1479 1 15 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.005 0.075 25699
1480 1 15 . 1 1 8 8 GLU CA C 8 56.439 56.439 59.048 -2.609 25699
1481 1 15 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.205 0.348 25699
1482 1 15 . 1 1 8 8 GLU H H 8 8.182 8.182 8.512 -0.330 25699
1483 1 15 . 1 1 9 9 LYS HA H 9 4.007 4.007 4.287 -0.280 25699
1484 1 15 . 1 1 9 9 LYS CA C 9 57.773 57.773 56.470 1.303 25699
1485 1 15 . 1 1 9 9 LYS CB C 9 32.979 32.979 33.079 -0.100 25699
1486 1 15 . 1 1 9 9 LYS H H 9 8.048 8.048 7.864 0.184 25699
1487 1 15 . 1 1 10 10 GLY CA C 10 45.562 45.562 44.660 0.902 25699
1488 1 15 . 1 1 10 10 GLY H H 10 8.305 8.305 7.156 1.149 25699
1489 1 15 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.388 -0.304 25699
1490 1 15 . 1 1 11 11 PHE CB C 11 39.831 39.831 39.481 0.350 25699
1491 1 15 . 1 1 11 11 PHE H H 11 8.761 8.761 8.611 0.150 25699
1492 1 15 . 1 1 12 12 LEU HA H 12 3.776 3.776 3.773 0.003 25699
1493 1 15 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.548 0.564 25699
1494 1 15 . 1 1 12 12 LEU CB C 12 41.197 41.197 40.755 0.442 25699
1495 1 15 . 1 1 12 12 LEU H H 12 8.728 8.728 8.114 0.614 25699
1496 1 15 . 1 1 13 13 TYR HA H 13 4.042 4.042 4.079 -0.037 25699
1497 1 15 . 1 1 13 13 TYR CA C 13 61.091 61.091 60.793 0.298 25699
1498 1 15 . 1 1 13 13 TYR CB C 13 37.856 37.856 38.042 -0.186 25699
1499 1 15 . 1 1 13 13 TYR H H 13 8.199 8.199 8.105 0.094 25699
1500 1 15 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.566 0.208 25699
1501 1 15 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.684 2.035 25699
1502 1 15 . 1 1 14 14 ARG H H 14 8.047 8.047 7.650 0.397 25699
1503 1 15 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.140 -0.273 25699
1504 1 15 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.428 3.690 25699
1505 1 15 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.534 2.765 25699
1506 1 15 . 1 1 15 15 LEU H H 15 8.048 8.048 7.099 0.949 25699
1507 1 15 . 1 1 16 16 THR HA H 16 4.079 4.079 4.481 -0.402 25699
1508 1 15 . 1 1 16 16 THR CA C 16 61.604 61.604 59.794 1.810 25699
1509 1 15 . 1 1 16 16 THR CB C 16 66.014 66.014 72.031 -6.017 25699
1510 1 15 . 1 1 16 16 THR H H 16 7.825 7.825 8.007 -0.182 25699
1511 1 15 . 1 1 17 17 SER HA H 17 3.925 3.925 3.921 0.004 25699
1512 1 15 . 1 1 17 17 SER CA C 17 61.613 61.613 61.133 0.479 25699
1513 1 15 . 1 1 17 17 SER CB C 17 62.836 62.836 62.928 -0.092 25699
1514 1 15 . 1 1 17 17 SER H H 17 7.824 7.824 8.703 -0.879 25699
1515 1 15 . 1 1 18 18 ARG HA H 18 3.997 3.997 3.703 0.294 25699
1516 1 15 . 1 1 18 18 ARG CA C 18 58.150 58.150 59.071 -0.921 25699
1517 1 15 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.508 0.558 25699
1518 1 15 . 1 1 18 18 ARG H H 18 7.580 7.580 8.311 -0.731 25699
1519 1 15 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.425 -0.167 25699
1520 1 15 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.329 -0.832 25699
1521 1 15 . 1 1 19 19 TYR H H 19 7.816 7.816 7.489 0.327 25699
1522 1 15 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.849 -0.131 25699
1523 1 15 . 1 1 20 20 ARG CA C 20 58.939 58.939 59.513 -0.574 25699
1524 1 15 . 1 1 20 20 ARG CB C 20 30.009 30.009 29.982 0.027 25699
1525 1 15 . 1 1 20 20 ARG H H 20 7.864 7.864 8.518 -0.654 25699
1526 1 15 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.515 -0.169 25699
1527 1 15 . 1 1 21 21 HIS CA C 21 57.378 57.378 57.831 -0.453 25699
1528 1 15 . 1 1 21 21 HIS CB C 21 28.660 28.660 29.452 -0.792 25699
1529 1 15 . 1 1 21 21 HIS H H 21 7.900 7.900 7.706 0.194 25699
1530 1 15 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.356 -0.165 25699
1531 1 15 . 1 1 22 22 TYR CA C 22 59.853 59.853 60.694 -0.841 25699
1532 1 15 . 1 1 22 22 TYR H H 22 7.680 7.680 8.039 -0.359 25699
1533 1 15 . 1 1 23 23 ALA HA H 23 3.880 3.880 3.937 -0.057 25699
1534 1 15 . 1 1 23 23 ALA CA C 23 53.293 53.293 54.842 -1.549 25699
1535 1 15 . 1 1 23 23 ALA CB C 23 18.596 18.596 17.523 1.073 25699
1536 1 15 . 1 1 23 23 ALA H H 23 8.030 8.030 8.165 -0.135 25699
1537 1 15 . 1 1 24 24 ALA HA H 24 4.025 4.025 4.241 -0.216 25699
1538 1 15 . 1 1 24 24 ALA CA C 24 52.985 52.985 53.750 -0.765 25699
1539 1 15 . 1 1 24 24 ALA CB C 24 18.873 18.873 18.913 -0.040 25699
1540 1 15 . 1 1 24 24 ALA H H 24 7.390 7.390 7.809 -0.419 25699
1541 1 15 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.819 -0.451 25699
1542 1 15 . 1 1 25 25 PHE CA C 25 58.247 58.247 58.701 -0.454 25699
1543 1 15 . 1 1 25 25 PHE CB C 25 39.360 39.360 41.231 -1.871 25699
1544 1 15 . 1 1 25 25 PHE H H 25 7.694 7.694 8.099 -0.405 25699
1545 1 15 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.713 -0.647 25699
1546 1 15 . 1 1 26 26 GLU CA C 26 57.011 57.011 57.714 -0.703 25699
1547 1 15 . 1 1 26 26 GLU CB C 26 30.081 30.081 32.050 -1.969 25699
1548 1 15 . 1 1 26 26 GLU H H 26 8.068 8.068 8.187 -0.119 25699
1549 1 15 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.663 -0.568 25699
1550 1 15 . 1 1 27 27 ARG CA C 27 56.260 56.260 55.623 0.637 25699
1551 1 15 . 1 1 27 27 ARG CB C 27 30.799 30.799 29.542 1.257 25699
1552 1 15 . 1 1 27 27 ARG H H 27 7.976 7.976 8.030 -0.054 25699
1553 1 15 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.024 0.147 25699
1554 1 15 . 1 1 28 28 ALA CA C 28 52.581 52.581 54.151 -1.570 25699
1555 1 15 . 1 1 28 28 ALA CB C 28 19.382 19.382 18.116 1.266 25699
1556 1 15 . 1 1 28 28 ALA H H 28 8.012 8.012 7.723 0.289 25699
1557 1 15 . 1 1 29 29 THR HA H 29 4.112 4.112 4.050 0.062 25699
1558 1 15 . 1 1 29 29 THR CA C 29 61.661 61.661 63.173 -1.512 25699
1559 1 15 . 1 1 29 29 THR CB C 29 70.032 70.032 68.778 1.254 25699
1560 1 15 . 1 1 29 29 THR H H 29 7.723 7.723 7.621 0.102 25699
1561 1 16 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.718 -0.639 25699
1562 1 16 . 1 1 2 2 ALA CA C 2 52.826 52.826 51.643 1.183 25699
1563 1 16 . 1 1 2 2 ALA CB C 2 21.988 21.988 19.957 2.031 25699
1564 1 16 . 1 1 2 2 ALA H H 2 8.067 8.067 8.171 -0.104 25699
1565 1 16 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.382 -0.350 25699
1566 1 16 . 1 1 3 3 GLU CB C 3 29.563 29.563 28.952 0.611 25699
1567 1 16 . 1 1 3 3 GLU H H 3 8.592 8.592 8.659 -0.067 25699
1568 1 16 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.051 0.079 25699
1569 1 16 . 1 1 4 4 LYS CA C 4 56.839 56.839 57.107 -0.268 25699
1570 1 16 . 1 1 4 4 LYS CB C 4 32.806 32.806 31.326 1.480 25699
1571 1 16 . 1 1 4 4 LYS H H 4 8.205 8.205 8.572 -0.367 25699
1572 1 16 . 1 1 5 5 VAL HA H 5 3.868 3.868 4.212 -0.344 25699
1573 1 16 . 1 1 5 5 VAL CA C 5 62.947 62.947 63.080 -0.133 25699
1574 1 16 . 1 1 5 5 VAL CB C 5 32.536 32.536 32.316 0.220 25699
1575 1 16 . 1 1 5 5 VAL H H 5 7.807 7.807 7.771 0.036 25699
1576 1 16 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.492 -0.414 25699
1577 1 16 . 1 1 6 6 ALA CA C 6 53.076 53.076 54.918 -1.842 25699
1578 1 16 . 1 1 6 6 ALA CB C 6 19.007 19.007 18.290 0.717 25699
1579 1 16 . 1 1 6 6 ALA H H 6 8.101 8.101 8.137 -0.036 25699
1580 1 16 . 1 1 7 7 GLN HA H 7 4.072 4.072 4.002 0.070 25699
1581 1 16 . 1 1 7 7 GLN CB C 7 29.413 29.413 27.938 1.475 25699
1582 1 16 . 1 1 7 7 GLN H H 7 8.065 8.065 8.635 -0.570 25699
1583 1 16 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.111 -0.031 25699
1584 1 16 . 1 1 8 8 GLU CA C 8 56.439 56.439 58.103 -1.664 25699
1585 1 16 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.362 0.191 25699
1586 1 16 . 1 1 8 8 GLU H H 8 8.182 8.182 8.449 -0.267 25699
1587 1 16 . 1 1 9 9 LYS HA H 9 4.007 4.007 3.955 0.052 25699
1588 1 16 . 1 1 9 9 LYS CA C 9 57.773 57.773 57.375 0.398 25699
1589 1 16 . 1 1 9 9 LYS CB C 9 32.979 32.979 32.634 0.345 25699
1590 1 16 . 1 1 9 9 LYS H H 9 8.048 8.048 7.499 0.549 25699
1591 1 16 . 1 1 10 10 GLY CA C 10 45.562 45.562 45.141 0.421 25699
1592 1 16 . 1 1 10 10 GLY H H 10 8.305 8.305 7.687 0.618 25699
1593 1 16 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.809 -0.725 25699
1594 1 16 . 1 1 11 11 PHE CB C 11 39.831 39.831 39.961 -0.130 25699
1595 1 16 . 1 1 11 11 PHE H H 11 8.761 8.761 8.318 0.443 25699
1596 1 16 . 1 1 12 12 LEU HA H 12 3.776 3.776 3.821 -0.045 25699
1597 1 16 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.381 0.731 25699
1598 1 16 . 1 1 12 12 LEU CB C 12 41.197 41.197 41.071 0.126 25699
1599 1 16 . 1 1 12 12 LEU H H 12 8.728 8.728 8.140 0.588 25699
1600 1 16 . 1 1 13 13 TYR HA H 13 4.042 4.042 4.070 -0.028 25699
1601 1 16 . 1 1 13 13 TYR CA C 13 61.091 61.091 60.613 0.478 25699
1602 1 16 . 1 1 13 13 TYR CB C 13 37.856 37.856 38.037 -0.181 25699
1603 1 16 . 1 1 13 13 TYR H H 13 8.199 8.199 8.036 0.163 25699
1604 1 16 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.637 0.137 25699
1605 1 16 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.702 2.018 25699
1606 1 16 . 1 1 14 14 ARG H H 14 8.047 8.047 7.543 0.504 25699
1607 1 16 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.127 -0.260 25699
1608 1 16 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.091 4.027 25699
1609 1 16 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.528 2.771 25699
1610 1 16 . 1 1 15 15 LEU H H 15 8.048 8.048 7.209 0.839 25699
1611 1 16 . 1 1 16 16 THR HA H 16 4.079 4.079 4.594 -0.515 25699
1612 1 16 . 1 1 16 16 THR CA C 16 61.604 61.604 59.978 1.626 25699
1613 1 16 . 1 1 16 16 THR CB C 16 66.014 66.014 71.863 -5.849 25699
1614 1 16 . 1 1 16 16 THR H H 16 7.825 7.825 7.753 0.072 25699
1615 1 16 . 1 1 17 17 SER HA H 17 3.925 3.925 3.982 -0.057 25699
1616 1 16 . 1 1 17 17 SER CA C 17 61.613 61.613 62.086 -0.473 25699
1617 1 16 . 1 1 17 17 SER CB C 17 62.836 62.836 63.042 -0.206 25699
1618 1 16 . 1 1 17 17 SER H H 17 7.824 7.824 8.973 -1.149 25699
1619 1 16 . 1 1 18 18 ARG HA H 18 3.997 3.997 3.836 0.161 25699
1620 1 16 . 1 1 18 18 ARG CA C 18 58.150 58.150 58.971 -0.820 25699
1621 1 16 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.355 0.711 25699
1622 1 16 . 1 1 18 18 ARG H H 18 7.580 7.580 8.541 -0.961 25699
1623 1 16 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.385 -0.127 25699
1624 1 16 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.535 -1.038 25699
1625 1 16 . 1 1 19 19 TYR H H 19 7.816 7.816 7.642 0.174 25699
1626 1 16 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.803 -0.085 25699
1627 1 16 . 1 1 20 20 ARG CA C 20 58.939 58.939 60.074 -1.135 25699
1628 1 16 . 1 1 20 20 ARG CB C 20 30.009 30.009 29.866 0.143 25699
1629 1 16 . 1 1 20 20 ARG H H 20 7.864 7.864 7.939 -0.075 25699
1630 1 16 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.304 0.042 25699
1631 1 16 . 1 1 21 21 HIS CA C 21 57.378 57.378 59.056 -1.678 25699
1632 1 16 . 1 1 21 21 HIS CB C 21 28.660 28.660 29.048 -0.388 25699
1633 1 16 . 1 1 21 21 HIS H H 21 7.900 7.900 7.933 -0.033 25699
1634 1 16 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.053 0.138 25699
1635 1 16 . 1 1 22 22 TYR CA C 22 59.853 59.853 61.623 -1.770 25699
1636 1 16 . 1 1 22 22 TYR H H 22 7.680 7.680 7.977 -0.297 25699
1637 1 16 . 1 1 23 23 ALA HA H 23 3.880 3.880 4.164 -0.284 25699
1638 1 16 . 1 1 23 23 ALA CA C 23 53.293 53.293 54.546 -1.253 25699
1639 1 16 . 1 1 23 23 ALA CB C 23 18.596 18.596 18.065 0.531 25699
1640 1 16 . 1 1 23 23 ALA H H 23 8.030 8.030 8.184 -0.154 25699
1641 1 16 . 1 1 24 24 ALA HA H 24 4.025 4.025 4.324 -0.299 25699
1642 1 16 . 1 1 24 24 ALA CA C 24 52.985 52.985 54.047 -1.062 25699
1643 1 16 . 1 1 24 24 ALA CB C 24 18.873 18.873 19.004 -0.131 25699
1644 1 16 . 1 1 24 24 ALA H H 24 7.390 7.390 7.921 -0.531 25699
1645 1 16 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.811 -0.443 25699
1646 1 16 . 1 1 25 25 PHE CA C 25 58.247 58.247 58.792 -0.545 25699
1647 1 16 . 1 1 25 25 PHE CB C 25 39.360 39.360 41.241 -1.881 25699
1648 1 16 . 1 1 25 25 PHE H H 25 7.694 7.694 7.970 -0.276 25699
1649 1 16 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.576 -0.510 25699
1650 1 16 . 1 1 26 26 GLU CA C 26 57.011 57.011 57.560 -0.549 25699
1651 1 16 . 1 1 26 26 GLU CB C 26 30.081 30.081 32.519 -2.438 25699
1652 1 16 . 1 1 26 26 GLU H H 26 8.068 8.068 8.159 -0.091 25699
1653 1 16 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.827 -0.732 25699
1654 1 16 . 1 1 27 27 ARG CA C 27 56.260 56.260 55.622 0.638 25699
1655 1 16 . 1 1 27 27 ARG CB C 27 30.799 30.799 30.911 -0.112 25699
1656 1 16 . 1 1 27 27 ARG H H 27 7.976 7.976 8.446 -0.470 25699
1657 1 16 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.353 -0.182 25699
1658 1 16 . 1 1 28 28 ALA CA C 28 52.581 52.581 53.790 -1.209 25699
1659 1 16 . 1 1 28 28 ALA CB C 28 19.382 19.382 18.661 0.721 25699
1660 1 16 . 1 1 28 28 ALA H H 28 8.012 8.012 8.022 -0.010 25699
1661 1 16 . 1 1 29 29 THR HA H 29 4.112 4.112 4.122 -0.010 25699
1662 1 16 . 1 1 29 29 THR CA C 29 61.661 61.661 62.197 -0.536 25699
1663 1 16 . 1 1 29 29 THR CB C 29 70.032 70.032 68.749 1.284 25699
1664 1 16 . 1 1 29 29 THR H H 29 7.723 7.723 7.789 -0.066 25699
1665 1 17 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.618 -0.539 25699
1666 1 17 . 1 1 2 2 ALA CA C 2 52.826 52.826 51.864 0.962 25699
1667 1 17 . 1 1 2 2 ALA CB C 2 21.988 21.988 19.773 2.216 25699
1668 1 17 . 1 1 2 2 ALA H H 2 8.067 8.067 7.947 0.120 25699
1669 1 17 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.419 -0.387 25699
1670 1 17 . 1 1 3 3 GLU CB C 3 29.563 29.563 31.574 -2.011 25699
1671 1 17 . 1 1 3 3 GLU H H 3 8.592 8.592 8.758 -0.166 25699
1672 1 17 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.387 -0.257 25699
1673 1 17 . 1 1 4 4 LYS CA C 4 56.839 56.839 55.783 1.056 25699
1674 1 17 . 1 1 4 4 LYS CB C 4 32.806 32.806 33.877 -1.071 25699
1675 1 17 . 1 1 4 4 LYS H H 4 8.205 8.205 7.931 0.274 25699
1676 1 17 . 1 1 5 5 VAL HA H 5 3.868 3.868 4.064 -0.196 25699
1677 1 17 . 1 1 5 5 VAL CA C 5 62.947 62.947 61.701 1.246 25699
1678 1 17 . 1 1 5 5 VAL CB C 5 32.536 32.536 33.946 -1.410 25699
1679 1 17 . 1 1 5 5 VAL H H 5 7.807 7.807 7.373 0.434 25699
1680 1 17 . 1 1 6 6 ALA HA H 6 4.078 4.078 3.966 0.112 25699
1681 1 17 . 1 1 6 6 ALA CA C 6 53.076 53.076 52.980 0.096 25699
1682 1 17 . 1 1 6 6 ALA CB C 6 19.007 19.007 18.216 0.791 25699
1683 1 17 . 1 1 6 6 ALA H H 6 8.101 8.101 8.959 -0.858 25699
1684 1 17 . 1 1 7 7 GLN HA H 7 4.072 4.072 3.811 0.261 25699
1685 1 17 . 1 1 7 7 GLN CB C 7 29.413 29.413 28.421 0.992 25699
1686 1 17 . 1 1 7 7 GLN H H 7 8.065 8.065 8.717 -0.652 25699
1687 1 17 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.339 -0.259 25699
1688 1 17 . 1 1 8 8 GLU CA C 8 56.439 56.439 56.308 0.131 25699
1689 1 17 . 1 1 8 8 GLU CB C 8 29.553 29.553 30.022 -0.469 25699
1690 1 17 . 1 1 8 8 GLU H H 8 8.182 8.182 8.380 -0.198 25699
1691 1 17 . 1 1 9 9 LYS HA H 9 4.007 4.007 4.206 -0.199 25699
1692 1 17 . 1 1 9 9 LYS CA C 9 57.773 57.773 56.264 1.509 25699
1693 1 17 . 1 1 9 9 LYS CB C 9 32.979 32.979 34.116 -1.137 25699
1694 1 17 . 1 1 9 9 LYS H H 9 8.048 8.048 7.865 0.183 25699
1695 1 17 . 1 1 10 10 GLY CA C 10 45.562 45.562 44.775 0.787 25699
1696 1 17 . 1 1 10 10 GLY H H 10 8.305 8.305 7.503 0.801 25699
1697 1 17 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.187 -0.103 25699
1698 1 17 . 1 1 11 11 PHE CB C 11 39.831 39.831 39.363 0.468 25699
1699 1 17 . 1 1 11 11 PHE H H 11 8.761 8.761 8.631 0.130 25699
1700 1 17 . 1 1 12 12 LEU HA H 12 3.776 3.776 4.131 -0.355 25699
1701 1 17 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.847 0.265 25699
1702 1 17 . 1 1 12 12 LEU CB C 12 41.197 41.197 41.099 0.098 25699
1703 1 17 . 1 1 12 12 LEU H H 12 8.728 8.728 8.111 0.617 25699
1704 1 17 . 1 1 13 13 TYR HA H 13 4.042 4.042 4.073 -0.031 25699
1705 1 17 . 1 1 13 13 TYR CA C 13 61.091 61.091 60.790 0.301 25699
1706 1 17 . 1 1 13 13 TYR CB C 13 37.856 37.856 38.070 -0.214 25699
1707 1 17 . 1 1 13 13 TYR H H 13 8.199 8.199 8.006 0.193 25699
1708 1 17 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.755 0.019 25699
1709 1 17 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.998 1.721 25699
1710 1 17 . 1 1 14 14 ARG H H 14 8.047 8.047 7.685 0.362 25699
1711 1 17 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.266 -0.399 25699
1712 1 17 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.849 3.269 25699
1713 1 17 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.860 2.439 25699
1714 1 17 . 1 1 15 15 LEU H H 15 8.048 8.048 7.443 0.605 25699
1715 1 17 . 1 1 16 16 THR HA H 16 4.079 4.079 4.569 -0.490 25699
1716 1 17 . 1 1 16 16 THR CA C 16 61.604 61.604 60.455 1.149 25699
1717 1 17 . 1 1 16 16 THR CB C 16 66.014 66.014 71.129 -5.115 25699
1718 1 17 . 1 1 16 16 THR H H 16 7.825 7.825 8.060 -0.235 25699
1719 1 17 . 1 1 17 17 SER HA H 17 3.925 3.925 4.345 -0.420 25699
1720 1 17 . 1 1 17 17 SER CA C 17 61.613 61.613 60.501 1.113 25699
1721 1 17 . 1 1 17 17 SER CB C 17 62.836 62.836 62.767 0.069 25699
1722 1 17 . 1 1 17 17 SER H H 17 7.824 7.824 8.576 -0.752 25699
1723 1 17 . 1 1 18 18 ARG HA H 18 3.997 3.997 3.943 0.054 25699
1724 1 17 . 1 1 18 18 ARG CA C 18 58.150 58.150 58.831 -0.681 25699
1725 1 17 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.268 0.798 25699
1726 1 17 . 1 1 18 18 ARG H H 18 7.580 7.580 8.156 -0.576 25699
1727 1 17 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.262 -0.004 25699
1728 1 17 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.111 -0.614 25699
1729 1 17 . 1 1 19 19 TYR H H 19 7.816 7.816 7.681 0.135 25699
1730 1 17 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.664 0.054 25699
1731 1 17 . 1 1 20 20 ARG CA C 20 58.939 58.939 58.880 0.059 25699
1732 1 17 . 1 1 20 20 ARG CB C 20 30.009 30.009 29.640 0.369 25699
1733 1 17 . 1 1 20 20 ARG H H 20 7.864 7.864 7.755 0.109 25699
1734 1 17 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.462 -0.116 25699
1735 1 17 . 1 1 21 21 HIS CA C 21 57.378 57.378 58.933 -1.555 25699
1736 1 17 . 1 1 21 21 HIS CB C 21 28.660 28.660 29.988 -1.328 25699
1737 1 17 . 1 1 21 21 HIS H H 21 7.900 7.900 7.536 0.364 25699
1738 1 17 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.242 -0.051 25699
1739 1 17 . 1 1 22 22 TYR CA C 22 59.853 59.853 60.887 -1.034 25699
1740 1 17 . 1 1 22 22 TYR H H 22 7.680 7.680 8.457 -0.777 25699
1741 1 17 . 1 1 23 23 ALA HA H 23 3.880 3.880 4.180 -0.300 25699
1742 1 17 . 1 1 23 23 ALA CA C 23 53.293 53.293 55.145 -1.853 25699
1743 1 17 . 1 1 23 23 ALA CB C 23 18.596 18.596 17.515 1.081 25699
1744 1 17 . 1 1 23 23 ALA H H 23 8.030 8.030 8.196 -0.166 25699
1745 1 17 . 1 1 24 24 ALA HA H 24 4.025 4.025 4.253 -0.228 25699
1746 1 17 . 1 1 24 24 ALA CA C 24 52.985 52.985 53.516 -0.531 25699
1747 1 17 . 1 1 24 24 ALA CB C 24 18.873 18.873 18.657 0.216 25699
1748 1 17 . 1 1 24 24 ALA H H 24 7.390 7.390 8.223 -0.834 25699
1749 1 17 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.875 -0.507 25699
1750 1 17 . 1 1 25 25 PHE CA C 25 58.247 58.247 58.776 -0.529 25699
1751 1 17 . 1 1 25 25 PHE CB C 25 39.360 39.360 41.296 -1.936 25699
1752 1 17 . 1 1 25 25 PHE H H 25 7.694 7.694 8.276 -0.582 25699
1753 1 17 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.731 -0.665 25699
1754 1 17 . 1 1 26 26 GLU CA C 26 57.011 57.011 57.755 -0.744 25699
1755 1 17 . 1 1 26 26 GLU CB C 26 30.081 30.081 32.144 -2.063 25699
1756 1 17 . 1 1 26 26 GLU H H 26 8.068 8.068 8.263 -0.195 25699
1757 1 17 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.618 -0.523 25699
1758 1 17 . 1 1 27 27 ARG CA C 27 56.260 56.260 55.602 0.658 25699
1759 1 17 . 1 1 27 27 ARG CB C 27 30.799 30.799 29.573 1.226 25699
1760 1 17 . 1 1 27 27 ARG H H 27 7.976 7.976 8.107 -0.131 25699
1761 1 17 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.043 0.128 25699
1762 1 17 . 1 1 28 28 ALA CA C 28 52.581 52.581 54.188 -1.607 25699
1763 1 17 . 1 1 28 28 ALA CB C 28 19.382 19.382 18.135 1.247 25699
1764 1 17 . 1 1 28 28 ALA H H 28 8.012 8.012 7.747 0.265 25699
1765 1 17 . 1 1 29 29 THR HA H 29 4.112 4.112 4.051 0.061 25699
1766 1 17 . 1 1 29 29 THR CA C 29 61.661 61.661 63.167 -1.506 25699
1767 1 17 . 1 1 29 29 THR CB C 29 70.032 70.032 68.781 1.251 25699
1768 1 17 . 1 1 29 29 THR H H 29 7.723 7.723 7.630 0.093 25699
1769 1 18 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.682 -0.603 25699
1770 1 18 . 1 1 2 2 ALA CA C 2 52.826 52.826 51.775 1.051 25699
1771 1 18 . 1 1 2 2 ALA CB C 2 21.988 21.988 19.111 2.877 25699
1772 1 18 . 1 1 2 2 ALA H H 2 8.067 8.067 7.912 0.155 25699
1773 1 18 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.394 -0.362 25699
1774 1 18 . 1 1 3 3 GLU CB C 3 29.563 29.563 30.746 -1.183 25699
1775 1 18 . 1 1 3 3 GLU H H 3 8.592 8.592 8.653 -0.061 25699
1776 1 18 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.459 -0.329 25699
1777 1 18 . 1 1 4 4 LYS CA C 4 56.839 56.839 56.404 0.435 25699
1778 1 18 . 1 1 4 4 LYS CB C 4 32.806 32.806 33.278 -0.472 25699
1779 1 18 . 1 1 4 4 LYS H H 4 8.205 8.205 8.223 -0.018 25699
1780 1 18 . 1 1 5 5 VAL HA H 5 3.868 3.868 4.247 -0.379 25699
1781 1 18 . 1 1 5 5 VAL CA C 5 62.947 62.947 63.842 -0.895 25699
1782 1 18 . 1 1 5 5 VAL CB C 5 32.536 32.536 32.334 0.202 25699
1783 1 18 . 1 1 5 5 VAL H H 5 7.807 7.807 7.717 0.090 25699
1784 1 18 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.378 -0.300 25699
1785 1 18 . 1 1 6 6 ALA CA C 6 53.076 53.076 54.426 -1.350 25699
1786 1 18 . 1 1 6 6 ALA CB C 6 19.007 19.007 19.030 -0.023 25699
1787 1 18 . 1 1 6 6 ALA H H 6 8.101 8.101 7.851 0.250 25699
1788 1 18 . 1 1 7 7 GLN HA H 7 4.072 4.072 4.005 0.067 25699
1789 1 18 . 1 1 7 7 GLN CB C 7 29.413 29.413 27.596 1.817 25699
1790 1 18 . 1 1 7 7 GLN H H 7 8.065 8.065 8.516 -0.451 25699
1791 1 18 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.058 0.022 25699
1792 1 18 . 1 1 8 8 GLU CA C 8 56.439 56.439 58.242 -1.803 25699
1793 1 18 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.089 0.464 25699
1794 1 18 . 1 1 8 8 GLU H H 8 8.182 8.182 8.424 -0.242 25699
1795 1 18 . 1 1 9 9 LYS HA H 9 4.007 4.007 4.269 -0.262 25699
1796 1 18 . 1 1 9 9 LYS CA C 9 57.773 57.773 56.231 1.542 25699
1797 1 18 . 1 1 9 9 LYS CB C 9 32.979 32.979 34.677 -1.698 25699
1798 1 18 . 1 1 9 9 LYS H H 9 8.048 8.048 7.433 0.615 25699
1799 1 18 . 1 1 10 10 GLY CA C 10 45.562 45.562 45.646 -0.084 25699
1800 1 18 . 1 1 10 10 GLY H H 10 8.305 8.305 7.558 0.747 25699
1801 1 18 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.832 -0.748 25699
1802 1 18 . 1 1 11 11 PHE CB C 11 39.831 39.831 40.002 -0.171 25699
1803 1 18 . 1 1 11 11 PHE H H 11 8.761 8.761 8.301 0.460 25699
1804 1 18 . 1 1 12 12 LEU HA H 12 3.776 3.776 3.808 -0.032 25699
1805 1 18 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.530 0.582 25699
1806 1 18 . 1 1 12 12 LEU CB C 12 41.197 41.197 41.078 0.119 25699
1807 1 18 . 1 1 12 12 LEU H H 12 8.728 8.728 8.055 0.673 25699
1808 1 18 . 1 1 13 13 TYR HA H 13 4.042 4.042 4.030 0.012 25699
1809 1 18 . 1 1 13 13 TYR CA C 13 61.091 61.091 61.195 -0.104 25699
1810 1 18 . 1 1 13 13 TYR CB C 13 37.856 37.856 38.028 -0.172 25699
1811 1 18 . 1 1 13 13 TYR H H 13 8.199 8.199 8.165 0.034 25699
1812 1 18 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.523 0.251 25699
1813 1 18 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.587 2.132 25699
1814 1 18 . 1 1 14 14 ARG H H 14 8.047 8.047 7.510 0.537 25699
1815 1 18 . 1 1 15 15 LEU HA H 15 3.867 3.867 3.997 -0.130 25699
1816 1 18 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.712 3.406 25699
1817 1 18 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.672 2.627 25699
1818 1 18 . 1 1 15 15 LEU H H 15 8.048 8.048 7.018 1.030 25699
1819 1 18 . 1 1 16 16 THR HA H 16 4.079 4.079 4.531 -0.452 25699
1820 1 18 . 1 1 16 16 THR CA C 16 61.604 61.604 60.380 1.224 25699
1821 1 18 . 1 1 16 16 THR CB C 16 66.014 66.014 71.520 -5.506 25699
1822 1 18 . 1 1 16 16 THR H H 16 7.825 7.825 7.943 -0.118 25699
1823 1 18 . 1 1 17 17 SER HA H 17 3.925 3.925 4.105 -0.180 25699
1824 1 18 . 1 1 17 17 SER CA C 17 61.613 61.613 61.645 -0.032 25699
1825 1 18 . 1 1 17 17 SER CB C 17 62.836 62.836 63.014 -0.178 25699
1826 1 18 . 1 1 17 17 SER H H 17 7.824 7.824 8.674 -0.850 25699
1827 1 18 . 1 1 18 18 ARG HA H 18 3.997 3.997 3.834 0.163 25699
1828 1 18 . 1 1 18 18 ARG CA C 18 58.150 58.150 59.015 -0.865 25699
1829 1 18 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.463 0.603 25699
1830 1 18 . 1 1 18 18 ARG H H 18 7.580 7.580 8.535 -0.955 25699
1831 1 18 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.305 -0.047 25699
1832 1 18 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.793 -1.296 25699
1833 1 18 . 1 1 19 19 TYR H H 19 7.816 7.816 7.600 0.216 25699
1834 1 18 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.846 -0.128 25699
1835 1 18 . 1 1 20 20 ARG CA C 20 58.939 58.939 59.923 -0.984 25699
1836 1 18 . 1 1 20 20 ARG CB C 20 30.009 30.009 30.032 -0.023 25699
1837 1 18 . 1 1 20 20 ARG H H 20 7.864 7.864 8.357 -0.493 25699
1838 1 18 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.344 0.002 25699
1839 1 18 . 1 1 21 21 HIS CA C 21 57.378 57.378 59.051 -1.673 25699
1840 1 18 . 1 1 21 21 HIS CB C 21 28.660 28.660 29.635 -0.975 25699
1841 1 18 . 1 1 21 21 HIS H H 21 7.900 7.900 8.138 -0.238 25699
1842 1 18 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.304 -0.113 25699
1843 1 18 . 1 1 22 22 TYR CA C 22 59.853 59.853 60.064 -0.211 25699
1844 1 18 . 1 1 22 22 TYR H H 22 7.680 7.680 7.752 -0.072 25699
1845 1 18 . 1 1 23 23 ALA HA H 23 3.880 3.880 4.399 -0.519 25699
1846 1 18 . 1 1 23 23 ALA CA C 23 53.293 53.293 54.392 -1.099 25699
1847 1 18 . 1 1 23 23 ALA CB C 23 18.596 18.596 18.160 0.436 25699
1848 1 18 . 1 1 23 23 ALA H H 23 8.030 8.030 8.744 -0.714 25699
1849 1 18 . 1 1 24 24 ALA HA H 24 4.025 4.025 4.404 -0.379 25699
1850 1 18 . 1 1 24 24 ALA CA C 24 52.985 52.985 52.801 0.184 25699
1851 1 18 . 1 1 24 24 ALA CB C 24 18.873 18.873 18.587 0.286 25699
1852 1 18 . 1 1 24 24 ALA H H 24 7.390 7.390 8.023 -0.633 25699
1853 1 18 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.614 -0.246 25699
1854 1 18 . 1 1 25 25 PHE CA C 25 58.247 58.247 59.177 -0.930 25699
1855 1 18 . 1 1 25 25 PHE CB C 25 39.360 39.360 40.850 -1.490 25699
1856 1 18 . 1 1 25 25 PHE H H 25 7.694 7.694 7.724 -0.030 25699
1857 1 18 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.101 -0.035 25699
1858 1 18 . 1 1 26 26 GLU CA C 26 57.011 57.011 59.658 -2.647 25699
1859 1 18 . 1 1 26 26 GLU CB C 26 30.081 30.081 29.998 0.083 25699
1860 1 18 . 1 1 26 26 GLU H H 26 8.068 8.068 8.536 -0.468 25699
1861 1 18 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.475 -0.380 25699
1862 1 18 . 1 1 27 27 ARG CA C 27 56.260 56.260 56.197 0.063 25699
1863 1 18 . 1 1 27 27 ARG CB C 27 30.799 30.799 32.801 -2.002 25699
1864 1 18 . 1 1 27 27 ARG H H 27 7.976 7.976 8.019 -0.043 25699
1865 1 18 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.273 -0.102 25699
1866 1 18 . 1 1 28 28 ALA CA C 28 52.581 52.581 53.471 -0.890 25699
1867 1 18 . 1 1 28 28 ALA CB C 28 19.382 19.382 17.200 2.182 25699
1868 1 18 . 1 1 28 28 ALA H H 28 8.012 8.012 8.368 -0.356 25699
1869 1 18 . 1 1 29 29 THR HA H 29 4.112 4.112 4.125 -0.013 25699
1870 1 18 . 1 1 29 29 THR CA C 29 61.661 61.661 62.296 -0.635 25699
1871 1 18 . 1 1 29 29 THR CB C 29 70.032 70.032 68.174 1.858 25699
1872 1 18 . 1 1 29 29 THR H H 29 7.723 7.723 7.843 -0.120 25699
1873 1 19 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.094 -0.015 25699
1874 1 19 . 1 1 2 2 ALA CA C 2 52.826 52.826 52.862 -0.036 25699
1875 1 19 . 1 1 2 2 ALA CB C 2 21.988 21.988 18.154 3.834 25699
1876 1 19 . 1 1 2 2 ALA H H 2 8.067 8.067 7.782 0.285 25699
1877 1 19 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.222 -0.190 25699
1878 1 19 . 1 1 3 3 GLU CB C 3 29.563 29.563 30.037 -0.474 25699
1879 1 19 . 1 1 3 3 GLU H H 3 8.592 8.592 8.804 -0.212 25699
1880 1 19 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.127 0.003 25699
1881 1 19 . 1 1 4 4 LYS CA C 4 56.839 56.839 58.653 -1.813 25699
1882 1 19 . 1 1 4 4 LYS CB C 4 32.806 32.806 32.063 0.743 25699
1883 1 19 . 1 1 4 4 LYS H H 4 8.205 8.205 8.306 -0.101 25699
1884 1 19 . 1 1 5 5 VAL HA H 5 3.868 3.868 4.571 -0.703 25699
1885 1 19 . 1 1 5 5 VAL CA C 5 62.947 62.947 60.181 2.766 25699
1886 1 19 . 1 1 5 5 VAL CB C 5 32.536 32.536 30.587 1.949 25699
1887 1 19 . 1 1 5 5 VAL H H 5 7.807 7.807 7.514 0.293 25699
1888 1 19 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.622 -0.544 25699
1889 1 19 . 1 1 6 6 ALA CA C 6 53.076 53.076 53.475 -0.399 25699
1890 1 19 . 1 1 6 6 ALA CB C 6 19.007 19.007 20.805 -1.798 25699
1891 1 19 . 1 1 6 6 ALA H H 6 8.101 8.101 7.362 0.739 25699
1892 1 19 . 1 1 7 7 GLN HA H 7 4.072 4.072 4.547 -0.475 25699
1893 1 19 . 1 1 7 7 GLN CB C 7 29.413 29.413 30.314 -0.902 25699
1894 1 19 . 1 1 7 7 GLN H H 7 8.065 8.065 7.635 0.430 25699
1895 1 19 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.023 0.057 25699
1896 1 19 . 1 1 8 8 GLU CA C 8 56.439 56.439 58.872 -2.433 25699
1897 1 19 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.183 0.370 25699
1898 1 19 . 1 1 8 8 GLU H H 8 8.182 8.182 7.814 0.368 25699
1899 1 19 . 1 1 9 9 LYS HA H 9 4.007 4.007 4.199 -0.192 25699
1900 1 19 . 1 1 9 9 LYS CA C 9 57.773 57.773 56.620 1.153 25699
1901 1 19 . 1 1 9 9 LYS CB C 9 32.979 32.979 32.852 0.127 25699
1902 1 19 . 1 1 9 9 LYS H H 9 8.048 8.048 7.998 0.050 25699
1903 1 19 . 1 1 10 10 GLY CA C 10 45.562 45.562 45.136 0.425 25699
1904 1 19 . 1 1 10 10 GLY H H 10 8.305 8.305 7.351 0.954 25699
1905 1 19 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.693 -0.609 25699
1906 1 19 . 1 1 11 11 PHE CB C 11 39.831 39.831 39.968 -0.137 25699
1907 1 19 . 1 1 11 11 PHE H H 11 8.761 8.761 8.449 0.312 25699
1908 1 19 . 1 1 12 12 LEU HA H 12 3.776 3.776 3.755 0.021 25699
1909 1 19 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.528 0.584 25699
1910 1 19 . 1 1 12 12 LEU CB C 12 41.197 41.197 40.821 0.376 25699
1911 1 19 . 1 1 12 12 LEU H H 12 8.728 8.728 8.159 0.569 25699
1912 1 19 . 1 1 13 13 TYR HA H 13 4.042 4.042 4.049 -0.007 25699
1913 1 19 . 1 1 13 13 TYR CA C 13 61.091 61.091 60.916 0.175 25699
1914 1 19 . 1 1 13 13 TYR CB C 13 37.856 37.856 37.837 0.019 25699
1915 1 19 . 1 1 13 13 TYR H H 13 8.199 8.199 8.006 0.193 25699
1916 1 19 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.658 0.116 25699
1917 1 19 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.741 1.978 25699
1918 1 19 . 1 1 14 14 ARG H H 14 8.047 8.047 7.628 0.419 25699
1919 1 19 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.190 -0.323 25699
1920 1 19 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.042 4.076 25699
1921 1 19 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.709 2.590 25699
1922 1 19 . 1 1 15 15 LEU H H 15 8.048 8.048 7.364 0.684 25699
1923 1 19 . 1 1 16 16 THR HA H 16 4.079 4.079 4.544 -0.465 25699
1924 1 19 . 1 1 16 16 THR CA C 16 61.604 61.604 59.653 1.951 25699
1925 1 19 . 1 1 16 16 THR CB C 16 66.014 66.014 70.943 -4.929 25699
1926 1 19 . 1 1 16 16 THR H H 16 7.825 7.825 7.705 0.120 25699
1927 1 19 . 1 1 17 17 SER HA H 17 3.925 3.925 4.278 -0.353 25699
1928 1 19 . 1 1 17 17 SER CA C 17 61.613 61.613 60.308 1.305 25699
1929 1 19 . 1 1 17 17 SER CB C 17 62.836 62.836 62.783 0.053 25699
1930 1 19 . 1 1 17 17 SER H H 17 7.824 7.824 8.636 -0.812 25699
1931 1 19 . 1 1 18 18 ARG HA H 18 3.997 3.997 4.013 -0.016 25699
1932 1 19 . 1 1 18 18 ARG CA C 18 58.150 58.150 57.972 0.178 25699
1933 1 19 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.120 0.946 25699
1934 1 19 . 1 1 18 18 ARG H H 18 7.580 7.580 8.235 -0.654 25699
1935 1 19 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.363 -0.105 25699
1936 1 19 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.358 -0.861 25699
1937 1 19 . 1 1 19 19 TYR H H 19 7.816 7.816 7.566 0.250 25699
1938 1 19 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.852 -0.134 25699
1939 1 19 . 1 1 20 20 ARG CA C 20 58.939 58.939 59.034 -0.095 25699
1940 1 19 . 1 1 20 20 ARG CB C 20 30.009 30.009 29.610 0.399 25699
1941 1 19 . 1 1 20 20 ARG H H 20 7.864 7.864 7.719 0.145 25699
1942 1 19 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.482 -0.136 25699
1943 1 19 . 1 1 21 21 HIS CA C 21 57.378 57.378 58.525 -1.147 25699
1944 1 19 . 1 1 21 21 HIS CB C 21 28.660 28.660 30.115 -1.455 25699
1945 1 19 . 1 1 21 21 HIS H H 21 7.900 7.900 7.778 0.122 25699
1946 1 19 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.487 -0.296 25699
1947 1 19 . 1 1 22 22 TYR CA C 22 59.853 59.853 60.117 -0.264 25699
1948 1 19 . 1 1 22 22 TYR H H 22 7.680 7.680 8.030 -0.350 25699
1949 1 19 . 1 1 23 23 ALA HA H 23 3.880 3.880 4.291 -0.411 25699
1950 1 19 . 1 1 23 23 ALA CA C 23 53.293 53.293 54.606 -1.313 25699
1951 1 19 . 1 1 23 23 ALA CB C 23 18.596 18.596 17.626 0.970 25699
1952 1 19 . 1 1 23 23 ALA H H 23 8.030 8.030 8.226 -0.196 25699
1953 1 19 . 1 1 24 24 ALA HA H 24 4.025 4.025 4.408 -0.383 25699
1954 1 19 . 1 1 24 24 ALA CA C 24 52.985 52.985 53.369 -0.384 25699
1955 1 19 . 1 1 24 24 ALA CB C 24 18.873 18.873 18.512 0.361 25699
1956 1 19 . 1 1 24 24 ALA H H 24 7.390 7.390 8.037 -0.647 25699
1957 1 19 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.714 -0.346 25699
1958 1 19 . 1 1 25 25 PHE CA C 25 58.247 58.247 59.292 -1.045 25699
1959 1 19 . 1 1 25 25 PHE CB C 25 39.360 39.360 41.041 -1.681 25699
1960 1 19 . 1 1 25 25 PHE H H 25 7.694 7.694 7.808 -0.114 25699
1961 1 19 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.225 -0.159 25699
1962 1 19 . 1 1 26 26 GLU CA C 26 57.011 57.011 59.664 -2.653 25699
1963 1 19 . 1 1 26 26 GLU CB C 26 30.081 30.081 30.327 -0.246 25699
1964 1 19 . 1 1 26 26 GLU H H 26 8.068 8.068 8.675 -0.607 25699
1965 1 19 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.553 -0.458 25699
1966 1 19 . 1 1 27 27 ARG CA C 27 56.260 56.260 55.794 0.466 25699
1967 1 19 . 1 1 27 27 ARG CB C 27 30.799 30.799 32.673 -1.874 25699
1968 1 19 . 1 1 27 27 ARG H H 27 7.976 7.976 8.042 -0.066 25699
1969 1 19 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.243 -0.072 25699
1970 1 19 . 1 1 28 28 ALA CA C 28 52.581 52.581 53.626 -1.045 25699
1971 1 19 . 1 1 28 28 ALA CB C 28 19.382 19.382 16.721 2.661 25699
1972 1 19 . 1 1 28 28 ALA H H 28 8.012 8.012 8.425 -0.413 25699
1973 1 19 . 1 1 29 29 THR HA H 29 4.112 4.112 4.049 0.063 25699
1974 1 19 . 1 1 29 29 THR CA C 29 61.661 61.661 62.479 -0.818 25699
1975 1 19 . 1 1 29 29 THR CB C 29 70.032 70.032 68.394 1.638 25699
1976 1 19 . 1 1 29 29 THR H H 29 7.723 7.723 7.850 -0.127 25699
1977 1 20 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.701 -0.622 25699
1978 1 20 . 1 1 2 2 ALA CA C 2 52.826 52.826 51.645 1.181 25699
1979 1 20 . 1 1 2 2 ALA CB C 2 21.988 21.988 21.788 0.200 25699
1980 1 20 . 1 1 2 2 ALA H H 2 8.067 8.067 8.389 -0.322 25699
1981 1 20 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.371 -0.339 25699
1982 1 20 . 1 1 3 3 GLU CB C 3 29.563 29.563 30.342 -0.779 25699
1983 1 20 . 1 1 3 3 GLU H H 3 8.592 8.592 8.780 -0.188 25699
1984 1 20 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.129 0.001 25699
1985 1 20 . 1 1 4 4 LYS CA C 4 56.839 56.839 58.704 -1.865 25699
1986 1 20 . 1 1 4 4 LYS CB C 4 32.806 32.806 32.459 0.347 25699
1987 1 20 . 1 1 4 4 LYS H H 4 8.205 8.205 8.089 0.116 25699
1988 1 20 . 1 1 5 5 VAL HA H 5 3.868 3.868 4.088 -0.220 25699
1989 1 20 . 1 1 5 5 VAL CA C 5 62.947 62.947 63.940 -0.993 25699
1990 1 20 . 1 1 5 5 VAL CB C 5 32.536 32.536 31.952 0.584 25699
1991 1 20 . 1 1 5 5 VAL H H 5 7.807 7.807 7.555 0.252 25699
1992 1 20 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.513 -0.435 25699
1993 1 20 . 1 1 6 6 ALA CA C 6 53.076 53.076 53.114 -0.038 25699
1994 1 20 . 1 1 6 6 ALA CB C 6 19.007 19.007 18.224 0.784 25699
1995 1 20 . 1 1 6 6 ALA H H 6 8.101 8.101 7.830 0.271 25699
1996 1 20 . 1 1 7 7 GLN HA H 7 4.072 4.072 4.239 -0.167 25699
1997 1 20 . 1 1 7 7 GLN CB C 7 29.413 29.413 28.583 0.830 25699
1998 1 20 . 1 1 7 7 GLN H H 7 8.065 8.065 7.751 0.314 25699
1999 1 20 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.045 0.035 25699
2000 1 20 . 1 1 8 8 GLU CA C 8 56.439 56.439 58.509 -2.070 25699
2001 1 20 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.424 0.129 25699
2002 1 20 . 1 1 8 8 GLU H H 8 8.182 8.182 8.346 -0.164 25699
2003 1 20 . 1 1 9 9 LYS HA H 9 4.007 4.007 4.470 -0.463 25699
2004 1 20 . 1 1 9 9 LYS CA C 9 57.773 57.773 55.916 1.857 25699
2005 1 20 . 1 1 9 9 LYS CB C 9 32.979 32.979 35.065 -2.086 25699
2006 1 20 . 1 1 9 9 LYS H H 9 8.048 8.048 7.990 0.058 25699
2007 1 20 . 1 1 10 10 GLY CA C 10 45.562 45.562 44.570 0.992 25699
2008 1 20 . 1 1 10 10 GLY H H 10 8.305 8.305 7.548 0.757 25699
2009 1 20 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.250 -0.166 25699
2010 1 20 . 1 1 11 11 PHE CB C 11 39.831 39.831 39.570 0.261 25699
2011 1 20 . 1 1 11 11 PHE H H 11 8.761 8.761 8.652 0.109 25699
2012 1 20 . 1 1 12 12 LEU HA H 12 3.776 3.776 3.809 -0.033 25699
2013 1 20 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.214 0.898 25699
2014 1 20 . 1 1 12 12 LEU CB C 12 41.197 41.197 41.423 -0.226 25699
2015 1 20 . 1 1 12 12 LEU H H 12 8.728 8.728 7.980 0.748 25699
2016 1 20 . 1 1 13 13 TYR HA H 13 4.042 4.042 4.178 -0.136 25699
2017 1 20 . 1 1 13 13 TYR CA C 13 61.091 61.091 60.322 0.769 25699
2018 1 20 . 1 1 13 13 TYR CB C 13 37.856 37.856 38.582 -0.726 25699
2019 1 20 . 1 1 13 13 TYR H H 13 8.199 8.199 7.310 0.889 25699
2020 1 20 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.580 0.194 25699
2021 1 20 . 1 1 14 14 ARG CA C 14 59.719 59.719 56.156 3.563 25699
2022 1 20 . 1 1 14 14 ARG H H 14 8.047 8.047 7.523 0.524 25699
2023 1 20 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.120 -0.254 25699
2024 1 20 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.533 3.585 25699
2025 1 20 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.387 2.912 25699
2026 1 20 . 1 1 15 15 LEU H H 15 8.048 8.048 6.891 1.157 25699
2027 1 20 . 1 1 16 16 THR HA H 16 4.079 4.079 4.535 -0.456 25699
2028 1 20 . 1 1 16 16 THR CA C 16 61.604 61.604 60.133 1.471 25699
2029 1 20 . 1 1 16 16 THR CB C 16 66.014 66.014 71.350 -5.336 25699
2030 1 20 . 1 1 16 16 THR H H 16 7.825 7.825 7.967 -0.142 25699
2031 1 20 . 1 1 17 17 SER HA H 17 3.925 3.925 4.285 -0.360 25699
2032 1 20 . 1 1 17 17 SER CA C 17 61.613 61.613 61.159 0.454 25699
2033 1 20 . 1 1 17 17 SER CB C 17 62.836 62.836 63.017 -0.181 25699
2034 1 20 . 1 1 17 17 SER H H 17 7.824 7.824 8.585 -0.761 25699
2035 1 20 . 1 1 18 18 ARG HA H 18 3.997 3.997 4.187 -0.190 25699
2036 1 20 . 1 1 18 18 ARG CA C 18 58.150 58.150 59.132 -0.982 25699
2037 1 20 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.607 0.459 25699
2038 1 20 . 1 1 18 18 ARG H H 18 7.580 7.580 8.507 -0.927 25699
2039 1 20 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.339 -0.081 25699
2040 1 20 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.301 -0.804 25699
2041 1 20 . 1 1 19 19 TYR H H 19 7.816 7.816 7.812 0.004 25699
2042 1 20 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.738 -0.020 25699
2043 1 20 . 1 1 20 20 ARG CA C 20 58.939 58.939 59.316 -0.377 25699
2044 1 20 . 1 1 20 20 ARG CB C 20 30.009 30.009 29.636 0.373 25699
2045 1 20 . 1 1 20 20 ARG H H 20 7.864 7.864 7.529 0.335 25699
2046 1 20 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.310 0.036 25699
2047 1 20 . 1 1 21 21 HIS CA C 21 57.378 57.378 59.071 -1.693 25699
2048 1 20 . 1 1 21 21 HIS CB C 21 28.660 28.660 29.317 -0.657 25699
2049 1 20 . 1 1 21 21 HIS H H 21 7.900 7.900 7.321 0.579 25699
2050 1 20 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.228 -0.037 25699
2051 1 20 . 1 1 22 22 TYR CA C 22 59.853 59.853 61.371 -1.518 25699
2052 1 20 . 1 1 22 22 TYR H H 22 7.680 7.680 7.908 -0.228 25699
2053 1 20 . 1 1 23 23 ALA HA H 23 3.880 3.880 3.923 -0.043 25699
2054 1 20 . 1 1 23 23 ALA CA C 23 53.293 53.293 54.673 -1.380 25699
2055 1 20 . 1 1 23 23 ALA CB C 23 18.596 18.596 17.715 0.881 25699
2056 1 20 . 1 1 23 23 ALA H H 23 8.030 8.030 7.723 0.307 25699
2057 1 20 . 1 1 24 24 ALA HA H 24 4.025 4.025 4.224 -0.199 25699
2058 1 20 . 1 1 24 24 ALA CA C 24 52.985 52.985 54.041 -1.056 25699
2059 1 20 . 1 1 24 24 ALA CB C 24 18.873 18.873 18.972 -0.099 25699
2060 1 20 . 1 1 24 24 ALA H H 24 7.390 7.390 7.878 -0.488 25699
2061 1 20 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.831 -0.463 25699
2062 1 20 . 1 1 25 25 PHE CA C 25 58.247 58.247 58.723 -0.476 25699
2063 1 20 . 1 1 25 25 PHE CB C 25 39.360 39.360 41.188 -1.828 25699
2064 1 20 . 1 1 25 25 PHE H H 25 7.694 7.694 8.068 -0.374 25699
2065 1 20 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.755 -0.689 25699
2066 1 20 . 1 1 26 26 GLU CA C 26 57.011 57.011 57.715 -0.704 25699
2067 1 20 . 1 1 26 26 GLU CB C 26 30.081 30.081 32.148 -2.067 25699
2068 1 20 . 1 1 26 26 GLU H H 26 8.068 8.068 8.166 -0.098 25699
2069 1 20 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.716 -0.621 25699
2070 1 20 . 1 1 27 27 ARG CA C 27 56.260 56.260 55.939 0.321 25699
2071 1 20 . 1 1 27 27 ARG CB C 27 30.799 30.799 30.203 0.596 25699
2072 1 20 . 1 1 27 27 ARG H H 27 7.976 7.976 8.362 -0.386 25699
2073 1 20 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.086 0.085 25699
2074 1 20 . 1 1 28 28 ALA CA C 28 52.581 52.581 54.243 -1.663 25699
2075 1 20 . 1 1 28 28 ALA CB C 28 19.382 19.382 18.158 1.224 25699
2076 1 20 . 1 1 28 28 ALA H H 28 8.012 8.012 8.029 -0.017 25699
2077 1 20 . 1 1 29 29 THR HA H 29 4.112 4.112 4.134 -0.022 25699
2078 1 20 . 1 1 29 29 THR CA C 29 61.661 61.661 62.753 -1.092 25699
2079 1 20 . 1 1 29 29 THR CB C 29 70.032 70.032 68.992 1.040 25699
2080 1 20 . 1 1 29 29 THR H H 29 7.723 7.723 7.670 0.053 25699
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 0 0.000 0.000 0.000 25699
2 1 1 "Average Difference" HA 29 0.356 0.013 0.362 25699
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25699
4 1 1 "Average Difference" CA 25 1.723 0.466 1.692 25699
5 1 1 "Average Difference" CB 24 1.506 -0.243 1.518 25699
6 1 1 "Average Difference" HN 28 0.486 -0.101 0.485 25699
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 25699
8 1 2 "Average Difference" HA 29 0.304 0.170 0.257 25699
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25699
10 1 2 "Average Difference" CA 25 1.354 -0.098 1.379 25699
11 1 2 "Average Difference" CB 24 1.550 -0.032 1.583 25699
12 1 2 "Average Difference" HN 28 0.497 -0.025 0.505 25699
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 25699
14 1 3 "Average Difference" HA 29 0.266 0.182 0.197 25699
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25699
16 1 3 "Average Difference" CA 25 1.413 0.234 1.423 25699
17 1 3 "Average Difference" CB 24 1.699 -0.037 1.735 25699
18 1 3 "Average Difference" HN 28 0.490 -0.033 0.498 25699
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 25699
20 1 4 "Average Difference" HA 29 0.260 0.098 0.246 25699
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25699
22 1 4 "Average Difference" CA 25 1.304 0.095 1.327 25699
23 1 4 "Average Difference" CB 24 1.729 -0.285 1.742 25699
24 1 4 "Average Difference" HN 28 0.464 -0.009 0.473 25699
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 25699
26 1 5 "Average Difference" HA 29 0.269 0.161 0.219 25699
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25699
28 1 5 "Average Difference" CA 25 1.248 -0.050 1.273 25699
29 1 5 "Average Difference" CB 24 1.671 -0.038 1.707 25699
30 1 5 "Average Difference" HN 28 0.489 0.008 0.498 25699
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 25699
32 1 6 "Average Difference" HA 29 0.375 0.239 0.294 25699
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25699
34 1 6 "Average Difference" CA 25 1.404 -0.057 1.431 25699
35 1 6 "Average Difference" CB 24 1.538 -0.086 1.569 25699
36 1 6 "Average Difference" HN 28 0.439 -0.041 0.445 25699
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 25699
38 1 7 "Average Difference" HA 29 0.289 0.142 0.256 25699
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25699
40 1 7 "Average Difference" CA 25 1.356 -0.098 1.381 25699
41 1 7 "Average Difference" CB 24 1.934 -0.037 1.975 25699
42 1 7 "Average Difference" HN 28 0.453 -0.077 0.454 25699
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 25699
44 1 8 "Average Difference" HA 29 0.274 0.118 0.252 25699
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25699
46 1 8 "Average Difference" CA 25 1.331 -0.096 1.354 25699
47 1 8 "Average Difference" CB 24 1.684 -0.173 1.711 25699
48 1 8 "Average Difference" HN 28 0.537 -0.037 0.546 25699
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 25699
50 1 9 "Average Difference" HA 29 0.234 0.067 0.229 25699
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25699
52 1 9 "Average Difference" CA 25 1.379 0.160 1.398 25699
53 1 9 "Average Difference" CB 24 1.770 -0.418 1.756 25699
54 1 9 "Average Difference" HN 28 0.511 -0.061 0.517 25699
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 25699
56 1 10 "Average Difference" HA 29 0.267 0.113 0.246 25699
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25699
58 1 10 "Average Difference" CA 25 1.543 0.079 1.572 25699
59 1 10 "Average Difference" CB 24 1.608 -0.356 1.601 25699
60 1 10 "Average Difference" HN 28 0.490 -0.083 0.492 25699
61 1 11 "Average Difference" N 0 0.000 0.000 0.000 25699
62 1 11 "Average Difference" HA 29 0.301 0.143 0.269 25699
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25699
64 1 11 "Average Difference" CA 25 1.361 -0.166 1.379 25699
65 1 11 "Average Difference" CB 24 1.639 0.003 1.674 25699
66 1 11 "Average Difference" HN 28 0.543 -0.025 0.552 25699
67 1 12 "Average Difference" N 0 0.000 0.000 0.000 25699
68 1 12 "Average Difference" HA 29 0.268 0.110 0.249 25699
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25699
70 1 12 "Average Difference" CA 25 1.340 0.135 1.361 25699
71 1 12 "Average Difference" CB 24 1.627 -0.246 1.643 25699
72 1 12 "Average Difference" HN 28 0.441 -0.063 0.445 25699
73 1 13 "Average Difference" N 0 0.000 0.000 0.000 25699
74 1 13 "Average Difference" HA 29 0.298 0.124 0.276 25699
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25699
76 1 13 "Average Difference" CA 25 1.573 -0.055 1.604 25699
77 1 13 "Average Difference" CB 24 1.575 -0.183 1.598 25699
78 1 13 "Average Difference" HN 28 0.488 -0.039 0.496 25699
79 1 14 "Average Difference" N 0 0.000 0.000 0.000 25699
80 1 14 "Average Difference" HA 29 0.296 0.201 0.221 25699
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25699
82 1 14 "Average Difference" CA 25 1.319 0.154 1.337 25699
83 1 14 "Average Difference" CB 24 1.629 0.164 1.656 25699
84 1 14 "Average Difference" HN 28 0.435 -0.056 0.440 25699
85 1 15 "Average Difference" N 0 0.000 0.000 0.000 25699
86 1 15 "Average Difference" HA 29 0.294 0.161 0.250 25699
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25699
88 1 15 "Average Difference" CA 25 1.391 0.016 1.420 25699
89 1 15 "Average Difference" CB 24 1.767 -0.094 1.802 25699
90 1 15 "Average Difference" HN 28 0.463 -0.008 0.471 25699
91 1 16 "Average Difference" N 0 0.000 0.000 0.000 25699
92 1 16 "Average Difference" HA 29 0.321 0.182 0.269 25699
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25699
94 1 16 "Average Difference" CA 25 1.361 0.178 1.378 25699
95 1 16 "Average Difference" CB 24 1.636 -0.085 1.669 25699
96 1 16 "Average Difference" HN 28 0.453 0.055 0.458 25699
97 1 17 "Average Difference" N 0 0.000 0.000 0.000 25699
98 1 17 "Average Difference" HA 29 0.300 0.180 0.245 25699
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25699
100 1 17 "Average Difference" CA 25 1.217 -0.147 1.233 25699
101 1 17 "Average Difference" CB 24 1.633 0.146 1.661 25699
102 1 17 "Average Difference" HN 28 0.464 0.051 0.470 25699
103 1 18 "Average Difference" N 0 0.000 0.000 0.000 25699
104 1 18 "Average Difference" HA 29 0.294 0.173 0.242 25699
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25699
106 1 18 "Average Difference" CA 25 1.328 0.195 1.341 25699
107 1 18 "Average Difference" CB 24 1.704 0.014 1.741 25699
108 1 18 "Average Difference" HN 28 0.485 0.038 0.492 25699
109 1 19 "Average Difference" N 0 0.000 0.000 0.000 25699
110 1 19 "Average Difference" HA 29 0.307 0.210 0.228 25699
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25699
112 1 19 "Average Difference" CA 25 1.537 -0.030 1.569 25699
113 1 19 "Average Difference" CB 24 1.768 -0.147 1.800 25699
114 1 19 "Average Difference" HN 28 0.441 -0.058 0.446 25699
115 1 20 "Average Difference" N 0 0.000 0.000 0.000 25699
116 1 20 "Average Difference" HA 29 0.302 0.196 0.234 25699
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25699
118 1 20 "Average Difference" CA 25 1.531 0.065 1.561 25699
119 1 20 "Average Difference" CB 24 1.535 0.140 1.561 25699
120 1 20 "Average Difference" HN 28 0.484 -0.085 0.485 25699
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 25699
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 ALA HA H 2 4.079 4.079 4.502 -0.423 25699
2 1 . 1 1 2 2 ALA CA C 2 52.826 52.826 51.941 0.885 25699
3 1 . 1 1 2 2 ALA CB C 2 21.988 21.988 19.577 2.411 25699
4 1 . 1 1 2 2 ALA H H 2 8.067 8.067 7.810 0.257 25699
5 1 . 1 1 3 3 GLU HA H 3 4.032 4.032 4.356 -0.324 25699
6 1 . 1 1 3 3 GLU CB C 3 29.563 29.563 30.196 -0.633 25699
7 1 . 1 1 3 3 GLU H H 3 8.592 8.592 8.647 -0.055 25699
8 1 . 1 1 4 4 LYS HA H 4 4.130 4.130 4.258 -0.128 25699
9 1 . 1 1 4 4 LYS CA C 4 56.839 56.839 57.566 -0.727 25699
10 1 . 1 1 4 4 LYS CB C 4 32.806 32.806 32.630 0.176 25699
11 1 . 1 1 4 4 LYS H H 4 8.205 8.205 8.196 0.009 25699
12 1 . 1 1 5 5 VAL HA H 5 3.868 3.868 4.070 -0.202 25699
13 1 . 1 1 5 5 VAL CA C 5 62.947 62.947 63.076 -0.129 25699
14 1 . 1 1 5 5 VAL CB C 5 32.536 32.536 31.826 0.710 25699
15 1 . 1 1 5 5 VAL H H 5 7.807 7.807 7.844 -0.037 25699
16 1 . 1 1 6 6 ALA HA H 6 4.078 4.078 4.344 -0.266 25699
17 1 . 1 1 6 6 ALA CA C 6 53.076 53.076 53.610 -0.534 25699
18 1 . 1 1 6 6 ALA CB C 6 19.007 19.007 18.943 0.064 25699
19 1 . 1 1 6 6 ALA H H 6 8.101 8.101 7.829 0.272 25699
20 1 . 1 1 7 7 GLN HA H 7 4.072 4.072 4.153 -0.081 25699
21 1 . 1 1 7 7 GLN CB C 7 29.413 29.413 28.603 0.810 25699
22 1 . 1 1 7 7 GLN H H 7 8.065 8.065 8.245 -0.180 25699
23 1 . 1 1 8 8 GLU HA H 8 4.080 4.080 4.119 -0.039 25699
24 1 . 1 1 8 8 GLU CA C 8 56.439 56.439 57.679 -1.240 25699
25 1 . 1 1 8 8 GLU CB C 8 29.553 29.553 29.594 -0.041 25699
26 1 . 1 1 8 8 GLU H H 8 8.182 8.182 8.015 0.167 25699
27 1 . 1 1 9 9 LYS HA H 9 4.007 4.007 4.130 -0.123 25699
28 1 . 1 1 9 9 LYS CA C 9 57.773 57.773 56.614 1.159 25699
29 1 . 1 1 9 9 LYS CB C 9 32.979 32.979 32.723 0.256 25699
30 1 . 1 1 9 9 LYS H H 9 8.048 8.048 8.070 -0.022 25699
31 1 . 1 1 10 10 GLY CA C 10 45.562 45.562 45.067 0.495 25699
32 1 . 1 1 10 10 GLY H H 10 8.305 8.305 7.550 0.755 25699
33 1 . 1 1 11 11 PHE HA H 11 4.084 4.084 4.564 -0.480 25699
34 1 . 1 1 11 11 PHE CB C 11 39.831 39.831 39.697 0.134 25699
35 1 . 1 1 11 11 PHE H H 11 8.761 8.761 8.460 0.301 25699
36 1 . 1 1 12 12 LEU HA H 12 3.776 3.776 3.899 -0.123 25699
37 1 . 1 1 12 12 LEU CA C 12 58.112 58.112 57.516 0.596 25699
38 1 . 1 1 12 12 LEU CB C 12 41.197 41.197 41.022 0.175 25699
39 1 . 1 1 12 12 LEU H H 12 8.728 8.728 8.086 0.642 25699
40 1 . 1 1 13 13 TYR HA H 13 4.042 4.042 4.051 -0.009 25699
41 1 . 1 1 13 13 TYR CA C 13 61.091 61.091 61.003 0.088 25699
42 1 . 1 1 13 13 TYR CB C 13 37.856 37.856 38.148 -0.292 25699
43 1 . 1 1 13 13 TYR H H 13 8.199 8.199 7.917 0.282 25699
44 1 . 1 1 14 14 ARG HA H 14 3.774 3.774 3.637 0.137 25699
45 1 . 1 1 14 14 ARG CA C 14 59.719 59.719 57.589 2.130 25699
46 1 . 1 1 14 14 ARG H H 14 8.047 8.047 7.558 0.489 25699
47 1 . 1 1 15 15 LEU HA H 15 3.867 3.867 4.122 -0.255 25699
48 1 . 1 1 15 15 LEU CA C 15 58.118 58.118 54.485 3.633 25699
49 1 . 1 1 15 15 LEU CB C 15 42.299 42.299 39.601 2.698 25699
50 1 . 1 1 15 15 LEU H H 15 8.048 8.048 7.184 0.864 25699
51 1 . 1 1 16 16 THR HA H 16 4.079 4.079 4.546 -0.467 25699
52 1 . 1 1 16 16 THR CA C 16 61.604 61.604 59.954 1.650 25699
53 1 . 1 1 16 16 THR CB C 16 66.014 66.014 71.546 -5.532 25699
54 1 . 1 1 16 16 THR H H 16 7.825 7.825 7.942 -0.117 25699
55 1 . 1 1 17 17 SER HA H 17 3.925 3.925 4.144 -0.219 25699
56 1 . 1 1 17 17 SER CA C 17 61.613 61.613 61.082 0.531 25699
57 1 . 1 1 17 17 SER CB C 17 62.836 62.836 62.981 -0.145 25699
58 1 . 1 1 17 17 SER H H 17 7.824 7.824 8.701 -0.877 25699
59 1 . 1 1 18 18 ARG HA H 18 3.997 3.997 3.874 0.123 25699
60 1 . 1 1 18 18 ARG CA C 18 58.150 58.150 58.847 -0.696 25699
61 1 . 1 1 18 18 ARG CB C 18 30.066 30.066 29.386 0.680 25699
62 1 . 1 1 18 18 ARG H H 18 7.580 7.580 8.389 -0.809 25699
63 1 . 1 1 19 19 TYR HA H 19 4.258 4.258 4.329 -0.071 25699
64 1 . 1 1 19 19 TYR CA C 19 60.497 60.497 61.501 -1.004 25699
65 1 . 1 1 19 19 TYR H H 19 7.816 7.816 7.608 0.208 25699
66 1 . 1 1 20 20 ARG HA H 20 3.718 3.718 3.762 -0.044 25699
67 1 . 1 1 20 20 ARG CA C 20 58.939 58.939 59.364 -0.425 25699
68 1 . 1 1 20 20 ARG CB C 20 30.009 30.009 29.819 0.190 25699
69 1 . 1 1 20 20 ARG H H 20 7.864 7.864 7.855 0.009 25699
70 1 . 1 1 21 21 HIS HA H 21 4.346 4.346 4.370 -0.024 25699
71 1 . 1 1 21 21 HIS CA C 21 57.378 57.378 58.596 -1.218 25699
72 1 . 1 1 21 21 HIS CB C 21 28.660 28.660 29.807 -1.147 25699
73 1 . 1 1 21 21 HIS H H 21 7.900 7.900 7.717 0.183 25699
74 1 . 1 1 22 22 TYR HA H 22 4.191 4.191 4.315 -0.124 25699
75 1 . 1 1 22 22 TYR CA C 22 59.853 59.853 60.351 -0.498 25699
76 1 . 1 1 22 22 TYR H H 22 7.680 7.680 7.988 -0.308 25699
77 1 . 1 1 23 23 ALA HA H 23 3.880 3.880 4.268 -0.388 25699
78 1 . 1 1 23 23 ALA CA C 23 53.293 53.293 53.965 -0.672 25699
79 1 . 1 1 23 23 ALA CB C 23 18.596 18.596 17.751 0.845 25699
80 1 . 1 1 23 23 ALA H H 23 8.030 8.030 8.145 -0.115 25699
81 1 . 1 1 24 24 ALA HA H 24 4.025 4.025 4.223 -0.198 25699
82 1 . 1 1 24 24 ALA CA C 24 52.985 52.985 53.524 -0.539 25699
83 1 . 1 1 24 24 ALA CB C 24 18.873 18.873 18.776 0.097 25699
84 1 . 1 1 24 24 ALA H H 24 7.390 7.390 7.864 -0.474 25699
85 1 . 1 1 25 25 PHE HA H 25 4.368 4.368 4.694 -0.326 25699
86 1 . 1 1 25 25 PHE CA C 25 58.247 58.247 59.207 -0.960 25699
87 1 . 1 1 25 25 PHE CB C 25 39.360 39.360 40.558 -1.198 25699
88 1 . 1 1 25 25 PHE H H 25 7.694 7.694 7.772 -0.078 25699
89 1 . 1 1 26 26 GLU HA H 26 4.066 4.066 4.336 -0.271 25699
90 1 . 1 1 26 26 GLU CA C 26 57.011 57.011 58.800 -1.789 25699
91 1 . 1 1 26 26 GLU CB C 26 30.081 30.081 30.508 -0.427 25699
92 1 . 1 1 26 26 GLU H H 26 8.068 8.068 8.441 -0.373 25699
93 1 . 1 1 27 27 ARG HA H 27 4.095 4.095 4.448 -0.353 25699
94 1 . 1 1 27 27 ARG CA C 27 56.260 56.260 55.584 0.676 25699
95 1 . 1 1 27 27 ARG CB C 27 30.799 30.799 31.099 -0.300 25699
96 1 . 1 1 27 27 ARG H H 27 7.976 7.976 7.874 0.102 25699
97 1 . 1 1 28 28 ALA HA H 28 4.171 4.171 4.171 -0.000 25699
98 1 . 1 1 28 28 ALA CA C 28 52.581 52.581 53.908 -1.327 25699
99 1 . 1 1 28 28 ALA CB C 28 19.382 19.382 17.665 1.717 25699
100 1 . 1 1 28 28 ALA H H 28 8.012 8.012 7.995 0.017 25699
101 1 . 1 1 29 29 THR HA H 29 4.112 4.112 4.108 0.004 25699
102 1 . 1 1 29 29 THR CA C 29 61.661 61.661 62.972 -1.311 25699
103 1 . 1 1 29 29 THR CB C 29 70.032 70.032 68.886 1.146 25699
104 1 . 1 1 29 29 THR H H 29 7.723 7.723 7.926 -0.203 25699
stop_
save_