data_19832
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19832
_Entry.PDB_ID 2MLU
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 19832
_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 LYS N N 2 124.386 124.386 122.787 1.599 19832
2 1 1 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.612 -0.228 19832
3 1 1 . 1 1 2 2 LYS CB C 2 32.959 32.959 34.105 -1.146 19832
4 1 1 . 1 1 2 2 LYS H H 2 9.052 9.052 7.990 1.062 19832
5 1 1 . 1 1 3 3 THR N N 3 116.039 116.039 119.662 -3.623 19832
6 1 1 . 1 1 3 3 THR HA H 3 4.216 4.216 4.143 0.073 19832
7 1 1 . 1 1 3 3 THR CB C 3 68.928 68.928 68.759 0.169 19832
8 1 1 . 1 1 3 3 THR H H 3 8.478 8.478 8.881 -0.403 19832
9 1 1 . 1 1 4 4 ILE N N 4 121.132 121.132 118.570 2.562 19832
10 1 1 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.960 0.150 19832
11 1 1 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.797 -0.225 19832
12 1 1 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.826 1.128 19832
13 1 1 . 1 1 4 4 ILE H H 4 8.556 8.556 7.841 0.715 19832
14 1 1 . 1 1 5 5 LEU N N 5 119.569 119.569 121.029 -1.460 19832
15 1 1 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.936 0.250 19832
16 1 1 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.294 -1.077 19832
17 1 1 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.072 0.008 19832
18 1 1 . 1 1 5 5 LEU H H 5 7.935 7.935 8.418 -0.483 19832
19 1 1 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.956 0.171 19832
20 1 1 . 1 1 6 6 ARG CA C 6 58.711 58.711 58.950 -0.239 19832
21 1 1 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.806 -0.119 19832
22 1 1 . 1 1 6 6 ARG H H 6 8.008 8.008 7.799 0.209 19832
23 1 1 . 1 1 7 7 PHE N N 7 118.637 118.637 117.180 1.457 19832
24 1 1 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.394 0.084 19832
25 1 1 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.820 0.293 19832
26 1 1 . 1 1 7 7 PHE H H 7 7.948 7.948 7.781 0.167 19832
27 1 1 . 1 1 8 8 VAL N N 8 116.441 116.441 121.014 -4.573 19832
28 1 1 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.745 0.148 19832
29 1 1 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.309 -0.344 19832
30 1 1 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.768 0.097 19832
31 1 1 . 1 1 8 8 VAL H H 8 8.014 8.014 8.065 -0.051 19832
32 1 1 . 1 1 9 9 ALA N N 9 121.442 121.442 120.683 0.759 19832
33 1 1 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.117 0.111 19832
34 1 1 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.910 -0.443 19832
35 1 1 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.189 0.290 19832
36 1 1 . 1 1 9 9 ALA H H 9 8.083 8.083 8.477 -0.394 19832
37 1 1 . 1 1 10 10 GLY N N 10 104.589 104.589 105.384 -0.795 19832
38 1 1 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.904 -1.241 19832
39 1 1 . 1 1 10 10 GLY H H 10 8.134 8.134 8.019 0.115 19832
40 1 1 . 1 1 11 11 TYR N N 11 118.591 118.591 123.314 -4.723 19832
41 1 1 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.115 0.208 19832
42 1 1 . 1 1 11 11 TYR H H 11 8.006 8.006 7.431 0.575 19832
43 1 1 . 1 1 12 12 ASP N N 12 119.339 119.339 117.068 2.271 19832
44 1 1 . 1 1 12 12 ASP HA H 12 4.609 4.609 3.963 0.646 19832
45 1 1 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.748 -2.659 19832
46 1 1 . 1 1 12 12 ASP H H 12 8.414 8.414 7.750 0.664 19832
47 1 1 . 1 1 13 13 ILE N N 13 119.097 119.097 118.292 0.805 19832
48 1 1 . 1 1 13 13 ILE HA H 13 3.994 3.994 3.965 0.029 19832
49 1 1 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.173 1.974 19832
50 1 1 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.270 1.214 19832
51 1 1 . 1 1 13 13 ILE H H 13 8.156 8.156 7.451 0.705 19832
52 1 1 . 1 1 14 14 ALA N N 14 123.581 123.581 123.886 -0.305 19832
53 1 1 . 1 1 14 14 ALA HA H 14 4.238 4.238 4.078 0.160 19832
54 1 1 . 1 1 14 14 ALA CA C 14 53.618 53.618 54.975 -1.357 19832
55 1 1 . 1 1 14 14 ALA CB C 14 18.817 18.817 18.161 0.656 19832
56 1 1 . 1 1 14 14 ALA H H 14 8.274 8.274 8.314 -0.040 19832
57 1 1 . 1 1 15 15 SER N N 15 112.583 112.583 112.946 -0.363 19832
58 1 1 . 1 1 15 15 SER HA H 15 4.299 4.299 4.148 0.151 19832
59 1 1 . 1 1 15 15 SER CA C 15 59.441 59.441 60.819 -1.378 19832
60 1 1 . 1 1 15 15 SER CB C 15 63.403 63.403 63.040 0.363 19832
61 1 1 . 1 1 15 15 SER H H 15 8.061 8.061 7.897 0.164 19832
62 1 1 . 1 1 16 16 HIS N N 16 120.408 120.408 118.159 2.249 19832
63 1 1 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.554 0.142 19832
64 1 1 . 1 1 16 16 HIS CB C 16 28.483 28.483 30.264 -1.781 19832
65 1 1 . 1 1 16 16 HIS H H 16 8.159 8.159 7.290 0.869 19832
66 1 1 . 1 1 17 17 LYS N N 17 120.845 120.845 119.657 1.188 19832
67 1 1 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.216 0.109 19832
68 1 1 . 1 1 17 17 LYS CA C 17 56.682 56.682 58.038 -1.356 19832
69 1 1 . 1 1 17 17 LYS CB C 17 32.996 32.996 33.296 -0.300 19832
70 1 1 . 1 1 17 17 LYS H H 17 8.080 8.080 8.194 -0.114 19832
71 1 1 . 1 1 18 18 LYS N N 18 121.661 121.661 117.243 4.418 19832
72 1 1 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.440 -0.107 19832
73 1 1 . 1 1 18 18 LYS CA C 18 56.579 56.579 55.795 0.784 19832
74 1 1 . 1 1 18 18 LYS H H 18 8.231 8.231 7.788 0.443 19832
75 1 1 . 1 1 19 19 LYS N N 19 122.316 122.316 123.736 -1.420 19832
76 1 1 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.566 -0.165 19832
77 1 1 . 1 1 19 19 LYS CA C 19 56.600 56.600 56.505 0.095 19832
78 1 1 . 1 1 19 19 LYS CB C 19 32.973 32.973 32.561 0.412 19832
79 1 1 . 1 1 19 19 LYS H H 19 8.392 8.392 8.378 0.014 19832
80 1 1 . 1 1 20 20 THR N N 20 113.974 113.974 117.290 -3.316 19832
81 1 1 . 1 1 20 20 THR HA H 20 4.405 4.405 4.508 -0.103 19832
82 1 1 . 1 1 20 20 THR CA C 20 61.680 61.680 62.230 -0.550 19832
83 1 1 . 1 1 20 20 THR CB C 20 69.817 69.817 69.373 0.444 19832
84 1 1 . 1 1 20 20 THR H H 20 8.085 8.085 8.237 -0.152 19832
85 1 1 . 1 1 21 21 GLY N N 21 110.706 110.706 110.787 -0.081 19832
86 1 1 . 1 1 21 21 GLY CA C 21 45.310 45.310 45.293 0.017 19832
87 1 1 . 1 1 21 21 GLY H H 21 8.360 8.360 8.329 0.031 19832
88 1 1 . 1 1 22 22 GLY N N 22 107.728 107.728 109.811 -2.083 19832
89 1 1 . 1 1 22 22 GLY CA C 22 45.175 45.175 44.957 0.218 19832
90 1 1 . 1 1 22 22 GLY H H 22 8.146 8.146 7.760 0.386 19832
91 1 1 . 1 1 23 23 TYR N N 23 119.224 119.224 120.223 -0.999 19832
92 1 1 . 1 1 23 23 TYR HA H 23 4.507 4.507 5.012 -0.505 19832
93 1 1 . 1 1 23 23 TYR H H 23 7.870 7.870 7.715 0.155 19832
94 1 1 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.412 -0.031 19832
95 1 1 . 1 1 24 24 PRO CA C 24 64.447 64.447 65.075 -0.628 19832
96 1 1 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.145 -0.629 19832
97 1 1 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.949 -0.563 19832
98 1 1 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.277 0.475 19832
99 1 1 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.883 -1.395 19832
100 1 1 . 1 1 25 25 TRP H H 25 6.924 6.924 7.942 -1.018 19832
101 1 1 . 1 1 26 26 GLU N N 26 119.971 119.971 122.208 -2.237 19832
102 1 1 . 1 1 26 26 GLU HA H 26 4.453 4.453 4.037 0.416 19832
103 1 1 . 1 1 26 26 GLU CA C 26 55.645 55.645 55.033 0.612 19832
104 1 1 . 1 1 26 26 GLU CB C 26 28.805 28.805 28.000 0.805 19832
105 1 1 . 1 1 26 26 GLU H H 26 7.653 7.653 7.627 0.026 19832
106 1 1 . 1 1 27 27 ARG N N 27 120.787 120.787 123.491 -2.704 19832
107 1 1 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.298 0.059 19832
108 1 1 . 1 1 27 27 ARG CA C 27 56.406 56.406 56.566 -0.160 19832
109 1 1 . 1 1 27 27 ARG CB C 27 30.763 30.763 30.681 0.082 19832
110 1 1 . 1 1 27 27 ARG H H 27 8.162 8.162 7.699 0.463 19832
111 1 1 . 1 1 28 28 GLY N N 28 109.282 109.282 107.312 1.970 19832
112 1 1 . 1 1 28 28 GLY H H 28 8.483 8.483 7.559 0.924 19832
113 1 1 . 1 1 29 29 LYS N N 29 120.396 120.396 119.914 0.482 19832
114 1 1 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.186 0.217 19832
115 1 1 . 1 1 29 29 LYS CA C 29 55.875 55.875 56.900 -1.025 19832
116 1 1 . 1 1 29 29 LYS CB C 29 33.293 33.293 33.136 0.157 19832
117 1 1 . 1 1 29 29 LYS H H 29 8.112 8.112 8.037 0.075 19832
118 1 2 . 1 1 2 2 LYS N N 2 124.386 124.386 123.382 1.004 19832
119 1 2 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.642 -0.258 19832
120 1 2 . 1 1 2 2 LYS CB C 2 32.959 32.959 34.088 -1.129 19832
121 1 2 . 1 1 2 2 LYS H H 2 9.052 9.052 8.285 0.767 19832
122 1 2 . 1 1 3 3 THR N N 3 116.039 116.039 120.107 -4.068 19832
123 1 2 . 1 1 3 3 THR HA H 3 4.216 4.216 4.115 0.101 19832
124 1 2 . 1 1 3 3 THR CB C 3 68.928 68.928 68.839 0.089 19832
125 1 2 . 1 1 3 3 THR H H 3 8.478 8.478 8.956 -0.478 19832
126 1 2 . 1 1 4 4 ILE N N 4 121.132 121.132 118.655 2.477 19832
127 1 2 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.967 0.143 19832
128 1 2 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.832 -0.260 19832
129 1 2 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.834 1.120 19832
130 1 2 . 1 1 4 4 ILE H H 4 8.556 8.556 7.870 0.686 19832
131 1 2 . 1 1 5 5 LEU N N 5 119.569 119.569 121.052 -1.483 19832
132 1 2 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.946 0.240 19832
133 1 2 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.290 -1.072 19832
134 1 2 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.079 0.001 19832
135 1 2 . 1 1 5 5 LEU H H 5 7.935 7.935 8.423 -0.488 19832
136 1 2 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.954 0.173 19832
137 1 2 . 1 1 6 6 ARG CA C 6 58.711 58.711 58.944 -0.233 19832
138 1 2 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.786 -0.099 19832
139 1 2 . 1 1 6 6 ARG H H 6 8.008 8.008 7.805 0.203 19832
140 1 2 . 1 1 7 7 PHE N N 7 118.637 118.637 117.559 1.078 19832
141 1 2 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.379 0.099 19832
142 1 2 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.908 0.205 19832
143 1 2 . 1 1 7 7 PHE H H 7 7.948 7.948 7.767 0.181 19832
144 1 2 . 1 1 8 8 VAL N N 8 116.441 116.441 120.769 -4.328 19832
145 1 2 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.676 0.217 19832
146 1 2 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.652 -0.687 19832
147 1 2 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.836 0.029 19832
148 1 2 . 1 1 8 8 VAL H H 8 8.014 8.014 8.099 -0.085 19832
149 1 2 . 1 1 9 9 ALA N N 9 121.442 121.442 120.655 0.787 19832
150 1 2 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.095 0.133 19832
151 1 2 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.823 -0.356 19832
152 1 2 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.232 0.247 19832
153 1 2 . 1 1 9 9 ALA H H 9 8.083 8.083 8.516 -0.433 19832
154 1 2 . 1 1 10 10 GLY N N 10 104.589 104.589 105.268 -0.679 19832
155 1 2 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.777 -1.114 19832
156 1 2 . 1 1 10 10 GLY H H 10 8.134 8.134 7.918 0.216 19832
157 1 2 . 1 1 11 11 TYR N N 11 118.591 118.591 123.442 -4.851 19832
158 1 2 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.107 0.216 19832
159 1 2 . 1 1 11 11 TYR H H 11 8.006 8.006 7.607 0.399 19832
160 1 2 . 1 1 12 12 ASP N N 12 119.339 119.339 118.038 1.301 19832
161 1 2 . 1 1 12 12 ASP HA H 12 4.609 4.609 4.131 0.478 19832
162 1 2 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.690 -2.601 19832
163 1 2 . 1 1 12 12 ASP H H 12 8.414 8.414 7.855 0.559 19832
164 1 2 . 1 1 13 13 ILE N N 13 119.097 119.097 118.216 0.881 19832
165 1 2 . 1 1 13 13 ILE HA H 13 3.994 3.994 3.946 0.048 19832
166 1 2 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.835 1.312 19832
167 1 2 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.535 0.950 19832
168 1 2 . 1 1 13 13 ILE H H 13 8.156 8.156 7.503 0.653 19832
169 1 2 . 1 1 14 14 ALA N N 14 123.581 123.581 123.068 0.513 19832
170 1 2 . 1 1 14 14 ALA HA H 14 4.238 4.238 4.111 0.127 19832
171 1 2 . 1 1 14 14 ALA CA C 14 53.618 53.618 54.920 -1.302 19832
172 1 2 . 1 1 14 14 ALA CB C 14 18.817 18.817 18.085 0.732 19832
173 1 2 . 1 1 14 14 ALA H H 14 8.274 8.274 8.338 -0.064 19832
174 1 2 . 1 1 15 15 SER N N 15 112.583 112.583 112.320 0.263 19832
175 1 2 . 1 1 15 15 SER HA H 15 4.299 4.299 4.065 0.234 19832
176 1 2 . 1 1 15 15 SER CA C 15 59.441 59.441 60.804 -1.363 19832
177 1 2 . 1 1 15 15 SER CB C 15 63.403 63.403 63.009 0.394 19832
178 1 2 . 1 1 15 15 SER H H 15 8.061 8.061 7.915 0.146 19832
179 1 2 . 1 1 16 16 HIS N N 16 120.408 120.408 117.804 2.604 19832
180 1 2 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.502 0.194 19832
181 1 2 . 1 1 16 16 HIS CB C 16 28.483 28.483 30.285 -1.802 19832
182 1 2 . 1 1 16 16 HIS H H 16 8.159 8.159 7.700 0.459 19832
183 1 2 . 1 1 17 17 LYS N N 17 120.845 120.845 119.931 0.914 19832
184 1 2 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.246 0.079 19832
185 1 2 . 1 1 17 17 LYS CA C 17 56.682 56.682 58.138 -1.456 19832
186 1 2 . 1 1 17 17 LYS CB C 17 32.996 32.996 33.315 -0.319 19832
187 1 2 . 1 1 17 17 LYS H H 17 8.080 8.080 7.656 0.424 19832
188 1 2 . 1 1 18 18 LYS N N 18 121.661 121.661 116.618 5.043 19832
189 1 2 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.462 -0.129 19832
190 1 2 . 1 1 18 18 LYS CA C 18 56.579 56.579 56.099 0.480 19832
191 1 2 . 1 1 18 18 LYS H H 18 8.231 8.231 7.849 0.382 19832
192 1 2 . 1 1 19 19 LYS N N 19 122.316 122.316 124.250 -1.934 19832
193 1 2 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.598 -0.197 19832
194 1 2 . 1 1 19 19 LYS CA C 19 56.600 56.600 56.481 0.119 19832
195 1 2 . 1 1 19 19 LYS CB C 19 32.973 32.973 31.985 0.988 19832
196 1 2 . 1 1 19 19 LYS H H 19 8.392 8.392 8.468 -0.076 19832
197 1 2 . 1 1 20 20 THR N N 20 113.974 113.974 116.650 -2.676 19832
198 1 2 . 1 1 20 20 THR HA H 20 4.405 4.405 4.459 -0.054 19832
199 1 2 . 1 1 20 20 THR CA C 20 61.680 61.680 62.128 -0.448 19832
200 1 2 . 1 1 20 20 THR CB C 20 69.817 69.817 69.614 0.203 19832
201 1 2 . 1 1 20 20 THR H H 20 8.085 8.085 8.366 -0.281 19832
202 1 2 . 1 1 21 21 GLY N N 21 110.706 110.706 110.777 -0.071 19832
203 1 2 . 1 1 21 21 GLY CA C 21 45.310 45.310 44.499 0.811 19832
204 1 2 . 1 1 21 21 GLY H H 21 8.360 8.360 8.247 0.113 19832
205 1 2 . 1 1 22 22 GLY N N 22 107.728 107.728 111.181 -3.453 19832
206 1 2 . 1 1 22 22 GLY CA C 22 45.175 45.175 44.970 0.205 19832
207 1 2 . 1 1 22 22 GLY H H 22 8.146 8.146 8.072 0.074 19832
208 1 2 . 1 1 23 23 TYR N N 23 119.224 119.224 120.665 -1.441 19832
209 1 2 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.878 -0.371 19832
210 1 2 . 1 1 23 23 TYR H H 23 7.870 7.870 7.694 0.176 19832
211 1 2 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.405 -0.024 19832
212 1 2 . 1 1 24 24 PRO CA C 24 64.447 64.447 65.100 -0.653 19832
213 1 2 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.167 -0.651 19832
214 1 2 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.943 -0.557 19832
215 1 2 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.286 0.466 19832
216 1 2 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.901 -1.413 19832
217 1 2 . 1 1 25 25 TRP H H 25 6.924 6.924 7.985 -1.061 19832
218 1 2 . 1 1 26 26 GLU N N 26 119.971 119.971 122.417 -2.446 19832
219 1 2 . 1 1 26 26 GLU HA H 26 4.453 4.453 4.042 0.411 19832
220 1 2 . 1 1 26 26 GLU CA C 26 55.645 55.645 55.080 0.565 19832
221 1 2 . 1 1 26 26 GLU CB C 26 28.805 28.805 27.944 0.861 19832
222 1 2 . 1 1 26 26 GLU H H 26 7.653 7.653 7.632 0.021 19832
223 1 2 . 1 1 27 27 ARG N N 27 120.787 120.787 122.793 -2.006 19832
224 1 2 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.214 0.143 19832
225 1 2 . 1 1 27 27 ARG CA C 27 56.406 56.406 56.645 -0.240 19832
226 1 2 . 1 1 27 27 ARG CB C 27 30.763 30.763 30.919 -0.156 19832
227 1 2 . 1 1 27 27 ARG H H 27 8.162 8.162 7.684 0.478 19832
228 1 2 . 1 1 28 28 GLY N N 28 109.282 109.282 106.230 3.052 19832
229 1 2 . 1 1 28 28 GLY H H 28 8.483 8.483 7.483 1.000 19832
230 1 2 . 1 1 29 29 LYS N N 29 120.396 120.396 117.898 2.498 19832
231 1 2 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.487 -0.084 19832
232 1 2 . 1 1 29 29 LYS CA C 29 55.875 55.875 56.312 -0.437 19832
233 1 2 . 1 1 29 29 LYS CB C 29 33.293 33.293 33.122 0.171 19832
234 1 2 . 1 1 29 29 LYS H H 29 8.112 8.112 8.509 -0.397 19832
235 1 3 . 1 1 2 2 LYS N N 2 124.386 124.386 123.344 1.042 19832
236 1 3 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.214 0.170 19832
237 1 3 . 1 1 2 2 LYS CB C 2 32.959 32.959 32.661 0.298 19832
238 1 3 . 1 1 2 2 LYS H H 2 9.052 9.052 8.639 0.413 19832
239 1 3 . 1 1 3 3 THR N N 3 116.039 116.039 119.762 -3.723 19832
240 1 3 . 1 1 3 3 THR HA H 3 4.216 4.216 4.028 0.188 19832
241 1 3 . 1 1 3 3 THR CB C 3 68.928 68.928 68.778 0.150 19832
242 1 3 . 1 1 3 3 THR H H 3 8.478 8.478 8.712 -0.234 19832
243 1 3 . 1 1 4 4 ILE N N 4 121.132 121.132 117.840 3.292 19832
244 1 3 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.929 0.181 19832
245 1 3 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.880 -0.308 19832
246 1 3 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.982 0.972 19832
247 1 3 . 1 1 4 4 ILE H H 4 8.556 8.556 7.841 0.715 19832
248 1 3 . 1 1 5 5 LEU N N 5 119.569 119.569 121.003 -1.434 19832
249 1 3 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.939 0.247 19832
250 1 3 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.290 -1.072 19832
251 1 3 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.081 -0.001 19832
252 1 3 . 1 1 5 5 LEU H H 5 7.935 7.935 8.428 -0.493 19832
253 1 3 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.949 0.178 19832
254 1 3 . 1 1 6 6 ARG CA C 6 58.711 58.711 58.865 -0.154 19832
255 1 3 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.735 -0.048 19832
256 1 3 . 1 1 6 6 ARG H H 6 8.008 8.008 7.811 0.197 19832
257 1 3 . 1 1 7 7 PHE N N 7 118.637 118.637 117.140 1.497 19832
258 1 3 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.383 0.095 19832
259 1 3 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.787 0.326 19832
260 1 3 . 1 1 7 7 PHE H H 7 7.948 7.948 7.772 0.176 19832
261 1 3 . 1 1 8 8 VAL N N 8 116.441 116.441 120.992 -4.551 19832
262 1 3 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.724 0.169 19832
263 1 3 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.281 -0.316 19832
264 1 3 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.767 0.098 19832
265 1 3 . 1 1 8 8 VAL H H 8 8.014 8.014 8.058 -0.044 19832
266 1 3 . 1 1 9 9 ALA N N 9 121.442 121.442 120.641 0.801 19832
267 1 3 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.117 0.111 19832
268 1 3 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.891 -0.424 19832
269 1 3 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.190 0.289 19832
270 1 3 . 1 1 9 9 ALA H H 9 8.083 8.083 8.464 -0.381 19832
271 1 3 . 1 1 10 10 GLY N N 10 104.589 104.589 105.123 -0.534 19832
272 1 3 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.876 -1.213 19832
273 1 3 . 1 1 10 10 GLY H H 10 8.134 8.134 8.031 0.103 19832
274 1 3 . 1 1 11 11 TYR N N 11 118.591 118.591 123.679 -5.088 19832
275 1 3 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.160 0.163 19832
276 1 3 . 1 1 11 11 TYR H H 11 8.006 8.006 7.485 0.521 19832
277 1 3 . 1 1 12 12 ASP N N 12 119.339 119.339 118.222 1.117 19832
278 1 3 . 1 1 12 12 ASP HA H 12 4.609 4.609 4.047 0.562 19832
279 1 3 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.483 -2.394 19832
280 1 3 . 1 1 12 12 ASP H H 12 8.414 8.414 7.842 0.572 19832
281 1 3 . 1 1 13 13 ILE N N 13 119.097 119.097 117.857 1.240 19832
282 1 3 . 1 1 13 13 ILE HA H 13 3.994 3.994 3.949 0.045 19832
283 1 3 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.319 1.828 19832
284 1 3 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.260 1.224 19832
285 1 3 . 1 1 13 13 ILE H H 13 8.156 8.156 7.444 0.712 19832
286 1 3 . 1 1 14 14 ALA N N 14 123.581 123.581 122.659 0.922 19832
287 1 3 . 1 1 14 14 ALA HA H 14 4.238 4.238 4.205 0.033 19832
288 1 3 . 1 1 14 14 ALA CA C 14 53.618 53.618 54.743 -1.125 19832
289 1 3 . 1 1 14 14 ALA CB C 14 18.817 18.817 18.658 0.159 19832
290 1 3 . 1 1 14 14 ALA H H 14 8.274 8.274 8.101 0.173 19832
291 1 3 . 1 1 15 15 SER N N 15 112.583 112.583 115.284 -2.701 19832
292 1 3 . 1 1 15 15 SER HA H 15 4.299 4.299 4.151 0.148 19832
293 1 3 . 1 1 15 15 SER CA C 15 59.441 59.441 61.018 -1.577 19832
294 1 3 . 1 1 15 15 SER CB C 15 63.403 63.403 62.942 0.461 19832
295 1 3 . 1 1 15 15 SER H H 15 8.061 8.061 7.897 0.164 19832
296 1 3 . 1 1 16 16 HIS N N 16 120.408 120.408 118.098 2.310 19832
297 1 3 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.755 -0.059 19832
298 1 3 . 1 1 16 16 HIS CB C 16 28.483 28.483 29.735 -1.252 19832
299 1 3 . 1 1 16 16 HIS H H 16 8.159 8.159 7.703 0.456 19832
300 1 3 . 1 1 17 17 LYS N N 17 120.845 120.845 120.356 0.489 19832
301 1 3 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.239 0.086 19832
302 1 3 . 1 1 17 17 LYS CA C 17 56.682 56.682 58.436 -1.754 19832
303 1 3 . 1 1 17 17 LYS CB C 17 32.996 32.996 33.380 -0.384 19832
304 1 3 . 1 1 17 17 LYS H H 17 8.080 8.080 7.897 0.183 19832
305 1 3 . 1 1 18 18 LYS N N 18 121.661 121.661 116.130 5.531 19832
306 1 3 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.632 -0.299 19832
307 1 3 . 1 1 18 18 LYS CA C 18 56.579 56.579 55.549 1.030 19832
308 1 3 . 1 1 18 18 LYS H H 18 8.231 8.231 8.240 -0.009 19832
309 1 3 . 1 1 19 19 LYS N N 19 122.316 122.316 120.112 2.204 19832
310 1 3 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.381 0.020 19832
311 1 3 . 1 1 19 19 LYS CA C 19 56.600 56.600 56.512 0.088 19832
312 1 3 . 1 1 19 19 LYS CB C 19 32.973 32.973 34.547 -1.574 19832
313 1 3 . 1 1 19 19 LYS H H 19 8.392 8.392 8.414 -0.022 19832
314 1 3 . 1 1 20 20 THR N N 20 113.974 113.974 117.470 -3.496 19832
315 1 3 . 1 1 20 20 THR HA H 20 4.405 4.405 4.405 0.000 19832
316 1 3 . 1 1 20 20 THR CA C 20 61.680 61.680 61.469 0.211 19832
317 1 3 . 1 1 20 20 THR CB C 20 69.817 69.817 67.360 2.457 19832
318 1 3 . 1 1 20 20 THR H H 20 8.085 8.085 8.418 -0.333 19832
319 1 3 . 1 1 21 21 GLY N N 21 110.706 110.706 113.930 -3.224 19832
320 1 3 . 1 1 21 21 GLY CA C 21 45.310 45.310 45.292 0.018 19832
321 1 3 . 1 1 21 21 GLY H H 21 8.360 8.360 8.540 -0.180 19832
322 1 3 . 1 1 22 22 GLY N N 22 107.728 107.728 111.782 -4.054 19832
323 1 3 . 1 1 22 22 GLY CA C 22 45.175 45.175 44.624 0.551 19832
324 1 3 . 1 1 22 22 GLY H H 22 8.146 8.146 7.849 0.297 19832
325 1 3 . 1 1 23 23 TYR N N 23 119.224 119.224 119.611 -0.387 19832
326 1 3 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.847 -0.340 19832
327 1 3 . 1 1 23 23 TYR H H 23 7.870 7.870 7.574 0.296 19832
328 1 3 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.489 -0.108 19832
329 1 3 . 1 1 24 24 PRO CA C 24 64.447 64.447 64.640 -0.193 19832
330 1 3 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.380 -0.864 19832
331 1 3 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.892 -0.506 19832
332 1 3 . 1 1 25 25 TRP CA C 25 57.752 57.752 56.804 0.948 19832
333 1 3 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.807 -1.319 19832
334 1 3 . 1 1 25 25 TRP H H 25 6.924 6.924 7.893 -0.969 19832
335 1 3 . 1 1 26 26 GLU N N 26 119.971 119.971 122.831 -2.860 19832
336 1 3 . 1 1 26 26 GLU HA H 26 4.453 4.453 4.020 0.433 19832
337 1 3 . 1 1 26 26 GLU CA C 26 55.645 55.645 56.006 -0.361 19832
338 1 3 . 1 1 26 26 GLU CB C 26 28.805 28.805 27.725 1.080 19832
339 1 3 . 1 1 26 26 GLU H H 26 7.653 7.653 7.540 0.113 19832
340 1 3 . 1 1 27 27 ARG N N 27 120.787 120.787 123.384 -2.597 19832
341 1 3 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.404 -0.047 19832
342 1 3 . 1 1 27 27 ARG CA C 27 56.406 56.406 56.367 0.039 19832
343 1 3 . 1 1 27 27 ARG CB C 27 30.763 30.763 31.474 -0.711 19832
344 1 3 . 1 1 27 27 ARG H H 27 8.162 8.162 7.675 0.487 19832
345 1 3 . 1 1 28 28 GLY N N 28 109.282 109.282 109.592 -0.310 19832
346 1 3 . 1 1 28 28 GLY H H 28 8.483 8.483 8.112 0.371 19832
347 1 3 . 1 1 29 29 LYS N N 29 120.396 120.396 119.472 0.924 19832
348 1 3 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.172 0.231 19832
349 1 3 . 1 1 29 29 LYS CA C 29 55.875 55.875 56.801 -0.926 19832
350 1 3 . 1 1 29 29 LYS CB C 29 33.293 33.293 32.231 1.062 19832
351 1 3 . 1 1 29 29 LYS H H 29 8.112 8.112 8.231 -0.119 19832
352 1 4 . 1 1 2 2 LYS N N 2 124.386 124.386 122.498 1.888 19832
353 1 4 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.682 -0.298 19832
354 1 4 . 1 1 2 2 LYS CB C 2 32.959 32.959 34.059 -1.100 19832
355 1 4 . 1 1 2 2 LYS H H 2 9.052 9.052 8.122 0.930 19832
356 1 4 . 1 1 3 3 THR N N 3 116.039 116.039 119.426 -3.387 19832
357 1 4 . 1 1 3 3 THR HA H 3 4.216 4.216 4.070 0.146 19832
358 1 4 . 1 1 3 3 THR CB C 3 68.928 68.928 68.711 0.217 19832
359 1 4 . 1 1 3 3 THR H H 3 8.478 8.478 8.906 -0.428 19832
360 1 4 . 1 1 4 4 ILE N N 4 121.132 121.132 117.885 3.247 19832
361 1 4 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.940 0.170 19832
362 1 4 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.842 -0.270 19832
363 1 4 . 1 1 4 4 ILE CB C 4 37.954 37.954 37.015 0.939 19832
364 1 4 . 1 1 4 4 ILE H H 4 8.556 8.556 7.833 0.723 19832
365 1 4 . 1 1 5 5 LEU N N 5 119.569 119.569 121.019 -1.450 19832
366 1 4 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.945 0.241 19832
367 1 4 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.300 -1.082 19832
368 1 4 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.085 -0.005 19832
369 1 4 . 1 1 5 5 LEU H H 5 7.935 7.935 8.432 -0.497 19832
370 1 4 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.955 0.172 19832
371 1 4 . 1 1 6 6 ARG CA C 6 58.711 58.711 58.893 -0.182 19832
372 1 4 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.764 -0.077 19832
373 1 4 . 1 1 6 6 ARG H H 6 8.008 8.008 7.810 0.198 19832
374 1 4 . 1 1 7 7 PHE N N 7 118.637 118.637 117.468 1.169 19832
375 1 4 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.377 0.101 19832
376 1 4 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.924 0.189 19832
377 1 4 . 1 1 7 7 PHE H H 7 7.948 7.948 7.772 0.176 19832
378 1 4 . 1 1 8 8 VAL N N 8 116.441 116.441 120.776 -4.335 19832
379 1 4 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.677 0.216 19832
380 1 4 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.654 -0.689 19832
381 1 4 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.844 0.021 19832
382 1 4 . 1 1 8 8 VAL H H 8 8.014 8.014 8.103 -0.089 19832
383 1 4 . 1 1 9 9 ALA N N 9 121.442 121.442 120.647 0.795 19832
384 1 4 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.107 0.121 19832
385 1 4 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.818 -0.351 19832
386 1 4 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.247 0.232 19832
387 1 4 . 1 1 9 9 ALA H H 9 8.083 8.083 8.518 -0.435 19832
388 1 4 . 1 1 10 10 GLY N N 10 104.589 104.589 105.334 -0.745 19832
389 1 4 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.859 -1.196 19832
390 1 4 . 1 1 10 10 GLY H H 10 8.134 8.134 8.021 0.113 19832
391 1 4 . 1 1 11 11 TYR N N 11 118.591 118.591 123.646 -5.055 19832
392 1 4 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.184 0.139 19832
393 1 4 . 1 1 11 11 TYR H H 11 8.006 8.006 7.460 0.546 19832
394 1 4 . 1 1 12 12 ASP N N 12 119.339 119.339 117.321 2.018 19832
395 1 4 . 1 1 12 12 ASP HA H 12 4.609 4.609 4.078 0.531 19832
396 1 4 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.725 -2.636 19832
397 1 4 . 1 1 12 12 ASP H H 12 8.414 8.414 7.822 0.592 19832
398 1 4 . 1 1 13 13 ILE N N 13 119.097 119.097 118.780 0.317 19832
399 1 4 . 1 1 13 13 ILE HA H 13 3.994 3.994 3.955 0.039 19832
400 1 4 . 1 1 13 13 ILE CA C 13 63.147 63.147 62.268 0.879 19832
401 1 4 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.387 1.097 19832
402 1 4 . 1 1 13 13 ILE H H 13 8.156 8.156 7.544 0.612 19832
403 1 4 . 1 1 14 14 ALA N N 14 123.581 123.581 123.330 0.251 19832
404 1 4 . 1 1 14 14 ALA HA H 14 4.238 4.238 4.147 0.091 19832
405 1 4 . 1 1 14 14 ALA CA C 14 53.618 53.618 55.145 -1.527 19832
406 1 4 . 1 1 14 14 ALA CB C 14 18.817 18.817 17.988 0.829 19832
407 1 4 . 1 1 14 14 ALA H H 14 8.274 8.274 8.499 -0.225 19832
408 1 4 . 1 1 15 15 SER N N 15 112.583 112.583 113.727 -1.144 19832
409 1 4 . 1 1 15 15 SER HA H 15 4.299 4.299 4.146 0.153 19832
410 1 4 . 1 1 15 15 SER CA C 15 59.441 59.441 60.885 -1.444 19832
411 1 4 . 1 1 15 15 SER CB C 15 63.403 63.403 63.047 0.356 19832
412 1 4 . 1 1 15 15 SER H H 15 8.061 8.061 8.147 -0.086 19832
413 1 4 . 1 1 16 16 HIS N N 16 120.408 120.408 117.527 2.881 19832
414 1 4 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.573 0.123 19832
415 1 4 . 1 1 16 16 HIS CB C 16 28.483 28.483 30.756 -2.273 19832
416 1 4 . 1 1 16 16 HIS H H 16 8.159 8.159 7.786 0.373 19832
417 1 4 . 1 1 17 17 LYS N N 17 120.845 120.845 120.437 0.408 19832
418 1 4 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.183 0.142 19832
419 1 4 . 1 1 17 17 LYS CA C 17 56.682 56.682 57.824 -1.142 19832
420 1 4 . 1 1 17 17 LYS CB C 17 32.996 32.996 33.388 -0.392 19832
421 1 4 . 1 1 17 17 LYS H H 17 8.080 8.080 7.758 0.322 19832
422 1 4 . 1 1 18 18 LYS N N 18 121.661 121.661 118.320 3.341 19832
423 1 4 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.429 -0.096 19832
424 1 4 . 1 1 18 18 LYS CA C 18 56.579 56.579 56.178 0.401 19832
425 1 4 . 1 1 18 18 LYS H H 18 8.231 8.231 8.030 0.201 19832
426 1 4 . 1 1 19 19 LYS N N 19 122.316 122.316 123.902 -1.586 19832
427 1 4 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.464 -0.063 19832
428 1 4 . 1 1 19 19 LYS CA C 19 56.600 56.600 57.077 -0.477 19832
429 1 4 . 1 1 19 19 LYS CB C 19 32.973 32.973 33.237 -0.264 19832
430 1 4 . 1 1 19 19 LYS H H 19 8.392 8.392 8.614 -0.222 19832
431 1 4 . 1 1 20 20 THR N N 20 113.974 113.974 112.868 1.106 19832
432 1 4 . 1 1 20 20 THR HA H 20 4.405 4.405 4.381 0.024 19832
433 1 4 . 1 1 20 20 THR CA C 20 61.680 61.680 62.051 -0.371 19832
434 1 4 . 1 1 20 20 THR CB C 20 69.817 69.817 69.911 -0.094 19832
435 1 4 . 1 1 20 20 THR H H 20 8.085 8.085 7.668 0.417 19832
436 1 4 . 1 1 21 21 GLY N N 21 110.706 110.706 113.294 -2.588 19832
437 1 4 . 1 1 21 21 GLY CA C 21 45.310 45.310 45.269 0.042 19832
438 1 4 . 1 1 21 21 GLY H H 21 8.360 8.360 8.345 0.015 19832
439 1 4 . 1 1 22 22 GLY N N 22 107.728 107.728 108.022 -0.294 19832
440 1 4 . 1 1 22 22 GLY CA C 22 45.175 45.175 45.474 -0.299 19832
441 1 4 . 1 1 22 22 GLY H H 22 8.146 8.146 8.093 0.053 19832
442 1 4 . 1 1 23 23 TYR N N 23 119.224 119.224 119.967 -0.743 19832
443 1 4 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.897 -0.390 19832
444 1 4 . 1 1 23 23 TYR H H 23 7.870 7.870 8.077 -0.207 19832
445 1 4 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.407 -0.026 19832
446 1 4 . 1 1 24 24 PRO CA C 24 64.447 64.447 65.153 -0.706 19832
447 1 4 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.227 -0.711 19832
448 1 4 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.985 -0.599 19832
449 1 4 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.686 0.066 19832
450 1 4 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.541 -1.053 19832
451 1 4 . 1 1 25 25 TRP H H 25 6.924 6.924 8.018 -1.095 19832
452 1 4 . 1 1 26 26 GLU N N 26 119.971 119.971 120.591 -0.620 19832
453 1 4 . 1 1 26 26 GLU HA H 26 4.453 4.453 3.879 0.574 19832
454 1 4 . 1 1 26 26 GLU CA C 26 55.645 55.645 55.447 0.199 19832
455 1 4 . 1 1 26 26 GLU CB C 26 28.805 28.805 27.784 1.021 19832
456 1 4 . 1 1 26 26 GLU H H 26 7.653 7.653 7.565 0.088 19832
457 1 4 . 1 1 27 27 ARG N N 27 120.787 120.787 119.470 1.317 19832
458 1 4 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.107 0.250 19832
459 1 4 . 1 1 27 27 ARG CA C 27 56.406 56.406 57.614 -1.208 19832
460 1 4 . 1 1 27 27 ARG CB C 27 30.763 30.763 30.525 0.238 19832
461 1 4 . 1 1 27 27 ARG H H 27 8.162 8.162 7.598 0.564 19832
462 1 4 . 1 1 28 28 GLY N N 28 109.282 109.282 106.774 2.508 19832
463 1 4 . 1 1 28 28 GLY H H 28 8.483 8.483 7.988 0.495 19832
464 1 4 . 1 1 29 29 LYS N N 29 120.396 120.396 119.867 0.529 19832
465 1 4 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.167 0.236 19832
466 1 4 . 1 1 29 29 LYS CA C 29 55.875 55.875 57.403 -1.528 19832
467 1 4 . 1 1 29 29 LYS CB C 29 33.293 33.293 32.575 0.718 19832
468 1 4 . 1 1 29 29 LYS H H 29 8.112 8.112 8.474 -0.362 19832
469 1 5 . 1 1 2 2 LYS N N 2 124.386 124.386 122.738 1.648 19832
470 1 5 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.654 -0.270 19832
471 1 5 . 1 1 2 2 LYS CB C 2 32.959 32.959 33.394 -0.435 19832
472 1 5 . 1 1 2 2 LYS H H 2 9.052 9.052 8.557 0.495 19832
473 1 5 . 1 1 3 3 THR N N 3 116.039 116.039 120.731 -4.692 19832
474 1 5 . 1 1 3 3 THR HA H 3 4.216 4.216 4.092 0.124 19832
475 1 5 . 1 1 3 3 THR CB C 3 68.928 68.928 68.705 0.223 19832
476 1 5 . 1 1 3 3 THR H H 3 8.478 8.478 9.007 -0.529 19832
477 1 5 . 1 1 4 4 ILE N N 4 121.132 121.132 118.428 2.704 19832
478 1 5 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.968 0.142 19832
479 1 5 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.819 -0.247 19832
480 1 5 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.855 1.099 19832
481 1 5 . 1 1 4 4 ILE H H 4 8.556 8.556 7.842 0.714 19832
482 1 5 . 1 1 5 5 LEU N N 5 119.569 119.569 121.050 -1.481 19832
483 1 5 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.939 0.247 19832
484 1 5 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.307 -1.089 19832
485 1 5 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.075 0.005 19832
486 1 5 . 1 1 5 5 LEU H H 5 7.935 7.935 8.429 -0.494 19832
487 1 5 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.959 0.168 19832
488 1 5 . 1 1 6 6 ARG CA C 6 58.711 58.711 59.027 -0.316 19832
489 1 5 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.832 -0.145 19832
490 1 5 . 1 1 6 6 ARG H H 6 8.008 8.008 7.800 0.208 19832
491 1 5 . 1 1 7 7 PHE N N 7 118.637 118.637 117.413 1.224 19832
492 1 5 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.354 0.124 19832
493 1 5 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.831 0.282 19832
494 1 5 . 1 1 7 7 PHE H H 7 7.948 7.948 7.804 0.144 19832
495 1 5 . 1 1 8 8 VAL N N 8 116.441 116.441 121.065 -4.624 19832
496 1 5 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.751 0.142 19832
497 1 5 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.257 -0.292 19832
498 1 5 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.391 0.474 19832
499 1 5 . 1 1 8 8 VAL H H 8 8.014 8.014 8.096 -0.082 19832
500 1 5 . 1 1 9 9 ALA N N 9 121.442 121.442 120.612 0.830 19832
501 1 5 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.139 0.089 19832
502 1 5 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.895 -0.428 19832
503 1 5 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.407 0.072 19832
504 1 5 . 1 1 9 9 ALA H H 9 8.083 8.083 8.548 -0.465 19832
505 1 5 . 1 1 10 10 GLY N N 10 104.589 104.589 105.392 -0.803 19832
506 1 5 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.814 -1.151 19832
507 1 5 . 1 1 10 10 GLY H H 10 8.134 8.134 7.928 0.206 19832
508 1 5 . 1 1 11 11 TYR N N 11 118.591 118.591 123.284 -4.693 19832
509 1 5 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.093 0.230 19832
510 1 5 . 1 1 11 11 TYR H H 11 8.006 8.006 7.613 0.393 19832
511 1 5 . 1 1 12 12 ASP N N 12 119.339 119.339 118.275 1.064 19832
512 1 5 . 1 1 12 12 ASP HA H 12 4.609 4.609 4.098 0.511 19832
513 1 5 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.862 -2.773 19832
514 1 5 . 1 1 12 12 ASP H H 12 8.414 8.414 7.853 0.561 19832
515 1 5 . 1 1 13 13 ILE N N 13 119.097 119.097 118.773 0.324 19832
516 1 5 . 1 1 13 13 ILE HA H 13 3.994 3.994 4.189 -0.195 19832
517 1 5 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.391 1.756 19832
518 1 5 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.204 1.280 19832
519 1 5 . 1 1 13 13 ILE H H 13 8.156 8.156 7.573 0.583 19832
520 1 5 . 1 1 14 14 ALA N N 14 123.581 123.581 123.363 0.218 19832
521 1 5 . 1 1 14 14 ALA HA H 14 4.238 4.238 3.948 0.290 19832
522 1 5 . 1 1 14 14 ALA CA C 14 53.618 53.618 55.001 -1.383 19832
523 1 5 . 1 1 14 14 ALA CB C 14 18.817 18.817 17.898 0.919 19832
524 1 5 . 1 1 14 14 ALA H H 14 8.274 8.274 8.318 -0.044 19832
525 1 5 . 1 1 15 15 SER N N 15 112.583 112.583 114.060 -1.477 19832
526 1 5 . 1 1 15 15 SER HA H 15 4.299 4.299 4.056 0.243 19832
527 1 5 . 1 1 15 15 SER CA C 15 59.441 59.441 61.435 -1.994 19832
528 1 5 . 1 1 15 15 SER CB C 15 63.403 63.403 62.985 0.418 19832
529 1 5 . 1 1 15 15 SER H H 15 8.061 8.061 7.907 0.154 19832
530 1 5 . 1 1 16 16 HIS N N 16 120.408 120.408 115.268 5.140 19832
531 1 5 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.687 0.009 19832
532 1 5 . 1 1 16 16 HIS CB C 16 28.483 28.483 29.671 -1.188 19832
533 1 5 . 1 1 16 16 HIS H H 16 8.159 8.159 7.604 0.555 19832
534 1 5 . 1 1 17 17 LYS N N 17 120.845 120.845 120.516 0.329 19832
535 1 5 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.031 0.294 19832
536 1 5 . 1 1 17 17 LYS CA C 17 56.682 56.682 58.489 -1.806 19832
537 1 5 . 1 1 17 17 LYS CB C 17 32.996 32.996 32.809 0.187 19832
538 1 5 . 1 1 17 17 LYS H H 17 8.080 8.080 7.067 1.013 19832
539 1 5 . 1 1 18 18 LYS N N 18 121.661 121.661 118.127 3.534 19832
540 1 5 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.444 -0.111 19832
541 1 5 . 1 1 18 18 LYS CA C 18 56.579 56.579 55.699 0.880 19832
542 1 5 . 1 1 18 18 LYS H H 18 8.231 8.231 8.093 0.138 19832
543 1 5 . 1 1 19 19 LYS N N 19 122.316 122.316 123.837 -1.521 19832
544 1 5 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.339 0.062 19832
545 1 5 . 1 1 19 19 LYS CA C 19 56.600 56.600 56.446 0.154 19832
546 1 5 . 1 1 19 19 LYS CB C 19 32.973 32.973 34.227 -1.254 19832
547 1 5 . 1 1 19 19 LYS H H 19 8.392 8.392 8.529 -0.137 19832
548 1 5 . 1 1 20 20 THR N N 20 113.974 113.974 114.796 -0.822 19832
549 1 5 . 1 1 20 20 THR HA H 20 4.405 4.405 4.118 0.287 19832
550 1 5 . 1 1 20 20 THR CA C 20 61.680 61.680 62.804 -1.124 19832
551 1 5 . 1 1 20 20 THR CB C 20 69.817 69.817 68.045 1.772 19832
552 1 5 . 1 1 20 20 THR H H 20 8.085 8.085 8.179 -0.094 19832
553 1 5 . 1 1 21 21 GLY N N 21 110.706 110.706 108.462 2.244 19832
554 1 5 . 1 1 21 21 GLY CA C 21 45.310 45.310 45.940 -0.630 19832
555 1 5 . 1 1 21 21 GLY H H 21 8.360 8.360 8.839 -0.479 19832
556 1 5 . 1 1 22 22 GLY N N 22 107.728 107.728 107.347 0.381 19832
557 1 5 . 1 1 22 22 GLY CA C 22 45.175 45.175 44.632 0.543 19832
558 1 5 . 1 1 22 22 GLY H H 22 8.146 8.146 7.744 0.402 19832
559 1 5 . 1 1 23 23 TYR N N 23 119.224 119.224 119.197 0.027 19832
560 1 5 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.980 -0.473 19832
561 1 5 . 1 1 23 23 TYR H H 23 7.870 7.870 7.992 -0.122 19832
562 1 5 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.428 -0.047 19832
563 1 5 . 1 1 24 24 PRO CA C 24 64.447 64.447 65.131 -0.684 19832
564 1 5 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.245 -0.729 19832
565 1 5 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.949 -0.563 19832
566 1 5 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.291 0.461 19832
567 1 5 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.902 -1.414 19832
568 1 5 . 1 1 25 25 TRP H H 25 6.924 6.924 7.991 -1.067 19832
569 1 5 . 1 1 26 26 GLU N N 26 119.971 119.971 122.550 -2.579 19832
570 1 5 . 1 1 26 26 GLU HA H 26 4.453 4.453 4.031 0.422 19832
571 1 5 . 1 1 26 26 GLU CA C 26 55.645 55.645 54.981 0.664 19832
572 1 5 . 1 1 26 26 GLU CB C 26 28.805 28.805 27.931 0.874 19832
573 1 5 . 1 1 26 26 GLU H H 26 7.653 7.653 7.584 0.069 19832
574 1 5 . 1 1 27 27 ARG N N 27 120.787 120.787 123.329 -2.542 19832
575 1 5 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.139 0.218 19832
576 1 5 . 1 1 27 27 ARG CA C 27 56.406 56.406 56.870 -0.464 19832
577 1 5 . 1 1 27 27 ARG CB C 27 30.763 30.763 30.606 0.157 19832
578 1 5 . 1 1 27 27 ARG H H 27 8.162 8.162 7.848 0.314 19832
579 1 5 . 1 1 28 28 GLY N N 28 109.282 109.282 106.487 2.795 19832
580 1 5 . 1 1 28 28 GLY H H 28 8.483 8.483 7.479 1.004 19832
581 1 5 . 1 1 29 29 LYS N N 29 120.396 120.396 119.227 1.169 19832
582 1 5 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.335 0.068 19832
583 1 5 . 1 1 29 29 LYS CA C 29 55.875 55.875 56.958 -1.083 19832
584 1 5 . 1 1 29 29 LYS CB C 29 33.293 33.293 33.172 0.121 19832
585 1 5 . 1 1 29 29 LYS H H 29 8.112 8.112 8.310 -0.198 19832
586 1 6 . 1 1 2 2 LYS N N 2 124.386 124.386 125.759 -1.373 19832
587 1 6 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.272 0.112 19832
588 1 6 . 1 1 2 2 LYS CB C 2 32.959 32.959 32.550 0.409 19832
589 1 6 . 1 1 2 2 LYS H H 2 9.052 9.052 8.676 0.376 19832
590 1 6 . 1 1 3 3 THR N N 3 116.039 116.039 119.588 -3.549 19832
591 1 6 . 1 1 3 3 THR HA H 3 4.216 4.216 4.064 0.152 19832
592 1 6 . 1 1 3 3 THR CB C 3 68.928 68.928 68.820 0.108 19832
593 1 6 . 1 1 3 3 THR H H 3 8.478 8.478 8.665 -0.187 19832
594 1 6 . 1 1 4 4 ILE N N 4 121.132 121.132 118.688 2.444 19832
595 1 6 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.972 0.138 19832
596 1 6 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.883 -0.311 19832
597 1 6 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.875 1.079 19832
598 1 6 . 1 1 4 4 ILE H H 4 8.556 8.556 7.907 0.649 19832
599 1 6 . 1 1 5 5 LEU N N 5 119.569 119.569 121.052 -1.483 19832
600 1 6 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.951 0.235 19832
601 1 6 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.316 -1.098 19832
602 1 6 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.080 -0.000 19832
603 1 6 . 1 1 5 5 LEU H H 5 7.935 7.935 8.431 -0.496 19832
604 1 6 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.964 0.163 19832
605 1 6 . 1 1 6 6 ARG CA C 6 58.711 58.711 58.978 -0.267 19832
606 1 6 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.826 -0.139 19832
607 1 6 . 1 1 6 6 ARG H H 6 8.008 8.008 7.806 0.202 19832
608 1 6 . 1 1 7 7 PHE N N 7 118.637 118.637 117.463 1.174 19832
609 1 6 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.380 0.098 19832
610 1 6 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.847 0.266 19832
611 1 6 . 1 1 7 7 PHE H H 7 7.948 7.948 7.808 0.140 19832
612 1 6 . 1 1 8 8 VAL N N 8 116.441 116.441 121.086 -4.645 19832
613 1 6 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.777 0.116 19832
614 1 6 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.278 -0.312 19832
615 1 6 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.399 0.466 19832
616 1 6 . 1 1 8 8 VAL H H 8 8.014 8.014 8.114 -0.100 19832
617 1 6 . 1 1 9 9 ALA N N 9 121.442 121.442 120.656 0.786 19832
618 1 6 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.143 0.085 19832
619 1 6 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.897 -0.430 19832
620 1 6 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.412 0.067 19832
621 1 6 . 1 1 9 9 ALA H H 9 8.083 8.083 8.559 -0.476 19832
622 1 6 . 1 1 10 10 GLY N N 10 104.589 104.589 105.414 -0.825 19832
623 1 6 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.834 -1.171 19832
624 1 6 . 1 1 10 10 GLY H H 10 8.134 8.134 7.924 0.210 19832
625 1 6 . 1 1 11 11 TYR N N 11 118.591 118.591 123.689 -5.098 19832
626 1 6 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.129 0.194 19832
627 1 6 . 1 1 11 11 TYR H H 11 8.006 8.006 7.637 0.369 19832
628 1 6 . 1 1 12 12 ASP N N 12 119.339 119.339 118.028 1.311 19832
629 1 6 . 1 1 12 12 ASP HA H 12 4.609 4.609 4.083 0.526 19832
630 1 6 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.683 -2.594 19832
631 1 6 . 1 1 12 12 ASP H H 12 8.414 8.414 7.913 0.501 19832
632 1 6 . 1 1 13 13 ILE N N 13 119.097 119.097 118.177 0.920 19832
633 1 6 . 1 1 13 13 ILE HA H 13 3.994 3.994 4.072 -0.078 19832
634 1 6 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.385 1.762 19832
635 1 6 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.597 0.887 19832
636 1 6 . 1 1 13 13 ILE H H 13 8.156 8.156 7.560 0.596 19832
637 1 6 . 1 1 14 14 ALA N N 14 123.581 123.581 123.067 0.514 19832
638 1 6 . 1 1 14 14 ALA HA H 14 4.238 4.238 4.085 0.153 19832
639 1 6 . 1 1 14 14 ALA CA C 14 53.618 53.618 54.918 -1.300 19832
640 1 6 . 1 1 14 14 ALA CB C 14 18.817 18.817 18.036 0.781 19832
641 1 6 . 1 1 14 14 ALA H H 14 8.274 8.274 8.314 -0.040 19832
642 1 6 . 1 1 15 15 SER N N 15 112.583 112.583 112.662 -0.079 19832
643 1 6 . 1 1 15 15 SER HA H 15 4.299 4.299 4.005 0.294 19832
644 1 6 . 1 1 15 15 SER CA C 15 59.441 59.441 60.865 -1.424 19832
645 1 6 . 1 1 15 15 SER CB C 15 63.403 63.403 62.803 0.600 19832
646 1 6 . 1 1 15 15 SER H H 15 8.061 8.061 7.878 0.183 19832
647 1 6 . 1 1 16 16 HIS N N 16 120.408 120.408 117.294 3.114 19832
648 1 6 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.576 0.120 19832
649 1 6 . 1 1 16 16 HIS CB C 16 28.483 28.483 30.159 -1.676 19832
650 1 6 . 1 1 16 16 HIS H H 16 8.159 8.159 7.565 0.594 19832
651 1 6 . 1 1 17 17 LYS N N 17 120.845 120.845 120.647 0.198 19832
652 1 6 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.139 0.186 19832
653 1 6 . 1 1 17 17 LYS CA C 17 56.682 56.682 58.551 -1.869 19832
654 1 6 . 1 1 17 17 LYS CB C 17 32.996 32.996 33.295 -0.299 19832
655 1 6 . 1 1 17 17 LYS H H 17 8.080 8.080 7.559 0.521 19832
656 1 6 . 1 1 18 18 LYS N N 18 121.661 121.661 115.568 6.093 19832
657 1 6 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.390 -0.057 19832
658 1 6 . 1 1 18 18 LYS CA C 18 56.579 56.579 56.155 0.424 19832
659 1 6 . 1 1 18 18 LYS H H 18 8.231 8.231 7.695 0.536 19832
660 1 6 . 1 1 19 19 LYS N N 19 122.316 122.316 123.032 -0.716 19832
661 1 6 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.223 0.178 19832
662 1 6 . 1 1 19 19 LYS CA C 19 56.600 56.600 57.950 -1.350 19832
663 1 6 . 1 1 19 19 LYS CB C 19 32.973 32.973 32.763 0.210 19832
664 1 6 . 1 1 19 19 LYS H H 19 8.392 8.392 8.605 -0.213 19832
665 1 6 . 1 1 20 20 THR N N 20 113.974 113.974 110.946 3.028 19832
666 1 6 . 1 1 20 20 THR HA H 20 4.405 4.405 4.517 -0.112 19832
667 1 6 . 1 1 20 20 THR CA C 20 61.680 61.680 61.498 0.182 19832
668 1 6 . 1 1 20 20 THR CB C 20 69.817 69.817 69.034 0.783 19832
669 1 6 . 1 1 20 20 THR H H 20 8.085 8.085 7.504 0.581 19832
670 1 6 . 1 1 21 21 GLY N N 21 110.706 110.706 110.432 0.274 19832
671 1 6 . 1 1 21 21 GLY CA C 21 45.310 45.310 45.215 0.095 19832
672 1 6 . 1 1 21 21 GLY H H 21 8.360 8.360 7.875 0.485 19832
673 1 6 . 1 1 22 22 GLY N N 22 107.728 107.728 108.415 -0.687 19832
674 1 6 . 1 1 22 22 GLY CA C 22 45.175 45.175 44.529 0.646 19832
675 1 6 . 1 1 22 22 GLY H H 22 8.146 8.146 7.684 0.462 19832
676 1 6 . 1 1 23 23 TYR N N 23 119.224 119.224 122.287 -3.063 19832
677 1 6 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.896 -0.390 19832
678 1 6 . 1 1 23 23 TYR H H 23 7.870 7.870 7.683 0.187 19832
679 1 6 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.365 0.016 19832
680 1 6 . 1 1 24 24 PRO CA C 24 64.447 64.447 65.152 -0.705 19832
681 1 6 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.054 -0.538 19832
682 1 6 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.756 -0.370 19832
683 1 6 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.253 0.499 19832
684 1 6 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.910 -1.422 19832
685 1 6 . 1 1 25 25 TRP H H 25 6.924 6.924 7.777 -0.853 19832
686 1 6 . 1 1 26 26 GLU N N 26 119.971 119.971 122.199 -2.228 19832
687 1 6 . 1 1 26 26 GLU HA H 26 4.453 4.453 3.938 0.515 19832
688 1 6 . 1 1 26 26 GLU CA C 26 55.645 55.645 55.540 0.105 19832
689 1 6 . 1 1 26 26 GLU CB C 26 28.805 28.805 28.049 0.756 19832
690 1 6 . 1 1 26 26 GLU H H 26 7.653 7.653 7.444 0.209 19832
691 1 6 . 1 1 27 27 ARG N N 27 120.787 120.787 124.911 -4.124 19832
692 1 6 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.452 -0.095 19832
693 1 6 . 1 1 27 27 ARG CA C 27 56.406 56.406 55.779 0.626 19832
694 1 6 . 1 1 27 27 ARG CB C 27 30.763 30.763 31.140 -0.377 19832
695 1 6 . 1 1 27 27 ARG H H 27 8.162 8.162 7.797 0.365 19832
696 1 6 . 1 1 28 28 GLY N N 28 109.282 109.282 113.826 -4.544 19832
697 1 6 . 1 1 28 28 GLY H H 28 8.483 8.483 8.255 0.228 19832
698 1 6 . 1 1 29 29 LYS N N 29 120.396 120.396 119.066 1.330 19832
699 1 6 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.194 0.209 19832
700 1 6 . 1 1 29 29 LYS CA C 29 55.875 55.875 56.415 -0.540 19832
701 1 6 . 1 1 29 29 LYS CB C 29 33.293 33.293 32.847 0.445 19832
702 1 6 . 1 1 29 29 LYS H H 29 8.112 8.112 8.173 -0.061 19832
703 1 7 . 1 1 2 2 LYS N N 2 124.386 124.386 125.665 -1.279 19832
704 1 7 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.302 0.082 19832
705 1 7 . 1 1 2 2 LYS CB C 2 32.959 32.959 33.157 -0.198 19832
706 1 7 . 1 1 2 2 LYS H H 2 9.052 9.052 8.618 0.434 19832
707 1 7 . 1 1 3 3 THR N N 3 116.039 116.039 120.124 -4.085 19832
708 1 7 . 1 1 3 3 THR HA H 3 4.216 4.216 4.054 0.162 19832
709 1 7 . 1 1 3 3 THR CB C 3 68.928 68.928 68.529 0.399 19832
710 1 7 . 1 1 3 3 THR H H 3 8.478 8.478 8.787 -0.309 19832
711 1 7 . 1 1 4 4 ILE N N 4 121.132 121.132 117.892 3.240 19832
712 1 7 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.955 0.155 19832
713 1 7 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.860 -0.288 19832
714 1 7 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.991 0.963 19832
715 1 7 . 1 1 4 4 ILE H H 4 8.556 8.556 7.824 0.732 19832
716 1 7 . 1 1 5 5 LEU N N 5 119.569 119.569 121.076 -1.507 19832
717 1 7 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.960 0.226 19832
718 1 7 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.297 -1.079 19832
719 1 7 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.086 -0.006 19832
720 1 7 . 1 1 5 5 LEU H H 5 7.935 7.935 8.431 -0.496 19832
721 1 7 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.967 0.160 19832
722 1 7 . 1 1 6 6 ARG CA C 6 58.711 58.711 58.977 -0.266 19832
723 1 7 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.783 -0.096 19832
724 1 7 . 1 1 6 6 ARG H H 6 8.008 8.008 7.818 0.190 19832
725 1 7 . 1 1 7 7 PHE N N 7 118.637 118.637 117.544 1.093 19832
726 1 7 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.385 0.093 19832
727 1 7 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.821 0.292 19832
728 1 7 . 1 1 7 7 PHE H H 7 7.948 7.948 7.800 0.148 19832
729 1 7 . 1 1 8 8 VAL N N 8 116.441 116.441 121.074 -4.633 19832
730 1 7 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.760 0.133 19832
731 1 7 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.269 -0.304 19832
732 1 7 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.401 0.465 19832
733 1 7 . 1 1 8 8 VAL H H 8 8.014 8.014 8.103 -0.089 19832
734 1 7 . 1 1 9 9 ALA N N 9 121.442 121.442 120.614 0.828 19832
735 1 7 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.147 0.081 19832
736 1 7 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.894 -0.427 19832
737 1 7 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.416 0.063 19832
738 1 7 . 1 1 9 9 ALA H H 9 8.083 8.083 8.552 -0.469 19832
739 1 7 . 1 1 10 10 GLY N N 10 104.589 104.589 105.317 -0.728 19832
740 1 7 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.764 -1.101 19832
741 1 7 . 1 1 10 10 GLY H H 10 8.134 8.134 7.930 0.204 19832
742 1 7 . 1 1 11 11 TYR N N 11 118.591 118.591 123.290 -4.699 19832
743 1 7 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.094 0.229 19832
744 1 7 . 1 1 11 11 TYR H H 11 8.006 8.006 7.618 0.388 19832
745 1 7 . 1 1 12 12 ASP N N 12 119.339 119.339 118.246 1.093 19832
746 1 7 . 1 1 12 12 ASP HA H 12 4.609 4.609 4.107 0.502 19832
747 1 7 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.863 -2.774 19832
748 1 7 . 1 1 12 12 ASP H H 12 8.414 8.414 7.859 0.555 19832
749 1 7 . 1 1 13 13 ILE N N 13 119.097 119.097 118.786 0.311 19832
750 1 7 . 1 1 13 13 ILE HA H 13 3.994 3.994 4.170 -0.176 19832
751 1 7 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.465 1.682 19832
752 1 7 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.194 1.290 19832
753 1 7 . 1 1 13 13 ILE H H 13 8.156 8.156 7.540 0.616 19832
754 1 7 . 1 1 14 14 ALA N N 14 123.581 123.581 122.911 0.670 19832
755 1 7 . 1 1 14 14 ALA HA H 14 4.238 4.238 3.897 0.341 19832
756 1 7 . 1 1 14 14 ALA CA C 14 53.618 53.618 54.877 -1.259 19832
757 1 7 . 1 1 14 14 ALA CB C 14 18.817 18.817 17.833 0.984 19832
758 1 7 . 1 1 14 14 ALA H H 14 8.274 8.274 8.169 0.105 19832
759 1 7 . 1 1 15 15 SER N N 15 112.583 112.583 114.448 -1.865 19832
760 1 7 . 1 1 15 15 SER HA H 15 4.299 4.299 3.914 0.385 19832
761 1 7 . 1 1 15 15 SER CA C 15 59.441 59.441 61.839 -2.398 19832
762 1 7 . 1 1 15 15 SER CB C 15 63.403 63.403 63.030 0.373 19832
763 1 7 . 1 1 15 15 SER H H 15 8.061 8.061 7.855 0.206 19832
764 1 7 . 1 1 16 16 HIS N N 16 120.408 120.408 116.666 3.742 19832
765 1 7 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.557 0.139 19832
766 1 7 . 1 1 16 16 HIS CB C 16 28.483 28.483 29.373 -0.890 19832
767 1 7 . 1 1 16 16 HIS H H 16 8.159 8.159 7.754 0.405 19832
768 1 7 . 1 1 17 17 LYS N N 17 120.845 120.845 120.782 0.063 19832
769 1 7 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.018 0.307 19832
770 1 7 . 1 1 17 17 LYS CA C 17 56.682 56.682 58.537 -1.855 19832
771 1 7 . 1 1 17 17 LYS CB C 17 32.996 32.996 32.880 0.116 19832
772 1 7 . 1 1 17 17 LYS H H 17 8.080 8.080 7.135 0.945 19832
773 1 7 . 1 1 18 18 LYS N N 18 121.661 121.661 117.384 4.277 19832
774 1 7 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.403 -0.070 19832
775 1 7 . 1 1 18 18 LYS CA C 18 56.579 56.579 55.807 0.771 19832
776 1 7 . 1 1 18 18 LYS H H 18 8.231 8.231 7.970 0.261 19832
777 1 7 . 1 1 19 19 LYS N N 19 122.316 122.316 124.532 -2.216 19832
778 1 7 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.134 0.267 19832
779 1 7 . 1 1 19 19 LYS CA C 19 56.600 56.600 57.346 -0.746 19832
780 1 7 . 1 1 19 19 LYS CB C 19 32.973 32.973 32.973 0.000 19832
781 1 7 . 1 1 19 19 LYS H H 19 8.392 8.392 8.531 -0.139 19832
782 1 7 . 1 1 20 20 THR N N 20 113.974 113.974 114.472 -0.498 19832
783 1 7 . 1 1 20 20 THR HA H 20 4.405 4.405 4.370 0.035 19832
784 1 7 . 1 1 20 20 THR CA C 20 61.680 61.680 61.712 -0.032 19832
785 1 7 . 1 1 20 20 THR CB C 20 69.817 69.817 69.338 0.479 19832
786 1 7 . 1 1 20 20 THR H H 20 8.085 8.085 7.574 0.511 19832
787 1 7 . 1 1 21 21 GLY N N 21 110.706 110.706 114.384 -3.678 19832
788 1 7 . 1 1 21 21 GLY CA C 21 45.310 45.310 45.120 0.191 19832
789 1 7 . 1 1 21 21 GLY H H 21 8.360 8.360 8.309 0.051 19832
790 1 7 . 1 1 22 22 GLY N N 22 107.728 107.728 108.202 -0.474 19832
791 1 7 . 1 1 22 22 GLY CA C 22 45.175 45.175 44.753 0.422 19832
792 1 7 . 1 1 22 22 GLY H H 22 8.146 8.146 7.417 0.729 19832
793 1 7 . 1 1 23 23 TYR N N 23 119.224 119.224 119.954 -0.730 19832
794 1 7 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.962 -0.455 19832
795 1 7 . 1 1 23 23 TYR H H 23 7.870 7.870 7.874 -0.004 19832
796 1 7 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.153 0.228 19832
797 1 7 . 1 1 24 24 PRO CA C 24 64.447 64.447 64.815 -0.368 19832
798 1 7 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.178 -0.662 19832
799 1 7 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.887 -0.501 19832
800 1 7 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.237 0.515 19832
801 1 7 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.902 -1.414 19832
802 1 7 . 1 1 25 25 TRP H H 25 6.924 6.924 7.933 -1.009 19832
803 1 7 . 1 1 26 26 GLU N N 26 119.971 119.971 122.119 -2.148 19832
804 1 7 . 1 1 26 26 GLU HA H 26 4.453 4.453 3.965 0.488 19832
805 1 7 . 1 1 26 26 GLU CA C 26 55.645 55.645 55.411 0.234 19832
806 1 7 . 1 1 26 26 GLU CB C 26 28.805 28.805 28.005 0.801 19832
807 1 7 . 1 1 26 26 GLU H H 26 7.653 7.653 7.554 0.099 19832
808 1 7 . 1 1 27 27 ARG N N 27 120.787 120.787 125.013 -4.226 19832
809 1 7 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.340 0.017 19832
810 1 7 . 1 1 27 27 ARG CA C 27 56.406 56.406 56.940 -0.534 19832
811 1 7 . 1 1 27 27 ARG CB C 27 30.763 30.763 31.286 -0.523 19832
812 1 7 . 1 1 27 27 ARG H H 27 8.162 8.162 8.170 -0.008 19832
813 1 7 . 1 1 28 28 GLY N N 28 109.282 109.282 108.139 1.143 19832
814 1 7 . 1 1 28 28 GLY H H 28 8.483 8.483 8.140 0.343 19832
815 1 7 . 1 1 29 29 LYS N N 29 120.396 120.396 121.007 -0.611 19832
816 1 7 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.125 0.278 19832
817 1 7 . 1 1 29 29 LYS CA C 29 55.875 55.875 56.878 -1.003 19832
818 1 7 . 1 1 29 29 LYS CB C 29 33.293 33.293 32.219 1.074 19832
819 1 7 . 1 1 29 29 LYS H H 29 8.112 8.112 8.295 -0.183 19832
820 1 8 . 1 1 2 2 LYS N N 2 124.386 124.386 122.782 1.604 19832
821 1 8 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.672 -0.288 19832
822 1 8 . 1 1 2 2 LYS CB C 2 32.959 32.959 33.296 -0.337 19832
823 1 8 . 1 1 2 2 LYS H H 2 9.052 9.052 8.369 0.683 19832
824 1 8 . 1 1 3 3 THR N N 3 116.039 116.039 119.660 -3.621 19832
825 1 8 . 1 1 3 3 THR HA H 3 4.216 4.216 4.050 0.166 19832
826 1 8 . 1 1 3 3 THR CB C 3 68.928 68.928 68.835 0.093 19832
827 1 8 . 1 1 3 3 THR H H 3 8.478 8.478 8.933 -0.455 19832
828 1 8 . 1 1 4 4 ILE N N 4 121.132 121.132 118.585 2.547 19832
829 1 8 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.947 0.163 19832
830 1 8 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.873 -0.301 19832
831 1 8 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.911 1.043 19832
832 1 8 . 1 1 4 4 ILE H H 4 8.556 8.556 7.902 0.654 19832
833 1 8 . 1 1 5 5 LEU N N 5 119.569 119.569 121.100 -1.531 19832
834 1 8 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.949 0.237 19832
835 1 8 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.287 -1.069 19832
836 1 8 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.071 0.009 19832
837 1 8 . 1 1 5 5 LEU H H 5 7.935 7.935 8.415 -0.480 19832
838 1 8 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.965 0.162 19832
839 1 8 . 1 1 6 6 ARG CA C 6 58.711 58.711 59.062 -0.351 19832
840 1 8 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.837 -0.150 19832
841 1 8 . 1 1 6 6 ARG H H 6 8.008 8.008 7.801 0.207 19832
842 1 8 . 1 1 7 7 PHE N N 7 118.637 118.637 117.307 1.330 19832
843 1 8 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.395 0.083 19832
844 1 8 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.783 0.330 19832
845 1 8 . 1 1 7 7 PHE H H 7 7.948 7.948 7.782 0.166 19832
846 1 8 . 1 1 8 8 VAL N N 8 116.441 116.441 121.018 -4.577 19832
847 1 8 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.732 0.161 19832
848 1 8 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.300 -0.335 19832
849 1 8 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.768 0.097 19832
850 1 8 . 1 1 8 8 VAL H H 8 8.014 8.014 8.068 -0.054 19832
851 1 8 . 1 1 9 9 ALA N N 9 121.442 121.442 120.674 0.768 19832
852 1 8 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.119 0.109 19832
853 1 8 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.937 -0.470 19832
854 1 8 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.174 0.305 19832
855 1 8 . 1 1 9 9 ALA H H 9 8.083 8.083 8.490 -0.407 19832
856 1 8 . 1 1 10 10 GLY N N 10 104.589 104.589 105.057 -0.468 19832
857 1 8 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.939 -1.276 19832
858 1 8 . 1 1 10 10 GLY H H 10 8.134 8.134 8.064 0.070 19832
859 1 8 . 1 1 11 11 TYR N N 11 118.591 118.591 123.627 -5.036 19832
860 1 8 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.182 0.141 19832
861 1 8 . 1 1 11 11 TYR H H 11 8.006 8.006 7.536 0.470 19832
862 1 8 . 1 1 12 12 ASP N N 12 119.339 119.339 117.610 1.729 19832
863 1 8 . 1 1 12 12 ASP HA H 12 4.609 4.609 4.053 0.556 19832
864 1 8 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.624 -2.535 19832
865 1 8 . 1 1 12 12 ASP H H 12 8.414 8.414 7.800 0.615 19832
866 1 8 . 1 1 13 13 ILE N N 13 119.097 119.097 117.722 1.375 19832
867 1 8 . 1 1 13 13 ILE HA H 13 3.994 3.994 3.858 0.136 19832
868 1 8 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.736 1.411 19832
869 1 8 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.357 1.127 19832
870 1 8 . 1 1 13 13 ILE H H 13 8.156 8.156 7.094 1.062 19832
871 1 8 . 1 1 14 14 ALA N N 14 123.581 123.581 123.270 0.311 19832
872 1 8 . 1 1 14 14 ALA HA H 14 4.238 4.238 4.135 0.103 19832
873 1 8 . 1 1 14 14 ALA CA C 14 53.618 53.618 54.917 -1.299 19832
874 1 8 . 1 1 14 14 ALA CB C 14 18.817 18.817 18.180 0.636 19832
875 1 8 . 1 1 14 14 ALA H H 14 8.274 8.274 8.178 0.096 19832
876 1 8 . 1 1 15 15 SER N N 15 112.583 112.583 112.839 -0.256 19832
877 1 8 . 1 1 15 15 SER HA H 15 4.299 4.299 4.017 0.282 19832
878 1 8 . 1 1 15 15 SER CA C 15 59.441 59.441 61.676 -2.236 19832
879 1 8 . 1 1 15 15 SER CB C 15 63.403 63.403 63.101 0.302 19832
880 1 8 . 1 1 15 15 SER H H 15 8.061 8.061 7.989 0.072 19832
881 1 8 . 1 1 16 16 HIS N N 16 120.408 120.408 118.042 2.366 19832
882 1 8 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.552 0.144 19832
883 1 8 . 1 1 16 16 HIS CB C 16 28.483 28.483 30.629 -2.146 19832
884 1 8 . 1 1 16 16 HIS H H 16 8.159 8.159 7.454 0.705 19832
885 1 8 . 1 1 17 17 LYS N N 17 120.845 120.845 120.820 0.025 19832
886 1 8 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.113 0.212 19832
887 1 8 . 1 1 17 17 LYS CA C 17 56.682 56.682 57.874 -1.192 19832
888 1 8 . 1 1 17 17 LYS CB C 17 32.996 32.996 33.026 -0.030 19832
889 1 8 . 1 1 17 17 LYS H H 17 8.080 8.080 7.943 0.137 19832
890 1 8 . 1 1 18 18 LYS N N 18 121.661 121.661 118.536 3.125 19832
891 1 8 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.154 0.179 19832
892 1 8 . 1 1 18 18 LYS CA C 18 56.579 56.579 56.443 0.136 19832
893 1 8 . 1 1 18 18 LYS H H 18 8.231 8.231 7.744 0.487 19832
894 1 8 . 1 1 19 19 LYS N N 19 122.316 122.316 121.162 1.154 19832
895 1 8 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.180 0.221 19832
896 1 8 . 1 1 19 19 LYS CA C 19 56.600 56.600 57.705 -1.105 19832
897 1 8 . 1 1 19 19 LYS CB C 19 32.973 32.973 32.498 0.475 19832
898 1 8 . 1 1 19 19 LYS H H 19 8.392 8.392 8.627 -0.235 19832
899 1 8 . 1 1 20 20 THR N N 20 113.974 113.974 110.496 3.478 19832
900 1 8 . 1 1 20 20 THR HA H 20 4.405 4.405 4.309 0.096 19832
901 1 8 . 1 1 20 20 THR CA C 20 61.680 61.680 60.734 0.946 19832
902 1 8 . 1 1 20 20 THR CB C 20 69.817 69.817 68.863 0.954 19832
903 1 8 . 1 1 20 20 THR H H 20 8.085 8.085 7.383 0.702 19832
904 1 8 . 1 1 21 21 GLY N N 21 110.706 110.706 109.980 0.726 19832
905 1 8 . 1 1 21 21 GLY CA C 21 45.310 45.310 45.572 -0.262 19832
906 1 8 . 1 1 21 21 GLY H H 21 8.360 8.360 8.515 -0.155 19832
907 1 8 . 1 1 22 22 GLY N N 22 107.728 107.728 107.054 0.674 19832
908 1 8 . 1 1 22 22 GLY CA C 22 45.175 45.175 44.708 0.467 19832
909 1 8 . 1 1 22 22 GLY H H 22 8.146 8.146 7.437 0.709 19832
910 1 8 . 1 1 23 23 TYR N N 23 119.224 119.224 125.584 -6.360 19832
911 1 8 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.605 -0.098 19832
912 1 8 . 1 1 23 23 TYR H H 23 7.870 7.870 7.775 0.095 19832
913 1 8 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.427 -0.046 19832
914 1 8 . 1 1 24 24 PRO CA C 24 64.447 64.447 65.026 -0.579 19832
915 1 8 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.187 -0.671 19832
916 1 8 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.953 -0.567 19832
917 1 8 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.300 0.452 19832
918 1 8 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.905 -1.417 19832
919 1 8 . 1 1 25 25 TRP H H 25 6.924 6.924 7.995 -1.071 19832
920 1 8 . 1 1 26 26 GLU N N 26 119.971 119.971 121.994 -2.023 19832
921 1 8 . 1 1 26 26 GLU HA H 26 4.453 4.453 4.055 0.398 19832
922 1 8 . 1 1 26 26 GLU CA C 26 55.645 55.645 55.317 0.328 19832
923 1 8 . 1 1 26 26 GLU CB C 26 28.805 28.805 28.086 0.719 19832
924 1 8 . 1 1 26 26 GLU H H 26 7.653 7.653 7.697 -0.044 19832
925 1 8 . 1 1 27 27 ARG N N 27 120.787 120.787 123.192 -2.405 19832
926 1 8 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.412 -0.055 19832
927 1 8 . 1 1 27 27 ARG CA C 27 56.406 56.406 56.513 -0.107 19832
928 1 8 . 1 1 27 27 ARG CB C 27 30.763 30.763 30.453 0.310 19832
929 1 8 . 1 1 27 27 ARG H H 27 8.162 8.162 7.557 0.605 19832
930 1 8 . 1 1 28 28 GLY N N 28 109.282 109.282 108.616 0.666 19832
931 1 8 . 1 1 28 28 GLY H H 28 8.483 8.483 8.160 0.323 19832
932 1 8 . 1 1 29 29 LYS N N 29 120.396 120.396 123.483 -3.087 19832
933 1 8 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.012 0.391 19832
934 1 8 . 1 1 29 29 LYS CA C 29 55.875 55.875 57.587 -1.712 19832
935 1 8 . 1 1 29 29 LYS CB C 29 33.293 33.293 32.615 0.678 19832
936 1 8 . 1 1 29 29 LYS H H 29 8.112 8.112 8.175 -0.063 19832
937 1 9 . 1 1 2 2 LYS N N 2 124.386 124.386 122.785 1.601 19832
938 1 9 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.645 -0.261 19832
939 1 9 . 1 1 2 2 LYS CB C 2 32.959 32.959 33.883 -0.924 19832
940 1 9 . 1 1 2 2 LYS H H 2 9.052 9.052 8.157 0.895 19832
941 1 9 . 1 1 3 3 THR N N 3 116.039 116.039 119.920 -3.881 19832
942 1 9 . 1 1 3 3 THR HA H 3 4.216 4.216 4.110 0.106 19832
943 1 9 . 1 1 3 3 THR CB C 3 68.928 68.928 68.836 0.092 19832
944 1 9 . 1 1 3 3 THR H H 3 8.478 8.478 8.931 -0.453 19832
945 1 9 . 1 1 4 4 ILE N N 4 121.132 121.132 118.694 2.438 19832
946 1 9 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.964 0.146 19832
947 1 9 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.803 -0.231 19832
948 1 9 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.843 1.111 19832
949 1 9 . 1 1 4 4 ILE H H 4 8.556 8.556 7.863 0.693 19832
950 1 9 . 1 1 5 5 LEU N N 5 119.569 119.569 121.050 -1.481 19832
951 1 9 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.933 0.253 19832
952 1 9 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.299 -1.081 19832
953 1 9 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.065 0.015 19832
954 1 9 . 1 1 5 5 LEU H H 5 7.935 7.935 8.415 -0.480 19832
955 1 9 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.949 0.178 19832
956 1 9 . 1 1 6 6 ARG CA C 6 58.711 58.711 59.010 -0.299 19832
957 1 9 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.845 -0.158 19832
958 1 9 . 1 1 6 6 ARG H H 6 8.008 8.008 7.787 0.221 19832
959 1 9 . 1 1 7 7 PHE N N 7 118.637 118.637 117.165 1.472 19832
960 1 9 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.367 0.111 19832
961 1 9 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.816 0.297 19832
962 1 9 . 1 1 7 7 PHE H H 7 7.948 7.948 7.778 0.170 19832
963 1 9 . 1 1 8 8 VAL N N 8 116.441 116.441 121.010 -4.569 19832
964 1 9 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.728 0.165 19832
965 1 9 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.305 -0.340 19832
966 1 9 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.761 0.104 19832
967 1 9 . 1 1 8 8 VAL H H 8 8.014 8.014 8.064 -0.050 19832
968 1 9 . 1 1 9 9 ALA N N 9 121.442 121.442 120.657 0.785 19832
969 1 9 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.106 0.122 19832
970 1 9 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.921 -0.454 19832
971 1 9 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.173 0.306 19832
972 1 9 . 1 1 9 9 ALA H H 9 8.083 8.083 8.476 -0.393 19832
973 1 9 . 1 1 10 10 GLY N N 10 104.589 104.589 105.363 -0.774 19832
974 1 9 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.820 -1.157 19832
975 1 9 . 1 1 10 10 GLY H H 10 8.134 8.134 7.918 0.216 19832
976 1 9 . 1 1 11 11 TYR N N 11 118.591 118.591 123.331 -4.740 19832
977 1 9 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.107 0.216 19832
978 1 9 . 1 1 11 11 TYR H H 11 8.006 8.006 7.624 0.382 19832
979 1 9 . 1 1 12 12 ASP N N 12 119.339 119.339 118.046 1.293 19832
980 1 9 . 1 1 12 12 ASP HA H 12 4.609 4.609 4.016 0.593 19832
981 1 9 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.715 -2.626 19832
982 1 9 . 1 1 12 12 ASP H H 12 8.414 8.414 7.840 0.574 19832
983 1 9 . 1 1 13 13 ILE N N 13 119.097 119.097 118.585 0.512 19832
984 1 9 . 1 1 13 13 ILE HA H 13 3.994 3.994 3.897 0.097 19832
985 1 9 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.183 1.964 19832
986 1 9 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.170 1.314 19832
987 1 9 . 1 1 13 13 ILE H H 13 8.156 8.156 7.469 0.687 19832
988 1 9 . 1 1 14 14 ALA N N 14 123.581 123.581 123.825 -0.244 19832
989 1 9 . 1 1 14 14 ALA HA H 14 4.238 4.238 4.087 0.151 19832
990 1 9 . 1 1 14 14 ALA CA C 14 53.618 53.618 55.291 -1.673 19832
991 1 9 . 1 1 14 14 ALA CB C 14 18.817 18.817 18.074 0.743 19832
992 1 9 . 1 1 14 14 ALA H H 14 8.274 8.274 8.436 -0.162 19832
993 1 9 . 1 1 15 15 SER N N 15 112.583 112.583 113.989 -1.406 19832
994 1 9 . 1 1 15 15 SER HA H 15 4.299 4.299 4.015 0.284 19832
995 1 9 . 1 1 15 15 SER CA C 15 59.441 59.441 62.461 -3.019 19832
996 1 9 . 1 1 15 15 SER CB C 15 63.403 63.403 62.925 0.478 19832
997 1 9 . 1 1 15 15 SER H H 15 8.061 8.061 8.016 0.045 19832
998 1 9 . 1 1 16 16 HIS N N 16 120.408 120.408 117.837 2.571 19832
999 1 9 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.514 0.182 19832
1000 1 9 . 1 1 16 16 HIS CB C 16 28.483 28.483 30.168 -1.685 19832
1001 1 9 . 1 1 16 16 HIS H H 16 8.159 8.159 7.499 0.660 19832
1002 1 9 . 1 1 17 17 LYS N N 17 120.845 120.845 120.330 0.515 19832
1003 1 9 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.100 0.225 19832
1004 1 9 . 1 1 17 17 LYS CA C 17 56.682 56.682 58.666 -1.984 19832
1005 1 9 . 1 1 17 17 LYS CB C 17 32.996 32.996 33.153 -0.157 19832
1006 1 9 . 1 1 17 17 LYS H H 17 8.080 8.080 7.739 0.341 19832
1007 1 9 . 1 1 18 18 LYS N N 18 121.661 121.661 119.943 1.718 19832
1008 1 9 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.411 -0.078 19832
1009 1 9 . 1 1 18 18 LYS CA C 18 56.579 56.579 55.756 0.823 19832
1010 1 9 . 1 1 18 18 LYS H H 18 8.231 8.231 7.962 0.269 19832
1011 1 9 . 1 1 19 19 LYS N N 19 122.316 122.316 123.220 -0.904 19832
1012 1 9 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.244 0.157 19832
1013 1 9 . 1 1 19 19 LYS CA C 19 56.600 56.600 56.956 -0.356 19832
1014 1 9 . 1 1 19 19 LYS CB C 19 32.973 32.973 33.252 -0.279 19832
1015 1 9 . 1 1 19 19 LYS H H 19 8.392 8.392 8.656 -0.264 19832
1016 1 9 . 1 1 20 20 THR N N 20 113.974 113.974 114.076 -0.102 19832
1017 1 9 . 1 1 20 20 THR HA H 20 4.405 4.405 4.451 -0.046 19832
1018 1 9 . 1 1 20 20 THR CA C 20 61.680 61.680 62.213 -0.533 19832
1019 1 9 . 1 1 20 20 THR CB C 20 69.817 69.817 69.807 0.010 19832
1020 1 9 . 1 1 20 20 THR H H 20 8.085 8.085 7.532 0.553 19832
1021 1 9 . 1 1 21 21 GLY N N 21 110.706 110.706 113.513 -2.807 19832
1022 1 9 . 1 1 21 21 GLY CA C 21 45.310 45.310 45.475 -0.165 19832
1023 1 9 . 1 1 21 21 GLY H H 21 8.360 8.360 8.342 0.018 19832
1024 1 9 . 1 1 22 22 GLY N N 22 107.728 107.728 111.178 -3.450 19832
1025 1 9 . 1 1 22 22 GLY CA C 22 45.175 45.175 45.345 -0.170 19832
1026 1 9 . 1 1 22 22 GLY H H 22 8.146 8.146 7.690 0.456 19832
1027 1 9 . 1 1 23 23 TYR N N 23 119.224 119.224 122.929 -3.705 19832
1028 1 9 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.944 -0.437 19832
1029 1 9 . 1 1 23 23 TYR H H 23 7.870 7.870 7.886 -0.016 19832
1030 1 9 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.396 -0.015 19832
1031 1 9 . 1 1 24 24 PRO CA C 24 64.447 64.447 65.146 -0.699 19832
1032 1 9 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.268 -0.752 19832
1033 1 9 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.797 -0.411 19832
1034 1 9 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.310 0.442 19832
1035 1 9 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.964 -1.476 19832
1036 1 9 . 1 1 25 25 TRP H H 25 6.924 6.924 7.862 -0.938 19832
1037 1 9 . 1 1 26 26 GLU N N 26 119.971 119.971 122.413 -2.442 19832
1038 1 9 . 1 1 26 26 GLU HA H 26 4.453 4.453 3.920 0.533 19832
1039 1 9 . 1 1 26 26 GLU CA C 26 55.645 55.645 55.455 0.190 19832
1040 1 9 . 1 1 26 26 GLU CB C 26 28.805 28.805 27.972 0.833 19832
1041 1 9 . 1 1 26 26 GLU H H 26 7.653 7.653 7.458 0.195 19832
1042 1 9 . 1 1 27 27 ARG N N 27 120.787 120.787 124.893 -4.106 19832
1043 1 9 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.472 -0.115 19832
1044 1 9 . 1 1 27 27 ARG CA C 27 56.406 56.406 56.028 0.378 19832
1045 1 9 . 1 1 27 27 ARG CB C 27 30.763 30.763 31.207 -0.444 19832
1046 1 9 . 1 1 27 27 ARG H H 27 8.162 8.162 7.717 0.445 19832
1047 1 9 . 1 1 28 28 GLY N N 28 109.282 109.282 111.940 -2.658 19832
1048 1 9 . 1 1 28 28 GLY H H 28 8.483 8.483 7.961 0.522 19832
1049 1 9 . 1 1 29 29 LYS N N 29 120.396 120.396 119.982 0.414 19832
1050 1 9 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.698 -0.295 19832
1051 1 9 . 1 1 29 29 LYS CA C 29 55.875 55.875 58.058 -2.183 19832
1052 1 9 . 1 1 29 29 LYS CB C 29 33.293 33.293 33.008 0.285 19832
1053 1 9 . 1 1 29 29 LYS H H 29 8.112 8.112 9.068 -0.956 19832
1054 1 10 . 1 1 2 2 LYS N N 2 124.386 124.386 122.428 1.958 19832
1055 1 10 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.647 -0.263 19832
1056 1 10 . 1 1 2 2 LYS CB C 2 32.959 32.959 34.032 -1.073 19832
1057 1 10 . 1 1 2 2 LYS H H 2 9.052 9.052 8.275 0.777 19832
1058 1 10 . 1 1 3 3 THR N N 3 116.039 116.039 119.816 -3.777 19832
1059 1 10 . 1 1 3 3 THR HA H 3 4.216 4.216 4.070 0.146 19832
1060 1 10 . 1 1 3 3 THR CB C 3 68.928 68.928 68.833 0.095 19832
1061 1 10 . 1 1 3 3 THR H H 3 8.478 8.478 8.837 -0.359 19832
1062 1 10 . 1 1 4 4 ILE N N 4 121.132 121.132 118.624 2.508 19832
1063 1 10 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.948 0.162 19832
1064 1 10 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.870 -0.298 19832
1065 1 10 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.900 1.054 19832
1066 1 10 . 1 1 4 4 ILE H H 4 8.556 8.556 7.902 0.654 19832
1067 1 10 . 1 1 5 5 LEU N N 5 119.569 119.569 121.062 -1.493 19832
1068 1 10 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.935 0.251 19832
1069 1 10 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.295 -1.077 19832
1070 1 10 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.081 -0.001 19832
1071 1 10 . 1 1 5 5 LEU H H 5 7.935 7.935 8.435 -0.500 19832
1072 1 10 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.959 0.168 19832
1073 1 10 . 1 1 6 6 ARG CA C 6 58.711 58.711 59.059 -0.348 19832
1074 1 10 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.779 -0.092 19832
1075 1 10 . 1 1 6 6 ARG H H 6 8.008 8.008 7.807 0.201 19832
1076 1 10 . 1 1 7 7 PHE N N 7 118.637 118.637 117.401 1.236 19832
1077 1 10 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.346 0.132 19832
1078 1 10 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.956 0.157 19832
1079 1 10 . 1 1 7 7 PHE H H 7 7.948 7.948 7.778 0.170 19832
1080 1 10 . 1 1 8 8 VAL N N 8 116.441 116.441 120.772 -4.331 19832
1081 1 10 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.667 0.226 19832
1082 1 10 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.639 -0.674 19832
1083 1 10 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.843 0.022 19832
1084 1 10 . 1 1 8 8 VAL H H 8 8.014 8.014 8.101 -0.087 19832
1085 1 10 . 1 1 9 9 ALA N N 9 121.442 121.442 120.626 0.816 19832
1086 1 10 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.110 0.118 19832
1087 1 10 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.837 -0.370 19832
1088 1 10 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.233 0.246 19832
1089 1 10 . 1 1 9 9 ALA H H 9 8.083 8.083 8.519 -0.436 19832
1090 1 10 . 1 1 10 10 GLY N N 10 104.589 104.589 105.044 -0.455 19832
1091 1 10 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.929 -1.266 19832
1092 1 10 . 1 1 10 10 GLY H H 10 8.134 8.134 8.052 0.082 19832
1093 1 10 . 1 1 11 11 TYR N N 11 118.591 118.591 123.747 -5.156 19832
1094 1 10 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.122 0.201 19832
1095 1 10 . 1 1 11 11 TYR H H 11 8.006 8.006 7.537 0.469 19832
1096 1 10 . 1 1 12 12 ASP N N 12 119.339 119.339 118.076 1.263 19832
1097 1 10 . 1 1 12 12 ASP HA H 12 4.609 4.609 4.124 0.485 19832
1098 1 10 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.541 -2.452 19832
1099 1 10 . 1 1 12 12 ASP H H 12 8.414 8.414 7.866 0.548 19832
1100 1 10 . 1 1 13 13 ILE N N 13 119.097 119.097 118.547 0.550 19832
1101 1 10 . 1 1 13 13 ILE HA H 13 3.994 3.994 4.264 -0.270 19832
1102 1 10 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.468 1.679 19832
1103 1 10 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.365 1.119 19832
1104 1 10 . 1 1 13 13 ILE H H 13 8.156 8.156 7.384 0.772 19832
1105 1 10 . 1 1 14 14 ALA N N 14 123.581 123.581 122.811 0.770 19832
1106 1 10 . 1 1 14 14 ALA HA H 14 4.238 4.238 3.958 0.280 19832
1107 1 10 . 1 1 14 14 ALA CA C 14 53.618 53.618 54.740 -1.122 19832
1108 1 10 . 1 1 14 14 ALA CB C 14 18.817 18.817 18.022 0.795 19832
1109 1 10 . 1 1 14 14 ALA H H 14 8.274 8.274 8.112 0.162 19832
1110 1 10 . 1 1 15 15 SER N N 15 112.583 112.583 113.553 -0.970 19832
1111 1 10 . 1 1 15 15 SER HA H 15 4.299 4.299 4.094 0.205 19832
1112 1 10 . 1 1 15 15 SER CA C 15 59.441 59.441 61.104 -1.663 19832
1113 1 10 . 1 1 15 15 SER CB C 15 63.403 63.403 63.292 0.111 19832
1114 1 10 . 1 1 15 15 SER H H 15 8.061 8.061 7.890 0.171 19832
1115 1 10 . 1 1 16 16 HIS N N 16 120.408 120.408 116.320 4.088 19832
1116 1 10 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.667 0.029 19832
1117 1 10 . 1 1 16 16 HIS CB C 16 28.483 28.483 29.791 -1.308 19832
1118 1 10 . 1 1 16 16 HIS H H 16 8.159 8.159 7.415 0.744 19832
1119 1 10 . 1 1 17 17 LYS N N 17 120.845 120.845 120.698 0.147 19832
1120 1 10 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.008 0.317 19832
1121 1 10 . 1 1 17 17 LYS CA C 17 56.682 56.682 58.359 -1.677 19832
1122 1 10 . 1 1 17 17 LYS CB C 17 32.996 32.996 32.844 0.152 19832
1123 1 10 . 1 1 17 17 LYS H H 17 8.080 8.080 7.396 0.684 19832
1124 1 10 . 1 1 18 18 LYS N N 18 121.661 121.661 117.473 4.188 19832
1125 1 10 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.364 -0.031 19832
1126 1 10 . 1 1 18 18 LYS CA C 18 56.579 56.579 56.001 0.578 19832
1127 1 10 . 1 1 18 18 LYS H H 18 8.231 8.231 7.358 0.873 19832
1128 1 10 . 1 1 19 19 LYS N N 19 122.316 122.316 123.112 -0.796 19832
1129 1 10 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.428 -0.027 19832
1130 1 10 . 1 1 19 19 LYS CA C 19 56.600 56.600 57.304 -0.704 19832
1131 1 10 . 1 1 19 19 LYS CB C 19 32.973 32.973 32.934 0.039 19832
1132 1 10 . 1 1 19 19 LYS H H 19 8.392 8.392 8.639 -0.247 19832
1133 1 10 . 1 1 20 20 THR N N 20 113.974 113.974 112.396 1.578 19832
1134 1 10 . 1 1 20 20 THR HA H 20 4.405 4.405 4.521 -0.116 19832
1135 1 10 . 1 1 20 20 THR CA C 20 61.680 61.680 60.781 0.899 19832
1136 1 10 . 1 1 20 20 THR CB C 20 69.817 69.817 68.170 1.647 19832
1137 1 10 . 1 1 20 20 THR H H 20 8.085 8.085 7.850 0.235 19832
1138 1 10 . 1 1 21 21 GLY N N 21 110.706 110.706 111.197 -0.491 19832
1139 1 10 . 1 1 21 21 GLY CA C 21 45.310 45.310 44.585 0.725 19832
1140 1 10 . 1 1 21 21 GLY H H 21 8.360 8.360 7.542 0.818 19832
1141 1 10 . 1 1 22 22 GLY N N 22 107.728 107.728 111.365 -3.637 19832
1142 1 10 . 1 1 22 22 GLY CA C 22 45.175 45.175 44.605 0.570 19832
1143 1 10 . 1 1 22 22 GLY H H 22 8.146 8.146 7.618 0.528 19832
1144 1 10 . 1 1 23 23 TYR N N 23 119.224 119.224 124.696 -5.472 19832
1145 1 10 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.783 -0.276 19832
1146 1 10 . 1 1 23 23 TYR H H 23 7.870 7.870 7.838 0.032 19832
1147 1 10 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.460 -0.079 19832
1148 1 10 . 1 1 24 24 PRO CA C 24 64.447 64.447 65.016 -0.569 19832
1149 1 10 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.291 -0.775 19832
1150 1 10 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.949 -0.563 19832
1151 1 10 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.299 0.453 19832
1152 1 10 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.889 -1.401 19832
1153 1 10 . 1 1 25 25 TRP H H 25 6.924 6.924 7.990 -1.066 19832
1154 1 10 . 1 1 26 26 GLU N N 26 119.971 119.971 122.304 -2.333 19832
1155 1 10 . 1 1 26 26 GLU HA H 26 4.453 4.453 3.938 0.515 19832
1156 1 10 . 1 1 26 26 GLU CA C 26 55.645 55.645 55.452 0.194 19832
1157 1 10 . 1 1 26 26 GLU CB C 26 28.805 28.805 28.035 0.770 19832
1158 1 10 . 1 1 26 26 GLU H H 26 7.653 7.653 7.478 0.175 19832
1159 1 10 . 1 1 27 27 ARG N N 27 120.787 120.787 123.530 -2.743 19832
1160 1 10 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.543 -0.186 19832
1161 1 10 . 1 1 27 27 ARG CA C 27 56.406 56.406 55.199 1.207 19832
1162 1 10 . 1 1 27 27 ARG CB C 27 30.763 30.763 30.402 0.360 19832
1163 1 10 . 1 1 27 27 ARG H H 27 8.162 8.162 8.054 0.108 19832
1164 1 10 . 1 1 28 28 GLY N N 28 109.282 109.282 113.629 -4.347 19832
1165 1 10 . 1 1 28 28 GLY H H 28 8.483 8.483 8.230 0.253 19832
1166 1 10 . 1 1 29 29 LYS N N 29 120.396 120.396 120.415 -0.019 19832
1167 1 10 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.204 0.199 19832
1168 1 10 . 1 1 29 29 LYS CA C 29 55.875 55.875 56.971 -1.096 19832
1169 1 10 . 1 1 29 29 LYS CB C 29 33.293 33.293 32.895 0.398 19832
1170 1 10 . 1 1 29 29 LYS H H 29 8.112 8.112 8.124 -0.012 19832
1171 1 11 . 1 1 2 2 LYS N N 2 124.386 124.386 125.998 -1.612 19832
1172 1 11 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.301 0.083 19832
1173 1 11 . 1 1 2 2 LYS CB C 2 32.959 32.959 32.594 0.365 19832
1174 1 11 . 1 1 2 2 LYS H H 2 9.052 9.052 8.601 0.451 19832
1175 1 11 . 1 1 3 3 THR N N 3 116.039 116.039 119.795 -3.756 19832
1176 1 11 . 1 1 3 3 THR HA H 3 4.216 4.216 4.096 0.120 19832
1177 1 11 . 1 1 3 3 THR CB C 3 68.928 68.928 68.658 0.270 19832
1178 1 11 . 1 1 3 3 THR H H 3 8.478 8.478 8.697 -0.219 19832
1179 1 11 . 1 1 4 4 ILE N N 4 121.132 121.132 118.409 2.723 19832
1180 1 11 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.969 0.141 19832
1181 1 11 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.830 -0.258 19832
1182 1 11 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.849 1.105 19832
1183 1 11 . 1 1 4 4 ILE H H 4 8.556 8.556 7.840 0.716 19832
1184 1 11 . 1 1 5 5 LEU N N 5 119.569 119.569 121.053 -1.484 19832
1185 1 11 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.942 0.243 19832
1186 1 11 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.309 -1.091 19832
1187 1 11 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.066 0.014 19832
1188 1 11 . 1 1 5 5 LEU H H 5 7.935 7.935 8.422 -0.487 19832
1189 1 11 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.958 0.169 19832
1190 1 11 . 1 1 6 6 ARG CA C 6 58.711 58.711 59.027 -0.316 19832
1191 1 11 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.857 -0.170 19832
1192 1 11 . 1 1 6 6 ARG H H 6 8.008 8.008 7.793 0.215 19832
1193 1 11 . 1 1 7 7 PHE N N 7 118.637 118.637 117.567 1.070 19832
1194 1 11 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.370 0.108 19832
1195 1 11 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.937 0.176 19832
1196 1 11 . 1 1 7 7 PHE H H 7 7.948 7.948 7.776 0.172 19832
1197 1 11 . 1 1 8 8 VAL N N 8 116.441 116.441 120.780 -4.339 19832
1198 1 11 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.680 0.213 19832
1199 1 11 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.651 -0.686 19832
1200 1 11 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.843 0.022 19832
1201 1 11 . 1 1 8 8 VAL H H 8 8.014 8.014 8.107 -0.093 19832
1202 1 11 . 1 1 9 9 ALA N N 9 121.442 121.442 120.656 0.786 19832
1203 1 11 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.102 0.126 19832
1204 1 11 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.861 -0.394 19832
1205 1 11 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.217 0.262 19832
1206 1 11 . 1 1 9 9 ALA H H 9 8.083 8.083 8.530 -0.447 19832
1207 1 11 . 1 1 10 10 GLY N N 10 104.589 104.589 105.589 -1.000 19832
1208 1 11 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.993 -1.330 19832
1209 1 11 . 1 1 10 10 GLY H H 10 8.134 8.134 8.024 0.110 19832
1210 1 11 . 1 1 11 11 TYR N N 11 118.591 118.591 123.720 -5.129 19832
1211 1 11 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.185 0.138 19832
1212 1 11 . 1 1 11 11 TYR H H 11 8.006 8.006 7.416 0.590 19832
1213 1 11 . 1 1 12 12 ASP N N 12 119.339 119.339 118.346 0.993 19832
1214 1 11 . 1 1 12 12 ASP HA H 12 4.609 4.609 4.126 0.483 19832
1215 1 11 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.664 -2.575 19832
1216 1 11 . 1 1 12 12 ASP H H 12 8.414 8.414 7.836 0.578 19832
1217 1 11 . 1 1 13 13 ILE N N 13 119.097 119.097 118.467 0.630 19832
1218 1 11 . 1 1 13 13 ILE HA H 13 3.994 3.994 4.012 -0.018 19832
1219 1 11 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.176 1.971 19832
1220 1 11 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.318 1.166 19832
1221 1 11 . 1 1 13 13 ILE H H 13 8.156 8.156 7.541 0.615 19832
1222 1 11 . 1 1 14 14 ALA N N 14 123.581 123.581 123.644 -0.063 19832
1223 1 11 . 1 1 14 14 ALA HA H 14 4.238 4.238 4.138 0.100 19832
1224 1 11 . 1 1 14 14 ALA CA C 14 53.618 53.618 55.166 -1.548 19832
1225 1 11 . 1 1 14 14 ALA CB C 14 18.817 18.817 18.001 0.816 19832
1226 1 11 . 1 1 14 14 ALA H H 14 8.274 8.274 8.381 -0.107 19832
1227 1 11 . 1 1 15 15 SER N N 15 112.583 112.583 112.884 -0.301 19832
1228 1 11 . 1 1 15 15 SER HA H 15 4.299 4.299 4.091 0.208 19832
1229 1 11 . 1 1 15 15 SER CA C 15 59.441 59.441 61.672 -2.231 19832
1230 1 11 . 1 1 15 15 SER CB C 15 63.403 63.403 62.871 0.532 19832
1231 1 11 . 1 1 15 15 SER H H 15 8.061 8.061 7.826 0.235 19832
1232 1 11 . 1 1 16 16 HIS N N 16 120.408 120.408 117.400 3.008 19832
1233 1 11 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.595 0.101 19832
1234 1 11 . 1 1 16 16 HIS CB C 16 28.483 28.483 30.731 -2.248 19832
1235 1 11 . 1 1 16 16 HIS H H 16 8.159 8.159 7.601 0.557 19832
1236 1 11 . 1 1 17 17 LYS N N 17 120.845 120.845 120.521 0.324 19832
1237 1 11 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.135 0.190 19832
1238 1 11 . 1 1 17 17 LYS CA C 17 56.682 56.682 57.811 -1.129 19832
1239 1 11 . 1 1 17 17 LYS CB C 17 32.996 32.996 33.112 -0.117 19832
1240 1 11 . 1 1 17 17 LYS H H 17 8.080 8.080 7.628 0.452 19832
1241 1 11 . 1 1 18 18 LYS N N 18 121.661 121.661 116.158 5.503 19832
1242 1 11 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.474 -0.141 19832
1243 1 11 . 1 1 18 18 LYS CA C 18 56.579 56.579 56.152 0.427 19832
1244 1 11 . 1 1 18 18 LYS H H 18 8.231 8.231 7.859 0.372 19832
1245 1 11 . 1 1 19 19 LYS N N 19 122.316 122.316 123.973 -1.657 19832
1246 1 11 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.365 0.036 19832
1247 1 11 . 1 1 19 19 LYS CA C 19 56.600 56.600 56.982 -0.382 19832
1248 1 11 . 1 1 19 19 LYS CB C 19 32.973 32.973 33.083 -0.110 19832
1249 1 11 . 1 1 19 19 LYS H H 19 8.392 8.392 8.649 -0.257 19832
1250 1 11 . 1 1 20 20 THR N N 20 113.974 113.974 112.242 1.732 19832
1251 1 11 . 1 1 20 20 THR HA H 20 4.405 4.405 4.576 -0.171 19832
1252 1 11 . 1 1 20 20 THR CA C 20 61.680 61.680 60.978 0.702 19832
1253 1 11 . 1 1 20 20 THR CB C 20 69.817 69.817 68.604 1.213 19832
1254 1 11 . 1 1 20 20 THR H H 20 8.085 8.085 7.642 0.443 19832
1255 1 11 . 1 1 21 21 GLY N N 21 110.706 110.706 110.581 0.125 19832
1256 1 11 . 1 1 21 21 GLY CA C 21 45.310 45.310 44.323 0.987 19832
1257 1 11 . 1 1 21 21 GLY H H 21 8.360 8.360 8.747 -0.387 19832
1258 1 11 . 1 1 22 22 GLY N N 22 107.728 107.728 107.876 -0.148 19832
1259 1 11 . 1 1 22 22 GLY CA C 22 45.175 45.175 45.282 -0.107 19832
1260 1 11 . 1 1 22 22 GLY H H 22 8.146 8.146 7.700 0.446 19832
1261 1 11 . 1 1 23 23 TYR N N 23 119.224 119.224 120.523 -1.299 19832
1262 1 11 . 1 1 23 23 TYR HA H 23 4.507 4.507 5.035 -0.528 19832
1263 1 11 . 1 1 23 23 TYR H H 23 7.870 7.870 7.780 0.090 19832
1264 1 11 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.510 -0.129 19832
1265 1 11 . 1 1 24 24 PRO CA C 24 64.447 64.447 64.946 -0.499 19832
1266 1 11 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.384 -0.868 19832
1267 1 11 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.952 -0.566 19832
1268 1 11 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.298 0.454 19832
1269 1 11 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.893 -1.405 19832
1270 1 11 . 1 1 25 25 TRP H H 25 6.924 6.924 7.993 -1.069 19832
1271 1 11 . 1 1 26 26 GLU N N 26 119.971 119.971 122.029 -2.058 19832
1272 1 11 . 1 1 26 26 GLU HA H 26 4.453 4.453 3.984 0.469 19832
1273 1 11 . 1 1 26 26 GLU CA C 26 55.645 55.645 54.951 0.694 19832
1274 1 11 . 1 1 26 26 GLU CB C 26 28.805 28.805 27.986 0.819 19832
1275 1 11 . 1 1 26 26 GLU H H 26 7.653 7.653 7.550 0.103 19832
1276 1 11 . 1 1 27 27 ARG N N 27 120.787 120.787 124.549 -3.762 19832
1277 1 11 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.154 0.203 19832
1278 1 11 . 1 1 27 27 ARG CA C 27 56.406 56.406 56.795 -0.389 19832
1279 1 11 . 1 1 27 27 ARG CB C 27 30.763 30.763 30.870 -0.107 19832
1280 1 11 . 1 1 27 27 ARG H H 27 8.162 8.162 7.966 0.196 19832
1281 1 11 . 1 1 28 28 GLY N N 28 109.282 109.282 106.242 3.040 19832
1282 1 11 . 1 1 28 28 GLY H H 28 8.483 8.483 7.757 0.726 19832
1283 1 11 . 1 1 29 29 LYS N N 29 120.396 120.396 120.772 -0.376 19832
1284 1 11 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.539 -0.136 19832
1285 1 11 . 1 1 29 29 LYS CA C 29 55.875 55.875 56.364 -0.489 19832
1286 1 11 . 1 1 29 29 LYS CB C 29 33.293 33.293 33.207 0.086 19832
1287 1 11 . 1 1 29 29 LYS H H 29 8.112 8.112 8.500 -0.388 19832
1288 1 12 . 1 1 2 2 LYS N N 2 124.386 124.386 123.601 0.785 19832
1289 1 12 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.701 -0.317 19832
1290 1 12 . 1 1 2 2 LYS CB C 2 32.959 32.959 33.382 -0.423 19832
1291 1 12 . 1 1 2 2 LYS H H 2 9.052 9.052 8.627 0.425 19832
1292 1 12 . 1 1 3 3 THR N N 3 116.039 116.039 119.478 -3.439 19832
1293 1 12 . 1 1 3 3 THR HA H 3 4.216 4.216 4.034 0.182 19832
1294 1 12 . 1 1 3 3 THR CB C 3 68.928 68.928 68.844 0.084 19832
1295 1 12 . 1 1 3 3 THR H H 3 8.478 8.478 8.908 -0.430 19832
1296 1 12 . 1 1 4 4 ILE N N 4 121.132 121.132 118.421 2.711 19832
1297 1 12 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.943 0.167 19832
1298 1 12 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.861 -0.289 19832
1299 1 12 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.938 1.016 19832
1300 1 12 . 1 1 4 4 ILE H H 4 8.556 8.556 7.893 0.663 19832
1301 1 12 . 1 1 5 5 LEU N N 5 119.569 119.569 121.076 -1.507 19832
1302 1 12 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.945 0.241 19832
1303 1 12 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.299 -1.081 19832
1304 1 12 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.068 0.012 19832
1305 1 12 . 1 1 5 5 LEU H H 5 7.935 7.935 8.416 -0.481 19832
1306 1 12 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.957 0.170 19832
1307 1 12 . 1 1 6 6 ARG CA C 6 58.711 58.711 59.054 -0.343 19832
1308 1 12 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.857 -0.170 19832
1309 1 12 . 1 1 6 6 ARG H H 6 8.008 8.008 7.791 0.217 19832
1310 1 12 . 1 1 7 7 PHE N N 7 118.637 118.637 117.637 1.000 19832
1311 1 12 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.377 0.101 19832
1312 1 12 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.922 0.191 19832
1313 1 12 . 1 1 7 7 PHE H H 7 7.948 7.948 7.769 0.179 19832
1314 1 12 . 1 1 8 8 VAL N N 8 116.441 116.441 120.768 -4.327 19832
1315 1 12 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.674 0.219 19832
1316 1 12 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.638 -0.673 19832
1317 1 12 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.842 0.023 19832
1318 1 12 . 1 1 8 8 VAL H H 8 8.014 8.014 8.098 -0.084 19832
1319 1 12 . 1 1 9 9 ALA N N 9 121.442 121.442 120.640 0.802 19832
1320 1 12 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.098 0.130 19832
1321 1 12 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.824 -0.357 19832
1322 1 12 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.229 0.250 19832
1323 1 12 . 1 1 9 9 ALA H H 9 8.083 8.083 8.512 -0.429 19832
1324 1 12 . 1 1 10 10 GLY N N 10 104.589 104.589 105.344 -0.755 19832
1325 1 12 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.930 -1.267 19832
1326 1 12 . 1 1 10 10 GLY H H 10 8.134 8.134 8.023 0.111 19832
1327 1 12 . 1 1 11 11 TYR N N 11 118.591 118.591 123.716 -5.125 19832
1328 1 12 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.178 0.145 19832
1329 1 12 . 1 1 11 11 TYR H H 11 8.006 8.006 7.462 0.544 19832
1330 1 12 . 1 1 12 12 ASP N N 12 119.339 119.339 117.117 2.222 19832
1331 1 12 . 1 1 12 12 ASP HA H 12 4.609 4.609 4.119 0.490 19832
1332 1 12 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.708 -2.619 19832
1333 1 12 . 1 1 12 12 ASP H H 12 8.414 8.414 7.799 0.615 19832
1334 1 12 . 1 1 13 13 ILE N N 13 119.097 119.097 118.120 0.977 19832
1335 1 12 . 1 1 13 13 ILE HA H 13 3.994 3.994 3.988 0.006 19832
1336 1 12 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.793 1.354 19832
1337 1 12 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.469 1.015 19832
1338 1 12 . 1 1 13 13 ILE H H 13 8.156 8.156 7.489 0.667 19832
1339 1 12 . 1 1 14 14 ALA N N 14 123.581 123.581 123.704 -0.123 19832
1340 1 12 . 1 1 14 14 ALA HA H 14 4.238 4.238 4.148 0.090 19832
1341 1 12 . 1 1 14 14 ALA CA C 14 53.618 53.618 55.099 -1.481 19832
1342 1 12 . 1 1 14 14 ALA CB C 14 18.817 18.817 18.121 0.696 19832
1343 1 12 . 1 1 14 14 ALA H H 14 8.274 8.274 8.325 -0.051 19832
1344 1 12 . 1 1 15 15 SER N N 15 112.583 112.583 112.777 -0.194 19832
1345 1 12 . 1 1 15 15 SER HA H 15 4.299 4.299 4.130 0.169 19832
1346 1 12 . 1 1 15 15 SER CA C 15 59.441 59.441 61.532 -2.091 19832
1347 1 12 . 1 1 15 15 SER CB C 15 63.403 63.403 63.100 0.303 19832
1348 1 12 . 1 1 15 15 SER H H 15 8.061 8.061 7.831 0.230 19832
1349 1 12 . 1 1 16 16 HIS N N 16 120.408 120.408 117.148 3.260 19832
1350 1 12 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.624 0.072 19832
1351 1 12 . 1 1 16 16 HIS CB C 16 28.483 28.483 30.884 -2.401 19832
1352 1 12 . 1 1 16 16 HIS H H 16 8.159 8.159 7.644 0.515 19832
1353 1 12 . 1 1 17 17 LYS N N 17 120.845 120.845 119.948 0.897 19832
1354 1 12 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.169 0.156 19832
1355 1 12 . 1 1 17 17 LYS CA C 17 56.682 56.682 58.024 -1.342 19832
1356 1 12 . 1 1 17 17 LYS CB C 17 32.996 32.996 32.967 0.029 19832
1357 1 12 . 1 1 17 17 LYS H H 17 8.080 8.080 7.983 0.097 19832
1358 1 12 . 1 1 18 18 LYS N N 18 121.661 121.661 119.675 1.986 19832
1359 1 12 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.354 -0.021 19832
1360 1 12 . 1 1 18 18 LYS CA C 18 56.579 56.579 55.908 0.671 19832
1361 1 12 . 1 1 18 18 LYS H H 18 8.231 8.231 7.791 0.440 19832
1362 1 12 . 1 1 19 19 LYS N N 19 122.316 122.316 123.575 -1.259 19832
1363 1 12 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.385 0.016 19832
1364 1 12 . 1 1 19 19 LYS CA C 19 56.600 56.600 56.631 -0.031 19832
1365 1 12 . 1 1 19 19 LYS CB C 19 32.973 32.973 33.417 -0.444 19832
1366 1 12 . 1 1 19 19 LYS H H 19 8.392 8.392 8.633 -0.241 19832
1367 1 12 . 1 1 20 20 THR N N 20 113.974 113.974 112.054 1.920 19832
1368 1 12 . 1 1 20 20 THR HA H 20 4.405 4.405 4.444 -0.039 19832
1369 1 12 . 1 1 20 20 THR CA C 20 61.680 61.680 61.823 -0.143 19832
1370 1 12 . 1 1 20 20 THR CB C 20 69.817 69.817 69.853 -0.036 19832
1371 1 12 . 1 1 20 20 THR H H 20 8.085 8.085 7.584 0.501 19832
1372 1 12 . 1 1 21 21 GLY N N 21 110.706 110.706 112.861 -2.155 19832
1373 1 12 . 1 1 21 21 GLY CA C 21 45.310 45.310 45.492 -0.182 19832
1374 1 12 . 1 1 21 21 GLY H H 21 8.360 8.360 8.345 0.015 19832
1375 1 12 . 1 1 22 22 GLY N N 22 107.728 107.728 110.245 -2.517 19832
1376 1 12 . 1 1 22 22 GLY CA C 22 45.175 45.175 45.444 -0.270 19832
1377 1 12 . 1 1 22 22 GLY H H 22 8.146 8.146 7.995 0.151 19832
1378 1 12 . 1 1 23 23 TYR N N 23 119.224 119.224 124.581 -5.357 19832
1379 1 12 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.726 -0.219 19832
1380 1 12 . 1 1 23 23 TYR H H 23 7.870 7.870 7.756 0.114 19832
1381 1 12 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.476 -0.095 19832
1382 1 12 . 1 1 24 24 PRO CA C 24 64.447 64.447 64.911 -0.464 19832
1383 1 12 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.333 -0.817 19832
1384 1 12 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.799 -0.413 19832
1385 1 12 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.302 0.450 19832
1386 1 12 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.961 -1.473 19832
1387 1 12 . 1 1 25 25 TRP H H 25 6.924 6.924 7.860 -0.936 19832
1388 1 12 . 1 1 26 26 GLU N N 26 119.971 119.971 122.382 -2.411 19832
1389 1 12 . 1 1 26 26 GLU HA H 26 4.453 4.453 3.963 0.490 19832
1390 1 12 . 1 1 26 26 GLU CA C 26 55.645 55.645 55.501 0.145 19832
1391 1 12 . 1 1 26 26 GLU CB C 26 28.805 28.805 27.997 0.808 19832
1392 1 12 . 1 1 26 26 GLU H H 26 7.653 7.653 7.511 0.142 19832
1393 1 12 . 1 1 27 27 ARG N N 27 120.787 120.787 123.664 -2.877 19832
1394 1 12 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.596 -0.239 19832
1395 1 12 . 1 1 27 27 ARG CA C 27 56.406 56.406 55.475 0.930 19832
1396 1 12 . 1 1 27 27 ARG CB C 27 30.763 30.763 31.643 -0.880 19832
1397 1 12 . 1 1 27 27 ARG H H 27 8.162 8.162 7.729 0.433 19832
1398 1 12 . 1 1 28 28 GLY N N 28 109.282 109.282 111.542 -2.260 19832
1399 1 12 . 1 1 28 28 GLY H H 28 8.483 8.483 8.174 0.309 19832
1400 1 12 . 1 1 29 29 LYS N N 29 120.396 120.396 121.134 -0.738 19832
1401 1 12 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.559 -0.156 19832
1402 1 12 . 1 1 29 29 LYS CA C 29 55.875 55.875 57.835 -1.960 19832
1403 1 12 . 1 1 29 29 LYS CB C 29 33.293 33.293 32.800 0.493 19832
1404 1 12 . 1 1 29 29 LYS H H 29 8.112 8.112 8.762 -0.650 19832
1405 1 13 . 1 1 2 2 LYS N N 2 124.386 124.386 122.282 2.104 19832
1406 1 13 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.446 -0.062 19832
1407 1 13 . 1 1 2 2 LYS CB C 2 32.959 32.959 32.602 0.357 19832
1408 1 13 . 1 1 2 2 LYS H H 2 9.052 9.052 8.574 0.478 19832
1409 1 13 . 1 1 3 3 THR N N 3 116.039 116.039 120.212 -4.173 19832
1410 1 13 . 1 1 3 3 THR HA H 3 4.216 4.216 3.992 0.224 19832
1411 1 13 . 1 1 3 3 THR CB C 3 68.928 68.928 68.840 0.088 19832
1412 1 13 . 1 1 3 3 THR H H 3 8.478 8.478 8.710 -0.232 19832
1413 1 13 . 1 1 4 4 ILE N N 4 121.132 121.132 118.369 2.763 19832
1414 1 13 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.939 0.171 19832
1415 1 13 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.856 -0.284 19832
1416 1 13 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.947 1.006 19832
1417 1 13 . 1 1 4 4 ILE H H 4 8.556 8.556 7.888 0.668 19832
1418 1 13 . 1 1 5 5 LEU N N 5 119.569 119.569 121.081 -1.512 19832
1419 1 13 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.939 0.247 19832
1420 1 13 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.298 -1.080 19832
1421 1 13 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.060 0.020 19832
1422 1 13 . 1 1 5 5 LEU H H 5 7.935 7.935 8.411 -0.476 19832
1423 1 13 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.957 0.170 19832
1424 1 13 . 1 1 6 6 ARG CA C 6 58.711 58.711 59.097 -0.386 19832
1425 1 13 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.886 -0.199 19832
1426 1 13 . 1 1 6 6 ARG H H 6 8.008 8.008 7.786 0.222 19832
1427 1 13 . 1 1 7 7 PHE N N 7 118.637 118.637 117.644 0.993 19832
1428 1 13 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.374 0.104 19832
1429 1 13 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.928 0.185 19832
1430 1 13 . 1 1 7 7 PHE H H 7 7.948 7.948 7.771 0.177 19832
1431 1 13 . 1 1 8 8 VAL N N 8 116.441 116.441 120.763 -4.322 19832
1432 1 13 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.667 0.226 19832
1433 1 13 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.626 -0.661 19832
1434 1 13 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.834 0.031 19832
1435 1 13 . 1 1 8 8 VAL H H 8 8.014 8.014 8.099 -0.085 19832
1436 1 13 . 1 1 9 9 ALA N N 9 121.442 121.442 120.622 0.820 19832
1437 1 13 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.083 0.145 19832
1438 1 13 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.857 -0.390 19832
1439 1 13 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.201 0.278 19832
1440 1 13 . 1 1 9 9 ALA H H 9 8.083 8.083 8.523 -0.440 19832
1441 1 13 . 1 1 10 10 GLY N N 10 104.589 104.589 105.504 -0.915 19832
1442 1 13 . 1 1 10 10 GLY CA C 10 44.663 44.663 46.045 -1.382 19832
1443 1 13 . 1 1 10 10 GLY H H 10 8.134 8.134 8.042 0.092 19832
1444 1 13 . 1 1 11 11 TYR N N 11 118.591 118.591 123.552 -4.961 19832
1445 1 13 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.156 0.167 19832
1446 1 13 . 1 1 11 11 TYR H H 11 8.006 8.006 7.475 0.531 19832
1447 1 13 . 1 1 12 12 ASP N N 12 119.339 119.339 118.020 1.319 19832
1448 1 13 . 1 1 12 12 ASP HA H 12 4.609 4.609 4.007 0.602 19832
1449 1 13 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.652 -2.563 19832
1450 1 13 . 1 1 12 12 ASP H H 12 8.414 8.414 7.820 0.594 19832
1451 1 13 . 1 1 13 13 ILE N N 13 119.097 119.097 118.953 0.144 19832
1452 1 13 . 1 1 13 13 ILE HA H 13 3.994 3.994 3.809 0.185 19832
1453 1 13 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.612 1.534 19832
1454 1 13 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.524 0.960 19832
1455 1 13 . 1 1 13 13 ILE H H 13 8.156 8.156 7.486 0.670 19832
1456 1 13 . 1 1 14 14 ALA N N 14 123.581 123.581 120.957 2.624 19832
1457 1 13 . 1 1 14 14 ALA HA H 14 4.238 4.238 4.169 0.069 19832
1458 1 13 . 1 1 14 14 ALA CA C 14 53.618 53.618 54.657 -1.039 19832
1459 1 13 . 1 1 14 14 ALA CB C 14 18.817 18.817 18.430 0.387 19832
1460 1 13 . 1 1 14 14 ALA H H 14 8.274 8.274 8.189 0.085 19832
1461 1 13 . 1 1 15 15 SER N N 15 112.583 112.583 114.966 -2.383 19832
1462 1 13 . 1 1 15 15 SER HA H 15 4.299 4.299 4.226 0.073 19832
1463 1 13 . 1 1 15 15 SER CA C 15 59.441 59.441 60.891 -1.450 19832
1464 1 13 . 1 1 15 15 SER CB C 15 63.403 63.403 62.992 0.410 19832
1465 1 13 . 1 1 15 15 SER H H 15 8.061 8.061 7.824 0.237 19832
1466 1 13 . 1 1 16 16 HIS N N 16 120.408 120.408 117.261 3.147 19832
1467 1 13 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.764 -0.068 19832
1468 1 13 . 1 1 16 16 HIS CB C 16 28.483 28.483 29.814 -1.331 19832
1469 1 13 . 1 1 16 16 HIS H H 16 8.159 8.159 7.692 0.467 19832
1470 1 13 . 1 1 17 17 LYS N N 17 120.845 120.845 121.520 -0.675 19832
1471 1 13 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.126 0.199 19832
1472 1 13 . 1 1 17 17 LYS CA C 17 56.682 56.682 58.922 -2.240 19832
1473 1 13 . 1 1 17 17 LYS CB C 17 32.996 32.996 32.948 0.048 19832
1474 1 13 . 1 1 17 17 LYS H H 17 8.080 8.080 7.428 0.652 19832
1475 1 13 . 1 1 18 18 LYS N N 18 121.661 121.661 117.796 3.865 19832
1476 1 13 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.430 -0.097 19832
1477 1 13 . 1 1 18 18 LYS CA C 18 56.579 56.579 56.382 0.197 19832
1478 1 13 . 1 1 18 18 LYS H H 18 8.231 8.231 8.262 -0.031 19832
1479 1 13 . 1 1 19 19 LYS N N 19 122.316 122.316 122.087 0.229 19832
1480 1 13 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.315 0.086 19832
1481 1 13 . 1 1 19 19 LYS CA C 19 56.600 56.600 56.851 -0.251 19832
1482 1 13 . 1 1 19 19 LYS CB C 19 32.973 32.973 33.178 -0.205 19832
1483 1 13 . 1 1 19 19 LYS H H 19 8.392 8.392 8.717 -0.325 19832
1484 1 13 . 1 1 20 20 THR N N 20 113.974 113.974 112.708 1.266 19832
1485 1 13 . 1 1 20 20 THR HA H 20 4.405 4.405 4.308 0.097 19832
1486 1 13 . 1 1 20 20 THR CA C 20 61.680 61.680 62.097 -0.417 19832
1487 1 13 . 1 1 20 20 THR CB C 20 69.817 69.817 69.444 0.373 19832
1488 1 13 . 1 1 20 20 THR H H 20 8.085 8.085 7.425 0.660 19832
1489 1 13 . 1 1 21 21 GLY N N 21 110.706 110.706 114.228 -3.522 19832
1490 1 13 . 1 1 21 21 GLY CA C 21 45.310 45.310 44.619 0.691 19832
1491 1 13 . 1 1 21 21 GLY H H 21 8.360 8.360 8.352 0.008 19832
1492 1 13 . 1 1 22 22 GLY N N 22 107.728 107.728 110.993 -3.265 19832
1493 1 13 . 1 1 22 22 GLY CA C 22 45.175 45.175 44.804 0.371 19832
1494 1 13 . 1 1 22 22 GLY H H 22 8.146 8.146 8.441 -0.295 19832
1495 1 13 . 1 1 23 23 TYR N N 23 119.224 119.224 118.614 0.610 19832
1496 1 13 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.879 -0.372 19832
1497 1 13 . 1 1 23 23 TYR H H 23 7.870 7.870 7.612 0.258 19832
1498 1 13 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.457 -0.076 19832
1499 1 13 . 1 1 24 24 PRO CA C 24 64.447 64.447 64.903 -0.456 19832
1500 1 13 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.349 -0.833 19832
1501 1 13 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.947 -0.561 19832
1502 1 13 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.296 0.456 19832
1503 1 13 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.894 -1.406 19832
1504 1 13 . 1 1 25 25 TRP H H 25 6.924 6.924 7.989 -1.065 19832
1505 1 13 . 1 1 26 26 GLU N N 26 119.971 119.971 122.491 -2.520 19832
1506 1 13 . 1 1 26 26 GLU HA H 26 4.453 4.453 3.932 0.521 19832
1507 1 13 . 1 1 26 26 GLU CA C 26 55.645 55.645 55.451 0.194 19832
1508 1 13 . 1 1 26 26 GLU CB C 26 28.805 28.805 27.853 0.952 19832
1509 1 13 . 1 1 26 26 GLU H H 26 7.653 7.653 7.476 0.177 19832
1510 1 13 . 1 1 27 27 ARG N N 27 120.787 120.787 124.430 -3.643 19832
1511 1 13 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.496 -0.139 19832
1512 1 13 . 1 1 27 27 ARG CA C 27 56.406 56.406 55.862 0.544 19832
1513 1 13 . 1 1 27 27 ARG CB C 27 30.763 30.763 31.221 -0.458 19832
1514 1 13 . 1 1 27 27 ARG H H 27 8.162 8.162 8.013 0.149 19832
1515 1 13 . 1 1 28 28 GLY N N 28 109.282 109.282 114.946 -5.664 19832
1516 1 13 . 1 1 28 28 GLY H H 28 8.483 8.483 8.378 0.105 19832
1517 1 13 . 1 1 29 29 LYS N N 29 120.396 120.396 119.802 0.594 19832
1518 1 13 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.642 -0.239 19832
1519 1 13 . 1 1 29 29 LYS CA C 29 55.875 55.875 57.653 -1.778 19832
1520 1 13 . 1 1 29 29 LYS CB C 29 33.293 33.293 33.493 -0.200 19832
1521 1 13 . 1 1 29 29 LYS H H 29 8.112 8.112 8.582 -0.470 19832
1522 1 14 . 1 1 2 2 LYS N N 2 124.386 124.386 122.886 1.500 19832
1523 1 14 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.613 -0.229 19832
1524 1 14 . 1 1 2 2 LYS CB C 2 32.959 32.959 33.243 -0.284 19832
1525 1 14 . 1 1 2 2 LYS H H 2 9.052 9.052 8.574 0.478 19832
1526 1 14 . 1 1 3 3 THR N N 3 116.039 116.039 119.972 -3.933 19832
1527 1 14 . 1 1 3 3 THR HA H 3 4.216 4.216 4.032 0.184 19832
1528 1 14 . 1 1 3 3 THR CB C 3 68.928 68.928 68.774 0.154 19832
1529 1 14 . 1 1 3 3 THR H H 3 8.478 8.478 8.888 -0.410 19832
1530 1 14 . 1 1 4 4 ILE N N 4 121.132 121.132 117.931 3.201 19832
1531 1 14 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.930 0.180 19832
1532 1 14 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.892 -0.320 19832
1533 1 14 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.992 0.962 19832
1534 1 14 . 1 1 4 4 ILE H H 4 8.556 8.556 7.848 0.708 19832
1535 1 14 . 1 1 5 5 LEU N N 5 119.569 119.569 121.013 -1.444 19832
1536 1 14 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.935 0.251 19832
1537 1 14 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.302 -1.084 19832
1538 1 14 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.071 0.009 19832
1539 1 14 . 1 1 5 5 LEU H H 5 7.935 7.935 8.427 -0.492 19832
1540 1 14 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.956 0.171 19832
1541 1 14 . 1 1 6 6 ARG CA C 6 58.711 58.711 59.013 -0.302 19832
1542 1 14 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.796 -0.109 19832
1543 1 14 . 1 1 6 6 ARG H H 6 8.008 8.008 7.805 0.203 19832
1544 1 14 . 1 1 7 7 PHE N N 7 118.637 118.637 117.106 1.531 19832
1545 1 14 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.365 0.113 19832
1546 1 14 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.834 0.279 19832
1547 1 14 . 1 1 7 7 PHE H H 7 7.948 7.948 7.799 0.149 19832
1548 1 14 . 1 1 8 8 VAL N N 8 116.441 116.441 121.009 -4.568 19832
1549 1 14 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.740 0.153 19832
1550 1 14 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.320 -0.355 19832
1551 1 14 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.777 0.088 19832
1552 1 14 . 1 1 8 8 VAL H H 8 8.014 8.014 8.085 -0.071 19832
1553 1 14 . 1 1 9 9 ALA N N 9 121.442 121.442 120.685 0.757 19832
1554 1 14 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.132 0.096 19832
1555 1 14 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.925 -0.458 19832
1556 1 14 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.191 0.288 19832
1557 1 14 . 1 1 9 9 ALA H H 9 8.083 8.083 8.483 -0.400 19832
1558 1 14 . 1 1 10 10 GLY N N 10 104.589 104.589 105.488 -0.899 19832
1559 1 14 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.904 -1.241 19832
1560 1 14 . 1 1 10 10 GLY H H 10 8.134 8.134 8.024 0.110 19832
1561 1 14 . 1 1 11 11 TYR N N 11 118.591 118.591 123.639 -5.048 19832
1562 1 14 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.184 0.139 19832
1563 1 14 . 1 1 11 11 TYR H H 11 8.006 8.006 7.422 0.584 19832
1564 1 14 . 1 1 12 12 ASP N N 12 119.339 119.339 118.033 1.306 19832
1565 1 14 . 1 1 12 12 ASP HA H 12 4.609 4.609 4.123 0.486 19832
1566 1 14 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.953 -2.864 19832
1567 1 14 . 1 1 12 12 ASP H H 12 8.414 8.414 7.858 0.556 19832
1568 1 14 . 1 1 13 13 ILE N N 13 119.097 119.097 118.622 0.475 19832
1569 1 14 . 1 1 13 13 ILE HA H 13 3.994 3.994 4.074 -0.080 19832
1570 1 14 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.300 1.847 19832
1571 1 14 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.272 1.212 19832
1572 1 14 . 1 1 13 13 ILE H H 13 8.156 8.156 7.565 0.591 19832
1573 1 14 . 1 1 14 14 ALA N N 14 123.581 123.581 123.683 -0.102 19832
1574 1 14 . 1 1 14 14 ALA HA H 14 4.238 4.238 4.112 0.126 19832
1575 1 14 . 1 1 14 14 ALA CA C 14 53.618 53.618 55.194 -1.576 19832
1576 1 14 . 1 1 14 14 ALA CB C 14 18.817 18.817 18.074 0.743 19832
1577 1 14 . 1 1 14 14 ALA H H 14 8.274 8.274 8.337 -0.063 19832
1578 1 14 . 1 1 15 15 SER N N 15 112.583 112.583 113.649 -1.066 19832
1579 1 14 . 1 1 15 15 SER HA H 15 4.299 4.299 4.020 0.279 19832
1580 1 14 . 1 1 15 15 SER CA C 15 59.441 59.441 61.676 -2.236 19832
1581 1 14 . 1 1 15 15 SER CB C 15 63.403 63.403 62.777 0.626 19832
1582 1 14 . 1 1 15 15 SER H H 15 8.061 8.061 7.794 0.267 19832
1583 1 14 . 1 1 16 16 HIS N N 16 120.408 120.408 117.644 2.764 19832
1584 1 14 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.496 0.200 19832
1585 1 14 . 1 1 16 16 HIS CB C 16 28.483 28.483 30.141 -1.658 19832
1586 1 14 . 1 1 16 16 HIS H H 16 8.159 8.159 7.773 0.386 19832
1587 1 14 . 1 1 17 17 LYS N N 17 120.845 120.845 120.345 0.500 19832
1588 1 14 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.135 0.190 19832
1589 1 14 . 1 1 17 17 LYS CA C 17 56.682 56.682 58.682 -2.000 19832
1590 1 14 . 1 1 17 17 LYS CB C 17 32.996 32.996 33.294 -0.298 19832
1591 1 14 . 1 1 17 17 LYS H H 17 8.080 8.080 7.599 0.481 19832
1592 1 14 . 1 1 18 18 LYS N N 18 121.661 121.661 117.670 3.991 19832
1593 1 14 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.455 -0.122 19832
1594 1 14 . 1 1 18 18 LYS CA C 18 56.579 56.579 55.778 0.801 19832
1595 1 14 . 1 1 18 18 LYS H H 18 8.231 8.231 8.093 0.138 19832
1596 1 14 . 1 1 19 19 LYS N N 19 122.316 122.316 124.795 -2.479 19832
1597 1 14 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.358 0.043 19832
1598 1 14 . 1 1 19 19 LYS CA C 19 56.600 56.600 57.159 -0.559 19832
1599 1 14 . 1 1 19 19 LYS CB C 19 32.973 32.973 33.055 -0.082 19832
1600 1 14 . 1 1 19 19 LYS H H 19 8.392 8.392 8.750 -0.358 19832
1601 1 14 . 1 1 20 20 THR N N 20 113.974 113.974 112.737 1.237 19832
1602 1 14 . 1 1 20 20 THR HA H 20 4.405 4.405 4.450 -0.045 19832
1603 1 14 . 1 1 20 20 THR CA C 20 61.680 61.680 61.300 0.380 19832
1604 1 14 . 1 1 20 20 THR CB C 20 69.817 69.817 68.376 1.441 19832
1605 1 14 . 1 1 20 20 THR H H 20 8.085 8.085 7.648 0.437 19832
1606 1 14 . 1 1 21 21 GLY N N 21 110.706 110.706 110.619 0.087 19832
1607 1 14 . 1 1 21 21 GLY CA C 21 45.310 45.310 45.928 -0.618 19832
1608 1 14 . 1 1 21 21 GLY H H 21 8.360 8.360 7.959 0.401 19832
1609 1 14 . 1 1 22 22 GLY N N 22 107.728 107.728 108.813 -1.085 19832
1610 1 14 . 1 1 22 22 GLY CA C 22 45.175 45.175 44.778 0.397 19832
1611 1 14 . 1 1 22 22 GLY H H 22 8.146 8.146 7.612 0.534 19832
1612 1 14 . 1 1 23 23 TYR N N 23 119.224 119.224 123.605 -4.381 19832
1613 1 14 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.891 -0.384 19832
1614 1 14 . 1 1 23 23 TYR H H 23 7.870 7.870 7.860 0.010 19832
1615 1 14 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.405 -0.024 19832
1616 1 14 . 1 1 24 24 PRO CA C 24 64.447 64.447 65.069 -0.622 19832
1617 1 14 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.207 -0.691 19832
1618 1 14 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.942 -0.556 19832
1619 1 14 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.285 0.467 19832
1620 1 14 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.900 -1.412 19832
1621 1 14 . 1 1 25 25 TRP H H 25 6.924 6.924 7.985 -1.061 19832
1622 1 14 . 1 1 26 26 GLU N N 26 119.971 119.971 122.718 -2.747 19832
1623 1 14 . 1 1 26 26 GLU HA H 26 4.453 4.453 4.035 0.418 19832
1624 1 14 . 1 1 26 26 GLU CA C 26 55.645 55.645 55.106 0.539 19832
1625 1 14 . 1 1 26 26 GLU CB C 26 28.805 28.805 27.870 0.935 19832
1626 1 14 . 1 1 26 26 GLU H H 26 7.653 7.653 7.594 0.059 19832
1627 1 14 . 1 1 27 27 ARG N N 27 120.787 120.787 123.895 -3.108 19832
1628 1 14 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.305 0.052 19832
1629 1 14 . 1 1 27 27 ARG CA C 27 56.406 56.406 56.194 0.212 19832
1630 1 14 . 1 1 27 27 ARG CB C 27 30.763 30.763 30.812 -0.049 19832
1631 1 14 . 1 1 27 27 ARG H H 27 8.162 8.162 7.664 0.498 19832
1632 1 14 . 1 1 28 28 GLY N N 28 109.282 109.282 105.903 3.379 19832
1633 1 14 . 1 1 28 28 GLY H H 28 8.483 8.483 7.414 1.069 19832
1634 1 14 . 1 1 29 29 LYS N N 29 120.396 120.396 119.381 1.015 19832
1635 1 14 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.187 0.216 19832
1636 1 14 . 1 1 29 29 LYS CA C 29 55.875 55.875 56.770 -0.895 19832
1637 1 14 . 1 1 29 29 LYS CB C 29 33.293 33.293 32.887 0.406 19832
1638 1 14 . 1 1 29 29 LYS H H 29 8.112 8.112 8.147 -0.035 19832
1639 1 15 . 1 1 2 2 LYS N N 2 124.386 124.386 125.879 -1.493 19832
1640 1 15 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.231 0.153 19832
1641 1 15 . 1 1 2 2 LYS CB C 2 32.959 32.959 32.531 0.428 19832
1642 1 15 . 1 1 2 2 LYS H H 2 9.052 9.052 8.722 0.330 19832
1643 1 15 . 1 1 3 3 THR N N 3 116.039 116.039 120.009 -3.970 19832
1644 1 15 . 1 1 3 3 THR HA H 3 4.216 4.216 4.007 0.209 19832
1645 1 15 . 1 1 3 3 THR CB C 3 68.928 68.928 68.794 0.134 19832
1646 1 15 . 1 1 3 3 THR H H 3 8.478 8.478 8.619 -0.141 19832
1647 1 15 . 1 1 4 4 ILE N N 4 121.132 121.132 118.553 2.579 19832
1648 1 15 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.939 0.171 19832
1649 1 15 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.894 -0.322 19832
1650 1 15 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.918 1.036 19832
1651 1 15 . 1 1 4 4 ILE H H 4 8.556 8.556 7.902 0.654 19832
1652 1 15 . 1 1 5 5 LEU N N 5 119.569 119.569 121.265 -1.696 19832
1653 1 15 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.961 0.225 19832
1654 1 15 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.217 -0.999 19832
1655 1 15 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.092 -0.012 19832
1656 1 15 . 1 1 5 5 LEU H H 5 7.935 7.935 8.442 -0.507 19832
1657 1 15 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.993 0.134 19832
1658 1 15 . 1 1 6 6 ARG CA C 6 58.711 58.711 58.625 0.086 19832
1659 1 15 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.439 0.249 19832
1660 1 15 . 1 1 6 6 ARG H H 6 8.008 8.008 7.864 0.144 19832
1661 1 15 . 1 1 7 7 PHE N N 7 118.637 118.637 117.785 0.852 19832
1662 1 15 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.417 0.061 19832
1663 1 15 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.847 0.266 19832
1664 1 15 . 1 1 7 7 PHE H H 7 7.948 7.948 7.768 0.180 19832
1665 1 15 . 1 1 8 8 VAL N N 8 116.441 116.441 120.772 -4.331 19832
1666 1 15 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.668 0.225 19832
1667 1 15 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.644 -0.679 19832
1668 1 15 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.832 0.033 19832
1669 1 15 . 1 1 8 8 VAL H H 8 8.014 8.014 8.123 -0.109 19832
1670 1 15 . 1 1 9 9 ALA N N 9 121.442 121.442 120.659 0.783 19832
1671 1 15 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.109 0.119 19832
1672 1 15 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.850 -0.383 19832
1673 1 15 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.236 0.243 19832
1674 1 15 . 1 1 9 9 ALA H H 9 8.083 8.083 8.521 -0.438 19832
1675 1 15 . 1 1 10 10 GLY N N 10 104.589 104.589 105.367 -0.778 19832
1676 1 15 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.938 -1.275 19832
1677 1 15 . 1 1 10 10 GLY H H 10 8.134 8.134 8.043 0.091 19832
1678 1 15 . 1 1 11 11 TYR N N 11 118.591 118.591 123.649 -5.058 19832
1679 1 15 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.129 0.194 19832
1680 1 15 . 1 1 11 11 TYR H H 11 8.006 8.006 7.444 0.562 19832
1681 1 15 . 1 1 12 12 ASP N N 12 119.339 119.339 118.205 1.134 19832
1682 1 15 . 1 1 12 12 ASP HA H 12 4.609 4.609 4.078 0.531 19832
1683 1 15 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.507 -2.418 19832
1684 1 15 . 1 1 12 12 ASP H H 12 8.414 8.414 7.817 0.597 19832
1685 1 15 . 1 1 13 13 ILE N N 13 119.097 119.097 118.159 0.938 19832
1686 1 15 . 1 1 13 13 ILE HA H 13 3.994 3.994 3.777 0.217 19832
1687 1 15 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.676 1.471 19832
1688 1 15 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.470 1.014 19832
1689 1 15 . 1 1 13 13 ILE H H 13 8.156 8.156 7.256 0.900 19832
1690 1 15 . 1 1 14 14 ALA N N 14 123.581 123.581 123.068 0.513 19832
1691 1 15 . 1 1 14 14 ALA HA H 14 4.238 4.238 4.055 0.183 19832
1692 1 15 . 1 1 14 14 ALA CA C 14 53.618 53.618 54.574 -0.956 19832
1693 1 15 . 1 1 14 14 ALA CB C 14 18.817 18.817 18.020 0.797 19832
1694 1 15 . 1 1 14 14 ALA H H 14 8.274 8.274 8.393 -0.119 19832
1695 1 15 . 1 1 15 15 SER N N 15 112.583 112.583 113.542 -0.959 19832
1696 1 15 . 1 1 15 15 SER HA H 15 4.299 4.299 4.004 0.295 19832
1697 1 15 . 1 1 15 15 SER CA C 15 59.441 59.441 60.737 -1.296 19832
1698 1 15 . 1 1 15 15 SER CB C 15 63.403 63.403 63.029 0.374 19832
1699 1 15 . 1 1 15 15 SER H H 15 8.061 8.061 7.635 0.426 19832
1700 1 15 . 1 1 16 16 HIS N N 16 120.408 120.408 115.870 4.538 19832
1701 1 15 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.818 -0.122 19832
1702 1 15 . 1 1 16 16 HIS CB C 16 28.483 28.483 30.792 -2.309 19832
1703 1 15 . 1 1 16 16 HIS H H 16 8.159 8.159 7.087 1.072 19832
1704 1 15 . 1 1 17 17 LYS N N 17 120.845 120.845 121.713 -0.868 19832
1705 1 15 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.340 -0.015 19832
1706 1 15 . 1 1 17 17 LYS CA C 17 56.682 56.682 58.153 -1.471 19832
1707 1 15 . 1 1 17 17 LYS CB C 17 32.996 32.996 33.601 -0.605 19832
1708 1 15 . 1 1 17 17 LYS H H 17 8.080 8.080 8.070 0.010 19832
1709 1 15 . 1 1 18 18 LYS N N 18 121.661 121.661 118.921 2.740 19832
1710 1 15 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.444 -0.111 19832
1711 1 15 . 1 1 18 18 LYS CA C 18 56.579 56.579 55.887 0.692 19832
1712 1 15 . 1 1 18 18 LYS H H 18 8.231 8.231 7.568 0.663 19832
1713 1 15 . 1 1 19 19 LYS N N 19 122.316 122.316 122.067 0.249 19832
1714 1 15 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.397 0.004 19832
1715 1 15 . 1 1 19 19 LYS CA C 19 56.600 56.600 57.418 -0.818 19832
1716 1 15 . 1 1 19 19 LYS CB C 19 32.973 32.973 32.556 0.417 19832
1717 1 15 . 1 1 19 19 LYS H H 19 8.392 8.392 8.307 0.085 19832
1718 1 15 . 1 1 20 20 THR N N 20 113.974 113.974 112.024 1.950 19832
1719 1 15 . 1 1 20 20 THR HA H 20 4.405 4.405 4.402 0.003 19832
1720 1 15 . 1 1 20 20 THR CA C 20 61.680 61.680 61.389 0.291 19832
1721 1 15 . 1 1 20 20 THR CB C 20 69.817 69.817 70.189 -0.372 19832
1722 1 15 . 1 1 20 20 THR H H 20 8.085 8.085 7.338 0.747 19832
1723 1 15 . 1 1 21 21 GLY N N 21 110.706 110.706 112.392 -1.686 19832
1724 1 15 . 1 1 21 21 GLY CA C 21 45.310 45.310 45.005 0.305 19832
1725 1 15 . 1 1 21 21 GLY H H 21 8.360 8.360 8.674 -0.314 19832
1726 1 15 . 1 1 22 22 GLY N N 22 107.728 107.728 109.441 -1.713 19832
1727 1 15 . 1 1 22 22 GLY CA C 22 45.175 45.175 44.434 0.742 19832
1728 1 15 . 1 1 22 22 GLY H H 22 8.146 8.146 7.823 0.323 19832
1729 1 15 . 1 1 23 23 TYR N N 23 119.224 119.224 121.989 -2.765 19832
1730 1 15 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.856 -0.349 19832
1731 1 15 . 1 1 23 23 TYR H H 23 7.870 7.870 7.945 -0.075 19832
1732 1 15 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.423 -0.042 19832
1733 1 15 . 1 1 24 24 PRO CA C 24 64.447 64.447 65.153 -0.705 19832
1734 1 15 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.168 -0.652 19832
1735 1 15 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.953 -0.567 19832
1736 1 15 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.296 0.456 19832
1737 1 15 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.905 -1.417 19832
1738 1 15 . 1 1 25 25 TRP H H 25 6.924 6.924 7.997 -1.073 19832
1739 1 15 . 1 1 26 26 GLU N N 26 119.971 119.971 123.003 -3.032 19832
1740 1 15 . 1 1 26 26 GLU HA H 26 4.453 4.453 4.024 0.429 19832
1741 1 15 . 1 1 26 26 GLU CA C 26 55.645 55.645 54.683 0.962 19832
1742 1 15 . 1 1 26 26 GLU CB C 26 28.805 28.805 27.992 0.813 19832
1743 1 15 . 1 1 26 26 GLU H H 26 7.653 7.653 7.577 0.076 19832
1744 1 15 . 1 1 27 27 ARG N N 27 120.787 120.787 125.340 -4.553 19832
1745 1 15 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.104 0.253 19832
1746 1 15 . 1 1 27 27 ARG CA C 27 56.406 56.406 57.915 -1.509 19832
1747 1 15 . 1 1 27 27 ARG CB C 27 30.763 30.763 30.609 0.154 19832
1748 1 15 . 1 1 27 27 ARG H H 27 8.162 8.162 7.971 0.191 19832
1749 1 15 . 1 1 28 28 GLY N N 28 109.282 109.282 105.593 3.689 19832
1750 1 15 . 1 1 28 28 GLY H H 28 8.483 8.483 7.665 0.818 19832
1751 1 15 . 1 1 29 29 LYS N N 29 120.396 120.396 120.094 0.302 19832
1752 1 15 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.297 0.106 19832
1753 1 15 . 1 1 29 29 LYS CA C 29 55.875 55.875 56.690 -0.815 19832
1754 1 15 . 1 1 29 29 LYS CB C 29 33.293 33.293 33.451 -0.158 19832
1755 1 15 . 1 1 29 29 LYS H H 29 8.112 8.112 8.337 -0.225 19832
1756 1 16 . 1 1 2 2 LYS N N 2 124.386 124.386 122.615 1.771 19832
1757 1 16 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.663 -0.279 19832
1758 1 16 . 1 1 2 2 LYS CB C 2 32.959 32.959 33.959 -1.000 19832
1759 1 16 . 1 1 2 2 LYS H H 2 9.052 9.052 8.126 0.926 19832
1760 1 16 . 1 1 3 3 THR N N 3 116.039 116.039 119.755 -3.716 19832
1761 1 16 . 1 1 3 3 THR HA H 3 4.216 4.216 4.094 0.122 19832
1762 1 16 . 1 1 3 3 THR CB C 3 68.928 68.928 68.851 0.077 19832
1763 1 16 . 1 1 3 3 THR H H 3 8.478 8.478 8.883 -0.405 19832
1764 1 16 . 1 1 4 4 ILE N N 4 121.132 121.132 118.731 2.401 19832
1765 1 16 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.956 0.154 19832
1766 1 16 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.866 -0.294 19832
1767 1 16 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.874 1.079 19832
1768 1 16 . 1 1 4 4 ILE H H 4 8.556 8.556 7.901 0.655 19832
1769 1 16 . 1 1 5 5 LEU N N 5 119.569 119.569 121.036 -1.467 19832
1770 1 16 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.935 0.251 19832
1771 1 16 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.300 -1.082 19832
1772 1 16 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.068 0.012 19832
1773 1 16 . 1 1 5 5 LEU H H 5 7.935 7.935 8.424 -0.489 19832
1774 1 16 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.948 0.179 19832
1775 1 16 . 1 1 6 6 ARG CA C 6 58.711 58.711 59.002 -0.291 19832
1776 1 16 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.829 -0.142 19832
1777 1 16 . 1 1 6 6 ARG H H 6 8.008 8.008 7.791 0.217 19832
1778 1 16 . 1 1 7 7 PHE N N 7 118.637 118.637 117.429 1.208 19832
1779 1 16 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.345 0.133 19832
1780 1 16 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.819 0.294 19832
1781 1 16 . 1 1 7 7 PHE H H 7 7.948 7.948 7.796 0.152 19832
1782 1 16 . 1 1 8 8 VAL N N 8 116.441 116.441 121.049 -4.608 19832
1783 1 16 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.737 0.156 19832
1784 1 16 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.243 -0.278 19832
1785 1 16 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.392 0.473 19832
1786 1 16 . 1 1 8 8 VAL H H 8 8.014 8.014 8.086 -0.072 19832
1787 1 16 . 1 1 9 9 ALA N N 9 121.442 121.442 120.581 0.861 19832
1788 1 16 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.115 0.113 19832
1789 1 16 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.860 -0.393 19832
1790 1 16 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.386 0.093 19832
1791 1 16 . 1 1 9 9 ALA H H 9 8.083 8.083 8.527 -0.444 19832
1792 1 16 . 1 1 10 10 GLY N N 10 104.589 104.589 105.509 -0.920 19832
1793 1 16 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.959 -1.296 19832
1794 1 16 . 1 1 10 10 GLY H H 10 8.134 8.134 8.008 0.126 19832
1795 1 16 . 1 1 11 11 TYR N N 11 118.591 118.591 123.388 -4.797 19832
1796 1 16 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.115 0.208 19832
1797 1 16 . 1 1 11 11 TYR H H 11 8.006 8.006 7.433 0.573 19832
1798 1 16 . 1 1 12 12 ASP N N 12 119.339 119.339 117.170 2.169 19832
1799 1 16 . 1 1 12 12 ASP HA H 12 4.609 4.609 3.999 0.610 19832
1800 1 16 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.815 -2.726 19832
1801 1 16 . 1 1 12 12 ASP H H 12 8.414 8.414 7.751 0.663 19832
1802 1 16 . 1 1 13 13 ILE N N 13 119.097 119.097 118.476 0.621 19832
1803 1 16 . 1 1 13 13 ILE HA H 13 3.994 3.994 3.887 0.107 19832
1804 1 16 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.395 1.752 19832
1805 1 16 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.463 1.021 19832
1806 1 16 . 1 1 13 13 ILE H H 13 8.156 8.156 7.449 0.707 19832
1807 1 16 . 1 1 14 14 ALA N N 14 123.581 123.581 123.380 0.201 19832
1808 1 16 . 1 1 14 14 ALA HA H 14 4.238 4.238 4.094 0.144 19832
1809 1 16 . 1 1 14 14 ALA CA C 14 53.618 53.618 54.878 -1.260 19832
1810 1 16 . 1 1 14 14 ALA CB C 14 18.817 18.817 18.395 0.422 19832
1811 1 16 . 1 1 14 14 ALA H H 14 8.274 8.274 8.405 -0.131 19832
1812 1 16 . 1 1 15 15 SER N N 15 112.583 112.583 112.979 -0.396 19832
1813 1 16 . 1 1 15 15 SER HA H 15 4.299 4.299 4.200 0.099 19832
1814 1 16 . 1 1 15 15 SER CA C 15 59.441 59.441 60.982 -1.541 19832
1815 1 16 . 1 1 15 15 SER CB C 15 63.403 63.403 62.820 0.583 19832
1816 1 16 . 1 1 15 15 SER H H 15 8.061 8.061 8.114 -0.053 19832
1817 1 16 . 1 1 16 16 HIS N N 16 120.408 120.408 117.225 3.183 19832
1818 1 16 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.636 0.060 19832
1819 1 16 . 1 1 16 16 HIS CB C 16 28.483 28.483 30.772 -2.289 19832
1820 1 16 . 1 1 16 16 HIS H H 16 8.159 8.159 7.491 0.668 19832
1821 1 16 . 1 1 17 17 LYS N N 17 120.845 120.845 119.644 1.201 19832
1822 1 16 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.311 0.014 19832
1823 1 16 . 1 1 17 17 LYS CA C 17 56.682 56.682 57.746 -1.064 19832
1824 1 16 . 1 1 17 17 LYS CB C 17 32.996 32.996 33.685 -0.689 19832
1825 1 16 . 1 1 17 17 LYS H H 17 8.080 8.080 7.863 0.217 19832
1826 1 16 . 1 1 18 18 LYS N N 18 121.661 121.661 117.931 3.730 19832
1827 1 16 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.399 -0.066 19832
1828 1 16 . 1 1 18 18 LYS CA C 18 56.579 56.579 56.493 0.086 19832
1829 1 16 . 1 1 18 18 LYS H H 18 8.231 8.231 7.712 0.519 19832
1830 1 16 . 1 1 19 19 LYS N N 19 122.316 122.316 123.631 -1.315 19832
1831 1 16 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.517 -0.116 19832
1832 1 16 . 1 1 19 19 LYS CA C 19 56.600 56.600 56.422 0.178 19832
1833 1 16 . 1 1 19 19 LYS CB C 19 32.973 32.973 33.049 -0.076 19832
1834 1 16 . 1 1 19 19 LYS H H 19 8.392 8.392 8.401 -0.009 19832
1835 1 16 . 1 1 20 20 THR N N 20 113.974 113.974 122.283 -8.309 19832
1836 1 16 . 1 1 20 20 THR HA H 20 4.405 4.405 4.567 -0.162 19832
1837 1 16 . 1 1 20 20 THR CA C 20 61.680 61.680 60.927 0.753 19832
1838 1 16 . 1 1 20 20 THR CB C 20 69.817 69.817 68.894 0.923 19832
1839 1 16 . 1 1 20 20 THR H H 20 8.085 8.085 8.543 -0.458 19832
1840 1 16 . 1 1 21 21 GLY N N 21 110.706 110.706 110.558 0.148 19832
1841 1 16 . 1 1 21 21 GLY CA C 21 45.310 45.310 45.803 -0.493 19832
1842 1 16 . 1 1 21 21 GLY H H 21 8.360 8.360 7.988 0.372 19832
1843 1 16 . 1 1 22 22 GLY N N 22 107.728 107.728 110.446 -2.718 19832
1844 1 16 . 1 1 22 22 GLY CA C 22 45.175 45.175 44.584 0.591 19832
1845 1 16 . 1 1 22 22 GLY H H 22 8.146 8.146 7.850 0.296 19832
1846 1 16 . 1 1 23 23 TYR N N 23 119.224 119.224 118.948 0.276 19832
1847 1 16 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.684 -0.177 19832
1848 1 16 . 1 1 23 23 TYR H H 23 7.870 7.870 7.683 0.187 19832
1849 1 16 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.395 -0.014 19832
1850 1 16 . 1 1 24 24 PRO CA C 24 64.447 64.447 65.109 -0.662 19832
1851 1 16 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.181 -0.665 19832
1852 1 16 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.992 -0.606 19832
1853 1 16 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.574 0.178 19832
1854 1 16 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.529 -1.041 19832
1855 1 16 . 1 1 25 25 TRP H H 25 6.924 6.924 8.044 -1.120 19832
1856 1 16 . 1 1 26 26 GLU N N 26 119.971 119.971 120.060 -0.089 19832
1857 1 16 . 1 1 26 26 GLU HA H 26 4.453 4.453 3.856 0.597 19832
1858 1 16 . 1 1 26 26 GLU CA C 26 55.645 55.645 55.545 0.100 19832
1859 1 16 . 1 1 26 26 GLU CB C 26 28.805 28.805 27.993 0.812 19832
1860 1 16 . 1 1 26 26 GLU H H 26 7.653 7.653 7.426 0.227 19832
1861 1 16 . 1 1 27 27 ARG N N 27 120.787 120.787 120.442 0.345 19832
1862 1 16 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.113 0.244 19832
1863 1 16 . 1 1 27 27 ARG CA C 27 56.406 56.406 57.889 -1.483 19832
1864 1 16 . 1 1 27 27 ARG CB C 27 30.763 30.763 30.388 0.375 19832
1865 1 16 . 1 1 27 27 ARG H H 27 8.162 8.162 7.413 0.749 19832
1866 1 16 . 1 1 28 28 GLY N N 28 109.282 109.282 105.424 3.858 19832
1867 1 16 . 1 1 28 28 GLY H H 28 8.483 8.483 8.032 0.451 19832
1868 1 16 . 1 1 29 29 LYS N N 29 120.396 120.396 123.024 -2.628 19832
1869 1 16 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.437 -0.034 19832
1870 1 16 . 1 1 29 29 LYS CA C 29 55.875 55.875 56.474 -0.599 19832
1871 1 16 . 1 1 29 29 LYS CB C 29 33.293 33.293 32.642 0.651 19832
1872 1 16 . 1 1 29 29 LYS H H 29 8.112 8.112 8.564 -0.452 19832
1873 1 17 . 1 1 2 2 LYS N N 2 124.386 124.386 124.757 -0.371 19832
1874 1 17 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.554 -0.170 19832
1875 1 17 . 1 1 2 2 LYS CB C 2 32.959 32.959 33.056 -0.097 19832
1876 1 17 . 1 1 2 2 LYS H H 2 9.052 9.052 8.316 0.736 19832
1877 1 17 . 1 1 3 3 THR N N 3 116.039 116.039 119.790 -3.751 19832
1878 1 17 . 1 1 3 3 THR HA H 3 4.216 4.216 4.090 0.126 19832
1879 1 17 . 1 1 3 3 THR CB C 3 68.928 68.928 68.840 0.088 19832
1880 1 17 . 1 1 3 3 THR H H 3 8.478 8.478 8.870 -0.392 19832
1881 1 17 . 1 1 4 4 ILE N N 4 121.132 121.132 118.639 2.493 19832
1882 1 17 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.968 0.142 19832
1883 1 17 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.835 -0.263 19832
1884 1 17 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.835 1.119 19832
1885 1 17 . 1 1 4 4 ILE H H 4 8.556 8.556 7.869 0.687 19832
1886 1 17 . 1 1 5 5 LEU N N 5 119.569 119.569 121.079 -1.510 19832
1887 1 17 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.939 0.247 19832
1888 1 17 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.292 -1.074 19832
1889 1 17 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.089 -0.008 19832
1890 1 17 . 1 1 5 5 LEU H H 5 7.935 7.935 8.442 -0.507 19832
1891 1 17 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.965 0.162 19832
1892 1 17 . 1 1 6 6 ARG CA C 6 58.711 58.711 59.072 -0.361 19832
1893 1 17 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.747 -0.060 19832
1894 1 17 . 1 1 6 6 ARG H H 6 8.008 8.008 7.817 0.191 19832
1895 1 17 . 1 1 7 7 PHE N N 7 118.637 118.637 117.319 1.318 19832
1896 1 17 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.352 0.126 19832
1897 1 17 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.832 0.281 19832
1898 1 17 . 1 1 7 7 PHE H H 7 7.948 7.948 7.800 0.148 19832
1899 1 17 . 1 1 8 8 VAL N N 8 116.441 116.441 121.068 -4.627 19832
1900 1 17 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.740 0.153 19832
1901 1 17 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.242 -0.277 19832
1902 1 17 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.404 0.461 19832
1903 1 17 . 1 1 8 8 VAL H H 8 8.014 8.014 8.088 -0.074 19832
1904 1 17 . 1 1 9 9 ALA N N 9 121.442 121.442 120.638 0.804 19832
1905 1 17 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.153 0.075 19832
1906 1 17 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.903 -0.436 19832
1907 1 17 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.413 0.066 19832
1908 1 17 . 1 1 9 9 ALA H H 9 8.083 8.083 8.546 -0.463 19832
1909 1 17 . 1 1 10 10 GLY N N 10 104.589 104.589 104.602 -0.013 19832
1910 1 17 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.797 -1.134 19832
1911 1 17 . 1 1 10 10 GLY H H 10 8.134 8.134 8.079 0.056 19832
1912 1 17 . 1 1 11 11 TYR N N 11 118.591 118.591 123.525 -4.934 19832
1913 1 17 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.178 0.144 19832
1914 1 17 . 1 1 11 11 TYR H H 11 8.006 8.006 7.855 0.151 19832
1915 1 17 . 1 1 12 12 ASP N N 12 119.339 119.339 117.793 1.546 19832
1916 1 17 . 1 1 12 12 ASP HA H 12 4.609 4.609 4.098 0.511 19832
1917 1 17 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.727 -2.638 19832
1918 1 17 . 1 1 12 12 ASP H H 12 8.414 8.414 7.777 0.637 19832
1919 1 17 . 1 1 13 13 ILE N N 13 119.097 119.097 117.848 1.249 19832
1920 1 17 . 1 1 13 13 ILE HA H 13 3.994 3.994 4.271 -0.277 19832
1921 1 17 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.716 1.431 19832
1922 1 17 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.132 1.352 19832
1923 1 17 . 1 1 13 13 ILE H H 13 8.156 8.156 7.397 0.759 19832
1924 1 17 . 1 1 14 14 ALA N N 14 123.581 123.581 123.395 0.186 19832
1925 1 17 . 1 1 14 14 ALA HA H 14 4.238 4.238 3.978 0.260 19832
1926 1 17 . 1 1 14 14 ALA CA C 14 53.618 53.618 55.016 -1.398 19832
1927 1 17 . 1 1 14 14 ALA CB C 14 18.817 18.817 17.994 0.823 19832
1928 1 17 . 1 1 14 14 ALA H H 14 8.274 8.274 8.041 0.233 19832
1929 1 17 . 1 1 15 15 SER N N 15 112.583 112.583 114.355 -1.772 19832
1930 1 17 . 1 1 15 15 SER HA H 15 4.299 4.299 4.105 0.194 19832
1931 1 17 . 1 1 15 15 SER CA C 15 59.441 59.441 61.511 -2.070 19832
1932 1 17 . 1 1 15 15 SER CB C 15 63.403 63.403 62.969 0.434 19832
1933 1 17 . 1 1 15 15 SER H H 15 8.061 8.061 8.046 0.015 19832
1934 1 17 . 1 1 16 16 HIS N N 16 120.408 120.408 118.341 2.067 19832
1935 1 17 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.643 0.053 19832
1936 1 17 . 1 1 16 16 HIS CB C 16 28.483 28.483 29.582 -1.099 19832
1937 1 17 . 1 1 16 16 HIS H H 16 8.159 8.159 7.724 0.435 19832
1938 1 17 . 1 1 17 17 LYS N N 17 120.845 120.845 119.985 0.860 19832
1939 1 17 . 1 1 17 17 LYS HA H 17 4.325 4.325 3.998 0.327 19832
1940 1 17 . 1 1 17 17 LYS CA C 17 56.682 56.682 58.365 -1.683 19832
1941 1 17 . 1 1 17 17 LYS CB C 17 32.996 32.996 32.844 0.152 19832
1942 1 17 . 1 1 17 17 LYS H H 17 8.080 8.080 7.147 0.933 19832
1943 1 17 . 1 1 18 18 LYS N N 18 121.661 121.661 116.044 5.617 19832
1944 1 17 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.430 -0.097 19832
1945 1 17 . 1 1 18 18 LYS CA C 18 56.579 56.579 56.384 0.195 19832
1946 1 17 . 1 1 18 18 LYS H H 18 8.231 8.231 7.870 0.361 19832
1947 1 17 . 1 1 19 19 LYS N N 19 122.316 122.316 121.014 1.302 19832
1948 1 17 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.582 -0.181 19832
1949 1 17 . 1 1 19 19 LYS CA C 19 56.600 56.600 56.459 0.141 19832
1950 1 17 . 1 1 19 19 LYS CB C 19 32.973 32.973 34.149 -1.176 19832
1951 1 17 . 1 1 19 19 LYS H H 19 8.392 8.392 8.422 -0.030 19832
1952 1 17 . 1 1 20 20 THR N N 20 113.974 113.974 115.218 -1.244 19832
1953 1 17 . 1 1 20 20 THR HA H 20 4.405 4.405 4.581 -0.176 19832
1954 1 17 . 1 1 20 20 THR CA C 20 61.680 61.680 61.052 0.628 19832
1955 1 17 . 1 1 20 20 THR CB C 20 69.817 69.817 69.762 0.055 19832
1956 1 17 . 1 1 20 20 THR H H 20 8.085 8.085 8.379 -0.294 19832
1957 1 17 . 1 1 21 21 GLY N N 21 110.706 110.706 108.473 2.233 19832
1958 1 17 . 1 1 21 21 GLY CA C 21 45.310 45.310 45.620 -0.310 19832
1959 1 17 . 1 1 21 21 GLY H H 21 8.360 8.360 8.250 0.110 19832
1960 1 17 . 1 1 22 22 GLY N N 22 107.728 107.728 110.829 -3.101 19832
1961 1 17 . 1 1 22 22 GLY CA C 22 45.175 45.175 44.495 0.680 19832
1962 1 17 . 1 1 22 22 GLY H H 22 8.146 8.146 7.898 0.248 19832
1963 1 17 . 1 1 23 23 TYR N N 23 119.224 119.224 124.288 -5.064 19832
1964 1 17 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.724 -0.217 19832
1965 1 17 . 1 1 23 23 TYR H H 23 7.870 7.870 7.924 -0.054 19832
1966 1 17 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.430 -0.049 19832
1967 1 17 . 1 1 24 24 PRO CA C 24 64.447 64.447 65.026 -0.579 19832
1968 1 17 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.221 -0.705 19832
1969 1 17 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.950 -0.564 19832
1970 1 17 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.298 0.454 19832
1971 1 17 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.896 -1.408 19832
1972 1 17 . 1 1 25 25 TRP H H 25 6.924 6.924 7.992 -1.068 19832
1973 1 17 . 1 1 26 26 GLU N N 26 119.971 119.971 122.436 -2.465 19832
1974 1 17 . 1 1 26 26 GLU HA H 26 4.453 4.453 3.998 0.455 19832
1975 1 17 . 1 1 26 26 GLU CA C 26 55.645 55.645 55.285 0.360 19832
1976 1 17 . 1 1 26 26 GLU CB C 26 28.805 28.805 27.828 0.977 19832
1977 1 17 . 1 1 26 26 GLU H H 26 7.653 7.653 7.584 0.069 19832
1978 1 17 . 1 1 27 27 ARG N N 27 120.787 120.787 124.211 -3.424 19832
1979 1 17 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.431 -0.074 19832
1980 1 17 . 1 1 27 27 ARG CA C 27 56.406 56.406 56.028 0.378 19832
1981 1 17 . 1 1 27 27 ARG CB C 27 30.763 30.763 31.243 -0.480 19832
1982 1 17 . 1 1 27 27 ARG H H 27 8.162 8.162 7.866 0.296 19832
1983 1 17 . 1 1 28 28 GLY N N 28 109.282 109.282 108.906 0.376 19832
1984 1 17 . 1 1 28 28 GLY H H 28 8.483 8.483 7.945 0.538 19832
1985 1 17 . 1 1 29 29 LYS N N 29 120.396 120.396 122.013 -1.617 19832
1986 1 17 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.297 0.106 19832
1987 1 17 . 1 1 29 29 LYS CA C 29 55.875 55.875 56.584 -0.709 19832
1988 1 17 . 1 1 29 29 LYS CB C 29 33.293 33.293 32.627 0.666 19832
1989 1 17 . 1 1 29 29 LYS H H 29 8.112 8.112 8.372 -0.260 19832
1990 1 18 . 1 1 2 2 LYS N N 2 124.386 124.386 122.692 1.694 19832
1991 1 18 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.401 -0.017 19832
1992 1 18 . 1 1 2 2 LYS CB C 2 32.959 32.959 33.113 -0.154 19832
1993 1 18 . 1 1 2 2 LYS H H 2 9.052 9.052 8.236 0.816 19832
1994 1 18 . 1 1 3 3 THR N N 3 116.039 116.039 116.318 -0.279 19832
1995 1 18 . 1 1 3 3 THR HA H 3 4.216 4.216 4.366 -0.150 19832
1996 1 18 . 1 1 3 3 THR CB C 3 68.928 68.928 68.943 -0.015 19832
1997 1 18 . 1 1 3 3 THR H H 3 8.478 8.478 8.529 -0.051 19832
1998 1 18 . 1 1 4 4 ILE N N 4 121.132 121.132 118.523 2.609 19832
1999 1 18 . 1 1 4 4 ILE HA H 4 4.110 4.110 4.277 -0.167 19832
2000 1 18 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.284 0.288 19832
2001 1 18 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.955 0.999 19832
2002 1 18 . 1 1 4 4 ILE H H 4 8.556 8.556 7.932 0.624 19832
2003 1 18 . 1 1 5 5 LEU N N 5 119.569 119.569 121.364 -1.795 19832
2004 1 18 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.963 0.223 19832
2005 1 18 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.454 -1.236 19832
2006 1 18 . 1 1 5 5 LEU CB C 5 41.080 41.080 40.967 0.113 19832
2007 1 18 . 1 1 5 5 LEU H H 5 7.935 7.935 7.539 0.396 19832
2008 1 18 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.946 0.181 19832
2009 1 18 . 1 1 6 6 ARG CA C 6 58.711 58.711 58.830 -0.119 19832
2010 1 18 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.697 -0.010 19832
2011 1 18 . 1 1 6 6 ARG H H 6 8.008 8.008 8.182 -0.174 19832
2012 1 18 . 1 1 7 7 PHE N N 7 118.637 118.637 117.484 1.153 19832
2013 1 18 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.374 0.104 19832
2014 1 18 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.947 0.166 19832
2015 1 18 . 1 1 7 7 PHE H H 7 7.948 7.948 7.698 0.250 19832
2016 1 18 . 1 1 8 8 VAL N N 8 116.441 116.441 120.973 -4.532 19832
2017 1 18 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.739 0.154 19832
2018 1 18 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.278 -0.313 19832
2019 1 18 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.370 0.495 19832
2020 1 18 . 1 1 8 8 VAL H H 8 8.014 8.014 8.567 -0.553 19832
2021 1 18 . 1 1 9 9 ALA N N 9 121.442 121.442 120.662 0.780 19832
2022 1 18 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.152 0.076 19832
2023 1 18 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.757 -0.290 19832
2024 1 18 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.391 0.088 19832
2025 1 18 . 1 1 9 9 ALA H H 9 8.083 8.083 8.436 -0.353 19832
2026 1 18 . 1 1 10 10 GLY N N 10 104.589 104.589 104.706 -0.117 19832
2027 1 18 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.774 -1.111 19832
2028 1 18 . 1 1 10 10 GLY H H 10 8.134 8.134 8.176 -0.042 19832
2029 1 18 . 1 1 11 11 TYR N N 11 118.591 118.591 123.494 -4.903 19832
2030 1 18 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.202 0.121 19832
2031 1 18 . 1 1 11 11 TYR H H 11 8.006 8.006 7.614 0.392 19832
2032 1 18 . 1 1 12 12 ASP N N 12 119.339 119.339 117.770 1.569 19832
2033 1 18 . 1 1 12 12 ASP HA H 12 4.609 4.609 3.976 0.633 19832
2034 1 18 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.555 -2.466 19832
2035 1 18 . 1 1 12 12 ASP H H 12 8.414 8.414 7.681 0.733 19832
2036 1 18 . 1 1 13 13 ILE N N 13 119.097 119.097 117.293 1.804 19832
2037 1 18 . 1 1 13 13 ILE HA H 13 3.994 3.994 3.822 0.172 19832
2038 1 18 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.757 1.390 19832
2039 1 18 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.062 1.422 19832
2040 1 18 . 1 1 13 13 ILE H H 13 8.156 8.156 7.500 0.656 19832
2041 1 18 . 1 1 14 14 ALA N N 14 123.581 123.581 123.536 0.045 19832
2042 1 18 . 1 1 14 14 ALA HA H 14 4.238 4.238 4.075 0.163 19832
2043 1 18 . 1 1 14 14 ALA CA C 14 53.618 53.618 54.993 -1.375 19832
2044 1 18 . 1 1 14 14 ALA CB C 14 18.817 18.817 17.932 0.885 19832
2045 1 18 . 1 1 14 14 ALA H H 14 8.274 8.274 7.854 0.420 19832
2046 1 18 . 1 1 15 15 SER N N 15 112.583 112.583 113.878 -1.295 19832
2047 1 18 . 1 1 15 15 SER HA H 15 4.299 4.299 4.080 0.219 19832
2048 1 18 . 1 1 15 15 SER CA C 15 59.441 59.441 61.489 -2.048 19832
2049 1 18 . 1 1 15 15 SER CB C 15 63.403 63.403 63.076 0.327 19832
2050 1 18 . 1 1 15 15 SER H H 15 8.061 8.061 7.727 0.334 19832
2051 1 18 . 1 1 16 16 HIS N N 16 120.408 120.408 117.733 2.675 19832
2052 1 18 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.526 0.170 19832
2053 1 18 . 1 1 16 16 HIS CB C 16 28.483 28.483 29.977 -1.494 19832
2054 1 18 . 1 1 16 16 HIS H H 16 8.159 8.159 7.612 0.547 19832
2055 1 18 . 1 1 17 17 LYS N N 17 120.845 120.845 119.218 1.627 19832
2056 1 18 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.121 0.204 19832
2057 1 18 . 1 1 17 17 LYS CA C 17 56.682 56.682 57.477 -0.795 19832
2058 1 18 . 1 1 17 17 LYS CB C 17 32.996 32.996 33.219 -0.223 19832
2059 1 18 . 1 1 17 17 LYS H H 17 8.080 8.080 7.737 0.343 19832
2060 1 18 . 1 1 18 18 LYS N N 18 121.661 121.661 118.203 3.458 19832
2061 1 18 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.059 0.274 19832
2062 1 18 . 1 1 18 18 LYS CA C 18 56.579 56.579 56.876 -0.297 19832
2063 1 18 . 1 1 18 18 LYS H H 18 8.231 8.231 7.932 0.299 19832
2064 1 18 . 1 1 19 19 LYS N N 19 122.316 122.316 122.073 0.243 19832
2065 1 18 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.119 0.282 19832
2066 1 18 . 1 1 19 19 LYS CA C 19 56.600 56.600 57.617 -1.017 19832
2067 1 18 . 1 1 19 19 LYS CB C 19 32.973 32.973 32.255 0.718 19832
2068 1 18 . 1 1 19 19 LYS H H 19 8.392 8.392 8.653 -0.261 19832
2069 1 18 . 1 1 20 20 THR N N 20 113.974 113.974 111.665 2.309 19832
2070 1 18 . 1 1 20 20 THR HA H 20 4.405 4.405 4.522 -0.117 19832
2071 1 18 . 1 1 20 20 THR CA C 20 61.680 61.680 61.697 -0.017 19832
2072 1 18 . 1 1 20 20 THR CB C 20 69.817 69.817 67.222 2.595 19832
2073 1 18 . 1 1 20 20 THR H H 20 8.085 8.085 7.892 0.193 19832
2074 1 18 . 1 1 21 21 GLY N N 21 110.706 110.706 110.850 -0.144 19832
2075 1 18 . 1 1 21 21 GLY CA C 21 45.310 45.310 45.709 -0.399 19832
2076 1 18 . 1 1 21 21 GLY H H 21 8.360 8.360 8.096 0.264 19832
2077 1 18 . 1 1 22 22 GLY N N 22 107.728 107.728 107.591 0.137 19832
2078 1 18 . 1 1 22 22 GLY CA C 22 45.175 45.175 45.190 -0.014 19832
2079 1 18 . 1 1 22 22 GLY H H 22 8.146 8.146 8.221 -0.075 19832
2080 1 18 . 1 1 23 23 TYR N N 23 119.224 119.224 119.945 -0.721 19832
2081 1 18 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.923 -0.416 19832
2082 1 18 . 1 1 23 23 TYR H H 23 7.870 7.870 7.650 0.220 19832
2083 1 18 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.433 -0.052 19832
2084 1 18 . 1 1 24 24 PRO CA C 24 64.447 64.447 65.046 -0.599 19832
2085 1 18 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.277 -0.761 19832
2086 1 18 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.950 -0.564 19832
2087 1 18 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.294 0.459 19832
2088 1 18 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.907 -1.419 19832
2089 1 18 . 1 1 25 25 TRP H H 25 6.924 6.924 7.992 -1.068 19832
2090 1 18 . 1 1 26 26 GLU N N 26 119.971 119.971 121.975 -2.004 19832
2091 1 18 . 1 1 26 26 GLU HA H 26 4.453 4.453 4.040 0.413 19832
2092 1 18 . 1 1 26 26 GLU CA C 26 55.645 55.645 55.278 0.367 19832
2093 1 18 . 1 1 26 26 GLU CB C 26 28.805 28.805 28.159 0.646 19832
2094 1 18 . 1 1 26 26 GLU H H 26 7.653 7.653 7.661 -0.008 19832
2095 1 18 . 1 1 27 27 ARG N N 27 120.787 120.787 123.870 -3.083 19832
2096 1 18 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.361 -0.004 19832
2097 1 18 . 1 1 27 27 ARG CA C 27 56.406 56.406 56.511 -0.105 19832
2098 1 18 . 1 1 27 27 ARG CB C 27 30.763 30.763 30.364 0.399 19832
2099 1 18 . 1 1 27 27 ARG H H 27 8.162 8.162 7.631 0.531 19832
2100 1 18 . 1 1 28 28 GLY N N 28 109.282 109.282 107.155 2.127 19832
2101 1 18 . 1 1 28 28 GLY H H 28 8.483 8.483 7.816 0.667 19832
2102 1 18 . 1 1 29 29 LYS N N 29 120.396 120.396 117.366 3.030 19832
2103 1 18 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.345 0.058 19832
2104 1 18 . 1 1 29 29 LYS CA C 29 55.875 55.875 56.691 -0.816 19832
2105 1 18 . 1 1 29 29 LYS CB C 29 33.293 33.293 33.680 -0.387 19832
2106 1 18 . 1 1 29 29 LYS H H 29 8.112 8.112 8.215 -0.103 19832
2107 1 19 . 1 1 2 2 LYS N N 2 124.386 124.386 122.952 1.434 19832
2108 1 19 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.628 -0.244 19832
2109 1 19 . 1 1 2 2 LYS CB C 2 32.959 32.959 33.569 -0.610 19832
2110 1 19 . 1 1 2 2 LYS H H 2 9.052 9.052 8.361 0.691 19832
2111 1 19 . 1 1 3 3 THR N N 3 116.039 116.039 120.083 -4.044 19832
2112 1 19 . 1 1 3 3 THR HA H 3 4.216 4.216 4.031 0.185 19832
2113 1 19 . 1 1 3 3 THR CB C 3 68.928 68.928 68.840 0.088 19832
2114 1 19 . 1 1 3 3 THR H H 3 8.478 8.478 8.929 -0.451 19832
2115 1 19 . 1 1 4 4 ILE N N 4 121.132 121.132 118.535 2.597 19832
2116 1 19 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.947 0.163 19832
2117 1 19 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.871 -0.299 19832
2118 1 19 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.919 1.035 19832
2119 1 19 . 1 1 4 4 ILE H H 4 8.556 8.556 7.903 0.653 19832
2120 1 19 . 1 1 5 5 LEU N N 5 119.569 119.569 121.062 -1.493 19832
2121 1 19 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.940 0.246 19832
2122 1 19 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.301 -1.083 19832
2123 1 19 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.083 -0.003 19832
2124 1 19 . 1 1 5 5 LEU H H 5 7.935 7.935 8.436 -0.501 19832
2125 1 19 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.961 0.166 19832
2126 1 19 . 1 1 6 6 ARG CA C 6 58.711 58.711 59.045 -0.334 19832
2127 1 19 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.803 -0.116 19832
2128 1 19 . 1 1 6 6 ARG H H 6 8.008 8.008 7.807 0.201 19832
2129 1 19 . 1 1 7 7 PHE N N 7 118.637 118.637 117.098 1.539 19832
2130 1 19 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.364 0.114 19832
2131 1 19 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.843 0.270 19832
2132 1 19 . 1 1 7 7 PHE H H 7 7.948 7.948 7.789 0.159 19832
2133 1 19 . 1 1 8 8 VAL N N 8 116.441 116.441 121.016 -4.575 19832
2134 1 19 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.743 0.150 19832
2135 1 19 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.310 -0.345 19832
2136 1 19 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.780 0.085 19832
2137 1 19 . 1 1 8 8 VAL H H 8 8.014 8.014 8.071 -0.057 19832
2138 1 19 . 1 1 9 9 ALA N N 9 121.442 121.442 120.669 0.773 19832
2139 1 19 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.136 0.092 19832
2140 1 19 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.938 -0.471 19832
2141 1 19 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.195 0.284 19832
2142 1 19 . 1 1 9 9 ALA H H 9 8.083 8.083 8.495 -0.412 19832
2143 1 19 . 1 1 10 10 GLY N N 10 104.589 104.589 105.517 -0.928 19832
2144 1 19 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.984 -1.321 19832
2145 1 19 . 1 1 10 10 GLY H H 10 8.134 8.134 8.036 0.098 19832
2146 1 19 . 1 1 11 11 TYR N N 11 118.591 118.591 123.926 -5.335 19832
2147 1 19 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.181 0.142 19832
2148 1 19 . 1 1 11 11 TYR H H 11 8.006 8.006 7.429 0.577 19832
2149 1 19 . 1 1 12 12 ASP N N 12 119.339 119.339 118.307 1.032 19832
2150 1 19 . 1 1 12 12 ASP HA H 12 4.609 4.609 4.137 0.472 19832
2151 1 19 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.481 -2.392 19832
2152 1 19 . 1 1 12 12 ASP H H 12 8.414 8.414 7.893 0.521 19832
2153 1 19 . 1 1 13 13 ILE N N 13 119.097 119.097 119.039 0.058 19832
2154 1 19 . 1 1 13 13 ILE HA H 13 3.994 3.994 4.307 -0.313 19832
2155 1 19 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.599 1.548 19832
2156 1 19 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.318 1.166 19832
2157 1 19 . 1 1 13 13 ILE H H 13 8.156 8.156 7.542 0.614 19832
2158 1 19 . 1 1 14 14 ALA N N 14 123.581 123.581 122.918 0.663 19832
2159 1 19 . 1 1 14 14 ALA HA H 14 4.238 4.238 3.951 0.287 19832
2160 1 19 . 1 1 14 14 ALA CA C 14 53.618 53.618 54.917 -1.299 19832
2161 1 19 . 1 1 14 14 ALA CB C 14 18.817 18.817 17.991 0.826 19832
2162 1 19 . 1 1 14 14 ALA H H 14 8.274 8.274 8.509 -0.235 19832
2163 1 19 . 1 1 15 15 SER N N 15 112.583 112.583 113.947 -1.364 19832
2164 1 19 . 1 1 15 15 SER HA H 15 4.299 4.299 4.021 0.278 19832
2165 1 19 . 1 1 15 15 SER CA C 15 59.441 59.441 61.991 -2.550 19832
2166 1 19 . 1 1 15 15 SER CB C 15 63.403 63.403 63.190 0.213 19832
2167 1 19 . 1 1 15 15 SER H H 15 8.061 8.061 8.088 -0.027 19832
2168 1 19 . 1 1 16 16 HIS N N 16 120.408 120.408 115.547 4.861 19832
2169 1 19 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.565 0.131 19832
2170 1 19 . 1 1 16 16 HIS CB C 16 28.483 28.483 29.605 -1.122 19832
2171 1 19 . 1 1 16 16 HIS H H 16 8.159 8.159 7.799 0.360 19832
2172 1 19 . 1 1 17 17 LYS N N 17 120.845 120.845 121.178 -0.333 19832
2173 1 19 . 1 1 17 17 LYS HA H 17 4.325 4.325 3.908 0.417 19832
2174 1 19 . 1 1 17 17 LYS CA C 17 56.682 56.682 58.719 -2.038 19832
2175 1 19 . 1 1 17 17 LYS CB C 17 32.996 32.996 32.552 0.444 19832
2176 1 19 . 1 1 17 17 LYS H H 17 8.080 8.080 7.141 0.939 19832
2177 1 19 . 1 1 18 18 LYS N N 18 121.661 121.661 118.442 3.219 19832
2178 1 19 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.355 -0.022 19832
2179 1 19 . 1 1 18 18 LYS CA C 18 56.579 56.579 55.503 1.076 19832
2180 1 19 . 1 1 18 18 LYS H H 18 8.231 8.231 7.812 0.419 19832
2181 1 19 . 1 1 19 19 LYS N N 19 122.316 122.316 122.328 -0.012 19832
2182 1 19 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.406 -0.005 19832
2183 1 19 . 1 1 19 19 LYS CA C 19 56.600 56.600 56.408 0.192 19832
2184 1 19 . 1 1 19 19 LYS CB C 19 32.973 32.973 32.856 0.117 19832
2185 1 19 . 1 1 19 19 LYS H H 19 8.392 8.392 7.894 0.498 19832
2186 1 19 . 1 1 20 20 THR N N 20 113.974 113.974 111.901 2.073 19832
2187 1 19 . 1 1 20 20 THR HA H 20 4.405 4.405 4.430 -0.025 19832
2188 1 19 . 1 1 20 20 THR CA C 20 61.680 61.680 61.683 -0.003 19832
2189 1 19 . 1 1 20 20 THR CB C 20 69.817 69.817 69.626 0.191 19832
2190 1 19 . 1 1 20 20 THR H H 20 8.085 8.085 7.499 0.586 19832
2191 1 19 . 1 1 21 21 GLY N N 21 110.706 110.706 112.724 -2.018 19832
2192 1 19 . 1 1 21 21 GLY CA C 21 45.310 45.310 45.179 0.131 19832
2193 1 19 . 1 1 21 21 GLY H H 21 8.360 8.360 8.656 -0.296 19832
2194 1 19 . 1 1 22 22 GLY N N 22 107.728 107.728 110.092 -2.364 19832
2195 1 19 . 1 1 22 22 GLY CA C 22 45.175 45.175 44.621 0.554 19832
2196 1 19 . 1 1 22 22 GLY H H 22 8.146 8.146 8.048 0.098 19832
2197 1 19 . 1 1 23 23 TYR N N 23 119.224 119.224 123.330 -4.106 19832
2198 1 19 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.793 -0.286 19832
2199 1 19 . 1 1 23 23 TYR H H 23 7.870 7.870 7.955 -0.085 19832
2200 1 19 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.387 -0.006 19832
2201 1 19 . 1 1 24 24 PRO CA C 24 64.447 64.447 65.162 -0.716 19832
2202 1 19 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.161 -0.645 19832
2203 1 19 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.950 -0.564 19832
2204 1 19 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.293 0.459 19832
2205 1 19 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.926 -1.438 19832
2206 1 19 . 1 1 25 25 TRP H H 25 6.924 6.924 7.990 -1.066 19832
2207 1 19 . 1 1 26 26 GLU N N 26 119.971 119.971 121.885 -1.914 19832
2208 1 19 . 1 1 26 26 GLU HA H 26 4.453 4.453 4.013 0.440 19832
2209 1 19 . 1 1 26 26 GLU CA C 26 55.645 55.645 55.560 0.085 19832
2210 1 19 . 1 1 26 26 GLU CB C 26 28.805 28.805 28.201 0.604 19832
2211 1 19 . 1 1 26 26 GLU H H 26 7.653 7.653 7.605 0.048 19832
2212 1 19 . 1 1 27 27 ARG N N 27 120.787 120.787 122.769 -1.982 19832
2213 1 19 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.549 -0.192 19832
2214 1 19 . 1 1 27 27 ARG CA C 27 56.406 56.406 54.541 1.865 19832
2215 1 19 . 1 1 27 27 ARG CB C 27 30.763 30.763 29.901 0.862 19832
2216 1 19 . 1 1 27 27 ARG H H 27 8.162 8.162 7.713 0.449 19832
2217 1 19 . 1 1 28 28 GLY N N 28 109.282 109.282 109.516 -0.234 19832
2218 1 19 . 1 1 28 28 GLY H H 28 8.483 8.483 7.744 0.739 19832
2219 1 19 . 1 1 29 29 LYS N N 29 120.396 120.396 121.851 -1.455 19832
2220 1 19 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.055 0.348 19832
2221 1 19 . 1 1 29 29 LYS CA C 29 55.875 55.875 57.899 -2.024 19832
2222 1 19 . 1 1 29 29 LYS CB C 29 33.293 33.293 32.505 0.788 19832
2223 1 19 . 1 1 29 29 LYS H H 29 8.112 8.112 8.509 -0.397 19832
2224 1 20 . 1 1 2 2 LYS N N 2 124.386 124.386 122.555 1.831 19832
2225 1 20 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.616 -0.232 19832
2226 1 20 . 1 1 2 2 LYS CB C 2 32.959 32.959 34.032 -1.073 19832
2227 1 20 . 1 1 2 2 LYS H H 2 9.052 9.052 8.160 0.892 19832
2228 1 20 . 1 1 3 3 THR N N 3 116.039 116.039 120.212 -4.173 19832
2229 1 20 . 1 1 3 3 THR HA H 3 4.216 4.216 4.126 0.090 19832
2230 1 20 . 1 1 3 3 THR CB C 3 68.928 68.928 68.757 0.172 19832
2231 1 20 . 1 1 3 3 THR H H 3 8.478 8.478 8.903 -0.425 19832
2232 1 20 . 1 1 4 4 ILE N N 4 121.132 121.132 118.573 2.559 19832
2233 1 20 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.972 0.138 19832
2234 1 20 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.812 -0.240 19832
2235 1 20 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.847 1.107 19832
2236 1 20 . 1 1 4 4 ILE H H 4 8.556 8.556 7.854 0.702 19832
2237 1 20 . 1 1 5 5 LEU N N 5 119.569 119.569 121.045 -1.476 19832
2238 1 20 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.942 0.244 19832
2239 1 20 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.305 -1.087 19832
2240 1 20 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.075 0.006 19832
2241 1 20 . 1 1 5 5 LEU H H 5 7.935 7.935 8.422 -0.487 19832
2242 1 20 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.962 0.165 19832
2243 1 20 . 1 1 6 6 ARG CA C 6 58.711 58.711 59.031 -0.320 19832
2244 1 20 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.858 -0.171 19832
2245 1 20 . 1 1 6 6 ARG H H 6 8.008 8.008 7.798 0.210 19832
2246 1 20 . 1 1 7 7 PHE N N 7 118.637 118.637 117.547 1.090 19832
2247 1 20 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.371 0.107 19832
2248 1 20 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.955 0.158 19832
2249 1 20 . 1 1 7 7 PHE H H 7 7.948 7.948 7.782 0.166 19832
2250 1 20 . 1 1 8 8 VAL N N 8 116.441 116.441 120.733 -4.292 19832
2251 1 20 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.676 0.217 19832
2252 1 20 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.576 -0.611 19832
2253 1 20 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.849 0.015 19832
2254 1 20 . 1 1 8 8 VAL H H 8 8.014 8.014 8.099 -0.085 19832
2255 1 20 . 1 1 9 9 ALA N N 9 121.442 121.442 120.731 0.711 19832
2256 1 20 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.118 0.110 19832
2257 1 20 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.813 -0.346 19832
2258 1 20 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.286 0.193 19832
2259 1 20 . 1 1 9 9 ALA H H 9 8.083 8.083 8.497 -0.414 19832
2260 1 20 . 1 1 10 10 GLY N N 10 104.589 104.589 104.361 0.228 19832
2261 1 20 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.685 -1.022 19832
2262 1 20 . 1 1 10 10 GLY H H 10 8.134 8.134 8.023 0.111 19832
2263 1 20 . 1 1 11 11 TYR N N 11 118.591 118.591 123.692 -5.101 19832
2264 1 20 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.176 0.147 19832
2265 1 20 . 1 1 11 11 TYR H H 11 8.006 8.006 7.866 0.140 19832
2266 1 20 . 1 1 12 12 ASP N N 12 119.339 119.339 117.750 1.589 19832
2267 1 20 . 1 1 12 12 ASP HA H 12 4.609 4.609 4.149 0.460 19832
2268 1 20 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.698 -2.609 19832
2269 1 20 . 1 1 12 12 ASP H H 12 8.414 8.414 7.854 0.560 19832
2270 1 20 . 1 1 13 13 ILE N N 13 119.097 119.097 118.814 0.283 19832
2271 1 20 . 1 1 13 13 ILE HA H 13 3.994 3.994 3.908 0.086 19832
2272 1 20 . 1 1 13 13 ILE CA C 13 63.147 63.147 63.670 -0.523 19832
2273 1 20 . 1 1 13 13 ILE CB C 13 38.484 38.484 38.333 0.151 19832
2274 1 20 . 1 1 13 13 ILE H H 13 8.156 8.156 7.390 0.766 19832
2275 1 20 . 1 1 14 14 ALA N N 14 123.581 123.581 123.280 0.301 19832
2276 1 20 . 1 1 14 14 ALA HA H 14 4.238 4.238 4.143 0.095 19832
2277 1 20 . 1 1 14 14 ALA CA C 14 53.618 53.618 55.122 -1.504 19832
2278 1 20 . 1 1 14 14 ALA CB C 14 18.817 18.817 17.937 0.880 19832
2279 1 20 . 1 1 14 14 ALA H H 14 8.274 8.274 8.061 0.213 19832
2280 1 20 . 1 1 15 15 SER N N 15 112.583 112.583 113.243 -0.660 19832
2281 1 20 . 1 1 15 15 SER HA H 15 4.299 4.299 3.982 0.317 19832
2282 1 20 . 1 1 15 15 SER CA C 15 59.441 59.441 61.921 -2.480 19832
2283 1 20 . 1 1 15 15 SER CB C 15 63.403 63.403 62.781 0.622 19832
2284 1 20 . 1 1 15 15 SER H H 15 8.061 8.061 8.036 0.025 19832
2285 1 20 . 1 1 16 16 HIS N N 16 120.408 120.408 117.486 2.922 19832
2286 1 20 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.593 0.103 19832
2287 1 20 . 1 1 16 16 HIS CB C 16 28.483 28.483 30.483 -2.000 19832
2288 1 20 . 1 1 16 16 HIS H H 16 8.159 8.159 7.462 0.697 19832
2289 1 20 . 1 1 17 17 LYS N N 17 120.845 120.845 121.194 -0.349 19832
2290 1 20 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.107 0.218 19832
2291 1 20 . 1 1 17 17 LYS CA C 17 56.682 56.682 58.829 -2.147 19832
2292 1 20 . 1 1 17 17 LYS CB C 17 32.996 32.996 33.023 -0.027 19832
2293 1 20 . 1 1 17 17 LYS H H 17 8.080 8.080 7.882 0.198 19832
2294 1 20 . 1 1 18 18 LYS N N 18 121.661 121.661 118.936 2.725 19832
2295 1 20 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.346 -0.013 19832
2296 1 20 . 1 1 18 18 LYS CA C 18 56.579 56.579 56.113 0.466 19832
2297 1 20 . 1 1 18 18 LYS H H 18 8.231 8.231 7.807 0.424 19832
2298 1 20 . 1 1 19 19 LYS N N 19 122.316 122.316 122.401 -0.085 19832
2299 1 20 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.341 0.060 19832
2300 1 20 . 1 1 19 19 LYS CA C 19 56.600 56.600 57.749 -1.149 19832
2301 1 20 . 1 1 19 19 LYS CB C 19 32.973 32.973 32.912 0.061 19832
2302 1 20 . 1 1 19 19 LYS H H 19 8.392 8.392 8.014 0.378 19832
2303 1 20 . 1 1 20 20 THR N N 20 113.974 113.974 114.113 -0.139 19832
2304 1 20 . 1 1 20 20 THR HA H 20 4.405 4.405 4.480 -0.075 19832
2305 1 20 . 1 1 20 20 THR CA C 20 61.680 61.680 61.401 0.279 19832
2306 1 20 . 1 1 20 20 THR CB C 20 69.817 69.817 69.167 0.650 19832
2307 1 20 . 1 1 20 20 THR H H 20 8.085 8.085 7.974 0.111 19832
2308 1 20 . 1 1 21 21 GLY N N 21 110.706 110.706 110.917 -0.211 19832
2309 1 20 . 1 1 21 21 GLY CA C 21 45.310 45.310 45.517 -0.207 19832
2310 1 20 . 1 1 21 21 GLY H H 21 8.360 8.360 8.332 0.028 19832
2311 1 20 . 1 1 22 22 GLY N N 22 107.728 107.728 111.274 -3.546 19832
2312 1 20 . 1 1 22 22 GLY CA C 22 45.175 45.175 44.693 0.482 19832
2313 1 20 . 1 1 22 22 GLY H H 22 8.146 8.146 7.900 0.246 19832
2314 1 20 . 1 1 23 23 TYR N N 23 119.224 119.224 118.158 1.066 19832
2315 1 20 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.890 -0.383 19832
2316 1 20 . 1 1 23 23 TYR H H 23 7.870 7.870 7.587 0.283 19832
2317 1 20 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.444 -0.063 19832
2318 1 20 . 1 1 24 24 PRO CA C 24 64.447 64.447 65.028 -0.581 19832
2319 1 20 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.337 -0.821 19832
2320 1 20 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.951 -0.565 19832
2321 1 20 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.293 0.459 19832
2322 1 20 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.906 -1.418 19832
2323 1 20 . 1 1 25 25 TRP H H 25 6.924 6.924 7.994 -1.070 19832
2324 1 20 . 1 1 26 26 GLU N N 26 119.971 119.971 122.759 -2.788 19832
2325 1 20 . 1 1 26 26 GLU HA H 26 4.453 4.453 3.995 0.458 19832
2326 1 20 . 1 1 26 26 GLU CA C 26 55.645 55.645 55.275 0.370 19832
2327 1 20 . 1 1 26 26 GLU CB C 26 28.805 28.805 27.896 0.909 19832
2328 1 20 . 1 1 26 26 GLU H H 26 7.653 7.653 7.555 0.098 19832
2329 1 20 . 1 1 27 27 ARG N N 27 120.787 120.787 124.699 -3.912 19832
2330 1 20 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.394 -0.037 19832
2331 1 20 . 1 1 27 27 ARG CA C 27 56.406 56.406 56.143 0.263 19832
2332 1 20 . 1 1 27 27 ARG CB C 27 30.763 30.763 31.880 -1.117 19832
2333 1 20 . 1 1 27 27 ARG H H 27 8.162 8.162 7.768 0.395 19832
2334 1 20 . 1 1 28 28 GLY N N 28 109.282 109.282 106.200 3.082 19832
2335 1 20 . 1 1 28 28 GLY H H 28 8.483 8.483 7.640 0.843 19832
2336 1 20 . 1 1 29 29 LYS N N 29 120.396 120.396 119.510 0.886 19832
2337 1 20 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.304 0.099 19832
2338 1 20 . 1 1 29 29 LYS CA C 29 55.875 55.875 57.086 -1.211 19832
2339 1 20 . 1 1 29 29 LYS CB C 29 33.293 33.293 32.656 0.637 19832
2340 1 20 . 1 1 29 29 LYS H H 29 8.112 8.112 8.209 -0.097 19832
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 25 2.347 0.357 2.368 19832
2 1 1 "Average Difference" HA 32 0.240 -0.065 0.234 19832
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19832
4 1 1 "Average Difference" CA 20 0.884 0.292 0.856 19832
5 1 1 "Average Difference" CB 21 0.940 0.091 0.959 19832
6 1 1 "Average Difference" HN 27 0.503 -0.189 0.475 19832
7 1 2 "Average Difference" N 25 2.504 0.281 2.539 19832
8 1 2 "Average Difference" HA 32 0.211 -0.033 0.212 19832
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19832
10 1 2 "Average Difference" CA 20 0.802 0.283 0.770 19832
11 1 2 "Average Difference" CB 21 0.941 0.104 0.958 19832
12 1 2 "Average Difference" HN 27 0.469 -0.132 0.459 19832
13 1 3 "Average Difference" N 25 2.718 0.544 2.718 19832
14 1 3 "Average Difference" HA 32 0.242 -0.072 0.235 19832
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19832
16 1 3 "Average Difference" CA 20 0.909 0.235 0.901 19832
17 1 3 "Average Difference" CB 21 1.074 -0.001 1.101 19832
18 1 3 "Average Difference" HN 27 0.398 -0.117 0.387 19832
19 1 4 "Average Difference" N 25 2.186 0.007 2.232 19832
20 1 4 "Average Difference" HA 32 0.231 -0.079 0.220 19832
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19832
22 1 4 "Average Difference" CA 20 0.859 0.544 0.682 19832
23 1 4 "Average Difference" CB 21 0.972 0.131 0.987 19832
24 1 4 "Average Difference" HN 27 0.457 -0.103 0.454 19832
25 1 5 "Average Difference" N 25 2.477 0.064 2.527 19832
26 1 5 "Average Difference" HA 32 0.258 -0.040 0.259 19832
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19832
28 1 5 "Average Difference" CA 20 1.011 0.412 0.947 19832
29 1 5 "Average Difference" CB 21 1.015 0.003 1.040 19832
30 1 5 "Average Difference" HN 27 0.491 -0.120 0.486 19832
31 1 6 "Average Difference" N 25 2.732 0.449 2.750 19832
32 1 6 "Average Difference" HA 32 0.230 -0.112 0.204 19832
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19832
34 1 6 "Average Difference" CA 20 0.928 0.322 0.894 19832
35 1 6 "Average Difference" CB 21 0.898 0.009 0.920 19832
36 1 6 "Average Difference" HN 27 0.417 -0.184 0.382 19832
37 1 7 "Average Difference" N 25 2.515 0.677 2.472 19832
38 1 7 "Average Difference" HA 32 0.263 -0.141 0.226 19832
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19832
40 1 7 "Average Difference" CA 20 0.988 0.392 0.930 19832
41 1 7 "Average Difference" CB 21 0.911 -0.035 0.933 19832
42 1 7 "Average Difference" HN 27 0.447 -0.156 0.427 19832
43 1 8 "Average Difference" N 25 2.596 0.299 2.632 19832
44 1 8 "Average Difference" HA 32 0.230 -0.094 0.214 19832
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19832
46 1 8 "Average Difference" CA 20 0.986 0.428 0.911 19832
47 1 8 "Average Difference" CB 21 0.949 0.010 0.972 19832
48 1 8 "Average Difference" HN 27 0.501 -0.181 0.476 19832
49 1 9 "Average Difference" N 25 2.455 0.958 2.307 19832
50 1 9 "Average Difference" HA 32 0.234 -0.046 0.233 19832
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19832
52 1 9 "Average Difference" CA 20 1.214 0.527 1.121 19832
53 1 9 "Average Difference" CB 21 0.935 0.139 0.948 19832
54 1 9 "Average Difference" HN 27 0.490 -0.134 0.480 19832
55 1 10 "Average Difference" N 25 2.760 0.677 2.731 19832
56 1 10 "Average Difference" HA 32 0.262 -0.091 0.249 19832
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19832
58 1 10 "Average Difference" CA 20 0.973 0.228 0.970 19832
59 1 10 "Average Difference" CB 21 0.930 0.007 0.953 19832
60 1 10 "Average Difference" HN 27 0.507 -0.213 0.469 19832
61 1 11 "Average Difference" N 25 2.453 0.282 2.487 19832
62 1 11 "Average Difference" HA 32 0.223 -0.051 0.220 19832
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19832
64 1 11 "Average Difference" CA 20 0.985 0.281 0.969 19832
65 1 11 "Average Difference" CB 21 0.987 0.036 1.011 19832
66 1 11 "Average Difference" HN 27 0.454 -0.134 0.442 19832
67 1 12 "Average Difference" N 25 2.492 0.739 2.429 19832
68 1 12 "Average Difference" HA 32 0.206 -0.026 0.208 19832
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19832
70 1 12 "Average Difference" CA 20 0.987 0.421 0.916 19832
71 1 12 "Average Difference" CB 21 0.983 0.207 0.985 19832
72 1 12 "Average Difference" HN 27 0.426 -0.114 0.419 19832
73 1 13 "Average Difference" N 25 2.788 0.683 2.759 19832
74 1 13 "Average Difference" HA 32 0.231 -0.065 0.226 19832
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19832
76 1 13 "Average Difference" CA 20 0.981 0.391 0.923 19832
77 1 13 "Average Difference" CB 21 0.842 0.100 0.857 19832
78 1 13 "Average Difference" HN 27 0.437 -0.104 0.432 19832
79 1 14 "Average Difference" N 25 2.567 0.365 2.593 19832
80 1 14 "Average Difference" HA 32 0.221 -0.036 0.222 19832
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19832
82 1 14 "Average Difference" CA 20 1.037 0.381 0.990 19832
83 1 14 "Average Difference" CB 21 0.982 0.015 1.006 19832
84 1 14 "Average Difference" HN 27 0.477 -0.177 0.451 19832
85 1 15 "Average Difference" N 25 2.584 0.505 2.586 19832
86 1 15 "Average Difference" HA 32 0.234 -0.094 0.218 19832
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19832
88 1 15 "Average Difference" CA 20 0.914 0.311 0.882 19832
89 1 15 "Average Difference" CB 21 0.933 0.095 0.951 19832
90 1 15 "Average Difference" HN 27 0.510 -0.180 0.487 19832
91 1 16 "Average Difference" N 25 2.850 0.360 2.886 19832
92 1 16 "Average Difference" HA 32 0.251 -0.093 0.237 19832
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19832
94 1 16 "Average Difference" CA 20 0.885 0.355 0.831 19832
95 1 16 "Average Difference" CB 21 0.996 0.086 1.017 19832
96 1 16 "Average Difference" HN 27 0.501 -0.151 0.487 19832
97 1 17 "Average Difference" N 25 2.673 0.554 2.669 19832
98 1 17 "Average Difference" HA 32 0.240 -0.054 0.238 19832
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19832
100 1 17 "Average Difference" CA 20 0.904 0.301 0.875 19832
101 1 17 "Average Difference" CB 21 0.925 0.057 0.946 19832
102 1 17 "Average Difference" HN 27 0.460 -0.128 0.450 19832
103 1 18 "Average Difference" N 25 2.208 -0.255 2.238 19832
104 1 18 "Average Difference" HA 32 0.228 -0.046 0.227 19832
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19832
106 1 18 "Average Difference" CA 20 0.847 0.402 0.765 19832
107 1 18 "Average Difference" CB 21 1.050 -0.092 1.072 19832
108 1 18 "Average Difference" HN 27 0.462 -0.185 0.431 19832
109 1 19 "Average Difference" N 25 2.519 0.556 2.508 19832
110 1 19 "Average Difference" HA 32 0.259 -0.081 0.250 19832
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19832
112 1 19 "Average Difference" CA 20 1.184 0.329 1.167 19832
113 1 19 "Average Difference" CB 21 0.849 -0.031 0.870 19832
114 1 19 "Average Difference" HN 27 0.493 -0.153 0.478 19832
115 1 20 "Average Difference" N 25 2.384 0.298 2.414 19832
116 1 20 "Average Difference" HA 32 0.238 -0.088 0.225 19832
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19832
118 1 20 "Average Difference" CA 20 1.007 0.556 0.862 19832
119 1 20 "Average Difference" CB 21 0.978 0.175 0.986 19832
120 1 20 "Average Difference" HN 27 0.470 -0.182 0.442 19832
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 19832
_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 LYS N N 2 124.386 124.386 123.519 0.867 19832
2 1 . 1 1 2 2 LYS HA H 2 4.384 4.384 4.525 -0.141 19832
3 1 . 1 1 2 2 LYS CB C 2 32.959 32.959 33.365 -0.406 19832
4 1 . 1 1 2 2 LYS H H 2 9.052 9.052 8.399 0.653 19832
5 1 . 1 1 3 3 THR N N 3 116.039 116.039 119.721 -3.682 19832
6 1 . 1 1 3 3 THR HA H 3 4.216 4.216 4.083 0.133 19832
7 1 . 1 1 3 3 THR CB C 3 68.928 68.928 68.789 0.139 19832
8 1 . 1 1 3 3 THR H H 3 8.478 8.478 8.828 -0.350 19832
9 1 . 1 1 4 4 ILE N N 4 121.132 121.132 118.427 2.705 19832
10 1 . 1 1 4 4 ILE HA H 4 4.110 4.110 3.970 0.140 19832
11 1 . 1 1 4 4 ILE CA C 4 63.572 63.572 63.823 -0.251 19832
12 1 . 1 1 4 4 ILE CB C 4 37.954 37.954 36.905 1.049 19832
13 1 . 1 1 4 4 ILE H H 4 8.556 8.556 7.873 0.683 19832
14 1 . 1 1 5 5 LEU N N 5 119.569 119.569 121.078 -1.509 19832
15 1 . 1 1 5 5 LEU HA H 5 4.186 4.186 3.944 0.242 19832
16 1 . 1 1 5 5 LEU CA C 5 57.218 57.218 58.303 -1.085 19832
17 1 . 1 1 5 5 LEU CB C 5 41.080 41.080 41.071 0.009 19832
18 1 . 1 1 5 5 LEU H H 5 7.935 7.935 8.382 -0.447 19832
19 1 . 1 1 6 6 ARG HA H 6 4.127 4.127 3.959 0.168 19832
20 1 . 1 1 6 6 ARG CA C 6 58.711 58.711 58.978 -0.267 19832
21 1 . 1 1 6 6 ARG CB C 6 29.687 29.687 29.788 -0.101 19832
22 1 . 1 1 6 6 ARG H H 6 8.008 8.008 7.824 0.184 19832
23 1 . 1 1 7 7 PHE N N 7 118.637 118.637 117.413 1.224 19832
24 1 . 1 1 7 7 PHE HA H 7 4.478 4.478 4.373 0.105 19832
25 1 . 1 1 7 7 PHE CB C 7 39.113 39.113 38.868 0.245 19832
26 1 . 1 1 7 7 PHE H H 7 7.948 7.948 7.780 0.168 19832
27 1 . 1 1 8 8 VAL N N 8 116.441 116.441 120.925 -4.484 19832
28 1 . 1 1 8 8 VAL HA H 8 3.893 3.893 3.715 0.178 19832
29 1 . 1 1 8 8 VAL CA C 8 64.965 64.965 65.424 -0.459 19832
30 1 . 1 1 8 8 VAL CB C 8 31.865 31.865 31.685 0.180 19832
31 1 . 1 1 8 8 VAL H H 8 8.014 8.014 8.115 -0.101 19832
32 1 . 1 1 9 9 ALA N N 9 121.442 121.442 120.650 0.792 19832
33 1 . 1 1 9 9 ALA HA H 9 4.228 4.228 4.120 0.108 19832
34 1 . 1 1 9 9 ALA CA C 9 54.467 54.467 54.871 -0.404 19832
35 1 . 1 1 9 9 ALA CB C 9 18.479 18.479 18.271 0.208 19832
36 1 . 1 1 9 9 ALA H H 9 8.083 8.083 8.509 -0.426 19832
37 1 . 1 1 10 10 GLY N N 10 104.589 104.589 105.234 -0.645 19832
38 1 . 1 1 10 10 GLY CA C 10 44.663 44.663 45.876 -1.213 19832
39 1 . 1 1 10 10 GLY H H 10 8.134 8.134 8.014 0.120 19832
40 1 . 1 1 11 11 TYR N N 11 118.591 118.591 123.567 -4.976 19832
41 1 . 1 1 11 11 TYR HA H 11 4.323 4.323 4.149 0.174 19832
42 1 . 1 1 11 11 TYR H H 11 8.006 8.006 7.548 0.458 19832
43 1 . 1 1 12 12 ASP N N 12 119.339 119.339 117.872 1.467 19832
44 1 . 1 1 12 12 ASP HA H 12 4.609 4.609 4.076 0.533 19832
45 1 . 1 1 12 12 ASP CB C 12 38.089 38.089 40.685 -2.596 19832
46 1 . 1 1 12 12 ASP H H 12 8.414 8.414 7.824 0.590 19832
47 1 . 1 1 13 13 ILE N N 13 119.097 119.097 118.376 0.721 19832
48 1 . 1 1 13 13 ILE HA H 13 3.994 3.994 4.006 -0.012 19832
49 1 . 1 1 13 13 ILE CA C 13 63.147 63.147 61.646 1.501 19832
50 1 . 1 1 13 13 ILE CB C 13 38.484 38.484 37.385 1.099 19832
51 1 . 1 1 13 13 ILE H H 13 8.156 8.156 7.459 0.697 19832
52 1 . 1 1 14 14 ALA N N 14 123.581 123.581 123.188 0.393 19832
53 1 . 1 1 14 14 ALA HA H 14 4.238 4.238 4.076 0.162 19832
54 1 . 1 1 14 14 ALA CA C 14 53.618 53.618 54.957 -1.339 19832
55 1 . 1 1 14 14 ALA CB C 14 18.817 18.817 18.092 0.725 19832
56 1 . 1 1 14 14 ALA H H 14 8.274 8.274 8.264 0.010 19832
57 1 . 1 1 15 15 SER N N 15 112.583 112.583 113.602 -1.019 19832
58 1 . 1 1 15 15 SER HA H 15 4.299 4.299 4.074 0.225 19832
59 1 . 1 1 15 15 SER CA C 15 59.441 59.441 61.365 -1.924 19832
60 1 . 1 1 15 15 SER CB C 15 63.403 63.403 62.989 0.414 19832
61 1 . 1 1 15 15 SER H H 15 8.061 8.061 7.916 0.145 19832
62 1 . 1 1 16 16 HIS N N 16 120.408 120.408 117.234 3.175 19832
63 1 . 1 1 16 16 HIS HA H 16 4.696 4.696 4.610 0.086 19832
64 1 . 1 1 16 16 HIS CB C 16 28.483 28.483 30.181 -1.698 19832
65 1 . 1 1 16 16 HIS H H 16 8.159 8.159 7.583 0.576 19832
66 1 . 1 1 17 17 LYS N N 17 120.845 120.845 120.472 0.373 19832
67 1 . 1 1 17 17 LYS HA H 17 4.325 4.325 4.132 0.193 19832
68 1 . 1 1 17 17 LYS CA C 17 56.682 56.682 58.282 -1.600 19832
69 1 . 1 1 17 17 LYS CB C 17 32.996 32.996 33.132 -0.136 19832
70 1 . 1 1 17 17 LYS H H 17 8.080 8.080 7.641 0.439 19832
71 1 . 1 1 18 18 LYS N N 18 121.661 121.661 117.756 3.905 19832
72 1 . 1 1 18 18 LYS HA H 18 4.333 4.333 4.394 -0.061 19832
73 1 . 1 1 18 18 LYS CA C 18 56.579 56.579 56.048 0.531 19832
74 1 . 1 1 18 18 LYS H H 18 8.231 8.231 7.872 0.359 19832
75 1 . 1 1 19 19 LYS N N 19 122.316 122.316 122.942 -0.626 19832
76 1 . 1 1 19 19 LYS HA H 19 4.401 4.401 4.367 0.034 19832
77 1 . 1 1 19 19 LYS CA C 19 56.600 56.600 56.999 -0.399 19832
78 1 . 1 1 19 19 LYS CB C 19 32.973 32.973 33.074 -0.101 19832
79 1 . 1 1 19 19 LYS H H 19 8.392 8.392 8.495 -0.103 19832
80 1 . 1 1 20 20 THR N N 20 113.974 113.974 113.920 0.054 19832
81 1 . 1 1 20 20 THR HA H 20 4.405 4.405 4.440 -0.035 19832
82 1 . 1 1 20 20 THR CA C 20 61.680 61.680 61.598 0.082 19832
83 1 . 1 1 20 20 THR CB C 20 69.817 69.817 69.033 0.784 19832
84 1 . 1 1 20 20 THR H H 20 8.085 8.085 7.832 0.253 19832
85 1 . 1 1 21 21 GLY N N 21 110.706 110.706 111.548 -0.842 19832
86 1 . 1 1 21 21 GLY CA C 21 45.310 45.310 45.273 0.037 19832
87 1 . 1 1 21 21 GLY H H 21 8.360 8.360 8.314 0.046 19832
88 1 . 1 1 22 22 GLY N N 22 107.728 107.728 109.598 -1.870 19832
89 1 . 1 1 22 22 GLY CA C 22 45.175 45.175 44.846 0.329 19832
90 1 . 1 1 22 22 GLY H H 22 8.146 8.146 7.843 0.303 19832
91 1 . 1 1 23 23 TYR N N 23 119.224 119.224 121.455 -2.231 19832
92 1 . 1 1 23 23 TYR HA H 23 4.507 4.507 4.860 -0.353 19832
93 1 . 1 1 23 23 TYR H H 23 7.870 7.870 7.793 0.077 19832
94 1 . 1 1 24 24 PRO HA H 24 4.381 4.381 4.415 -0.034 19832
95 1 . 1 1 24 24 PRO CA C 24 64.447 64.447 65.030 -0.583 19832
96 1 . 1 1 24 24 PRO CB C 24 31.516 31.516 32.238 -0.722 19832
97 1 . 1 1 25 25 TRP HA H 25 4.386 4.386 4.922 -0.536 19832
98 1 . 1 1 25 25 TRP CA C 25 57.752 57.752 57.299 0.453 19832
99 1 . 1 1 25 25 TRP CB C 25 28.488 28.488 29.866 -1.378 19832
100 1 . 1 1 25 25 TRP H H 25 6.924 6.924 7.961 -1.037 19832
101 1 . 1 1 26 26 GLU N N 26 119.971 119.971 122.168 -2.197 19832
102 1 . 1 1 26 26 GLU HA H 26 4.453 4.453 3.983 0.470 19832
103 1 . 1 1 26 26 GLU CA C 26 55.645 55.645 55.318 0.327 19832
104 1 . 1 1 26 26 GLU CB C 26 28.805 28.805 27.965 0.840 19832
105 1 . 1 1 26 26 GLU H H 26 7.653 7.653 7.556 0.097 19832
106 1 . 1 1 27 27 ARG N N 27 120.787 120.787 123.594 -2.807 19832
107 1 . 1 1 27 27 ARG HA H 27 4.357 4.357 4.344 0.013 19832
108 1 . 1 1 27 27 ARG CA C 27 56.406 56.406 56.394 0.012 19832
109 1 . 1 1 27 27 ARG CB C 27 30.763 30.763 30.881 -0.118 19832
110 1 . 1 1 27 27 ARG H H 27 8.162 8.162 7.777 0.385 19832
111 1 . 1 1 28 28 GLY N N 28 109.282 109.282 108.699 0.583 19832
112 1 . 1 1 28 28 GLY H H 28 8.483 8.483 7.897 0.586 19832
113 1 . 1 1 29 29 LYS N N 29 120.396 120.396 120.264 0.132 19832
114 1 . 1 1 29 29 LYS HA H 29 4.403 4.403 4.312 0.091 19832
115 1 . 1 1 29 29 LYS CA C 29 55.875 55.875 57.016 -1.141 19832
116 1 . 1 1 29 29 LYS CB C 29 33.293 33.293 32.888 0.405 19832
117 1 . 1 1 29 29 LYS H H 29 8.112 8.112 8.380 -0.268 19832
stop_
save_