data_19581
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19581
_Entry.PDB_ID 2MG1
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 19581
_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 HA H 2 4.210 4.210 4.109 0.101 19581
2 1 1 . 1 1 2 2 LYS CA C 2 58.800 58.800 58.495 0.305 19581
3 1 1 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.284 0.816 19581
4 1 1 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.093 -0.003 19581
5 1 1 . 1 1 3 3 LYS CA C 3 59.100 59.100 59.194 -0.094 19581
6 1 1 . 1 1 3 3 LYS CB C 3 32.700 32.700 32.027 0.673 19581
7 1 1 . 1 1 3 3 LYS H H 3 8.170 8.170 8.356 -0.186 19581
8 1 1 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.079 0.211 19581
9 1 1 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.567 -0.167 19581
10 1 1 . 1 1 4 4 LEU CB C 4 42.300 42.300 41.112 1.188 19581
11 1 1 . 1 1 4 4 LEU H H 4 7.210 7.210 7.621 -0.411 19581
12 1 1 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.067 0.223 19581
13 1 1 . 1 1 5 5 PHE CA C 5 61.300 61.300 62.238 -0.938 19581
14 1 1 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.167 -0.267 19581
15 1 1 . 1 1 5 5 PHE H H 5 7.670 7.670 7.663 0.007 19581
16 1 1 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.476 0.244 19581
17 1 1 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.491 -1.091 19581
18 1 1 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.794 0.206 19581
19 1 1 . 1 1 6 6 ILE H H 6 7.790 7.790 8.732 -0.942 19581
20 1 1 . 1 1 7 7 MET HA H 7 4.170 4.170 4.000 0.170 19581
21 1 1 . 1 1 7 7 MET CA C 7 58.700 58.700 59.602 -0.902 19581
22 1 1 . 1 1 7 7 MET CB C 7 32.500 32.500 32.538 -0.038 19581
23 1 1 . 1 1 7 7 MET H H 7 7.800 7.800 7.700 0.100 19581
24 1 1 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.691 0.139 19581
25 1 1 . 1 1 8 8 ILE CA C 8 65.100 65.100 65.023 0.077 19581
26 1 1 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.660 0.740 19581
27 1 1 . 1 1 8 8 ILE H H 8 8.190 8.190 7.708 0.482 19581
28 1 1 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.754 -0.114 19581
29 1 1 . 1 1 9 9 VAL CA C 9 67.000 67.000 64.948 2.052 19581
30 1 1 . 1 1 9 9 VAL CB C 9 31.500 31.500 30.151 1.349 19581
31 1 1 . 1 1 9 9 VAL H H 9 8.350 8.350 7.822 0.528 19581
32 1 1 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.495 -0.595 19581
33 1 1 . 1 1 10 10 GLY H H 10 8.370 8.370 8.502 -0.132 19581
34 1 1 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.505 -0.205 19581
35 1 1 . 1 1 11 11 GLY H H 11 7.800 7.800 7.558 0.242 19581
36 1 1 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.087 0.173 19581
37 1 1 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.227 0.573 19581
38 1 1 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.469 0.631 19581
39 1 1 . 1 1 12 12 LEU H H 12 8.070 8.070 7.347 0.723 19581
40 1 1 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.627 0.073 19581
41 1 1 . 1 1 13 13 VAL CA C 13 66.700 66.700 66.272 0.428 19581
42 1 1 . 1 1 13 13 VAL CB C 13 31.900 31.900 31.477 0.423 19581
43 1 1 . 1 1 13 13 VAL H H 13 8.450 8.450 8.363 0.087 19581
44 1 1 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.187 -0.187 19581
45 1 1 . 1 1 14 14 GLY H H 14 7.900 7.900 8.441 -0.541 19581
46 1 1 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.083 0.037 19581
47 1 1 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.346 0.354 19581
48 1 1 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.222 0.778 19581
49 1 1 . 1 1 15 15 LEU H H 15 7.800 7.800 7.483 0.317 19581
50 1 1 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.116 -0.006 19581
51 1 1 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.190 0.010 19581
52 1 1 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.561 -0.161 19581
53 1 1 . 1 1 16 16 ARG H H 16 7.750 7.750 8.079 -0.329 19581
54 1 1 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.843 0.027 19581
55 1 1 . 1 1 17 17 ILE CA C 17 65.000 65.000 64.811 0.189 19581
56 1 1 . 1 1 17 17 ILE CB C 17 37.900 37.900 37.913 -0.013 19581
57 1 1 . 1 1 17 17 ILE H H 17 7.910 7.910 7.407 0.503 19581
58 1 1 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.542 0.018 19581
59 1 1 . 1 1 18 18 VAL CA C 18 67.500 67.500 66.843 0.657 19581
60 1 1 . 1 1 18 18 VAL CB C 18 31.600 31.600 31.676 -0.076 19581
61 1 1 . 1 1 18 18 VAL H H 18 8.030 8.030 8.247 -0.217 19581
62 1 1 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.047 0.293 19581
63 1 1 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.404 -0.404 19581
64 1 1 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.754 -0.354 19581
65 1 1 . 1 1 19 19 PHE H H 19 8.370 8.370 8.631 -0.261 19581
66 1 1 . 1 1 20 20 ALA HA H 20 4.150 4.150 3.796 0.354 19581
67 1 1 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.271 0.629 19581
68 1 1 . 1 1 20 20 ALA CB C 20 17.400 17.400 18.066 -0.666 19581
69 1 1 . 1 1 20 20 ALA H H 20 8.190 8.190 8.040 0.150 19581
70 1 1 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.643 -0.013 19581
71 1 1 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.528 0.772 19581
72 1 1 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.084 0.616 19581
73 1 1 . 1 1 21 21 VAL H H 21 8.690 8.690 7.983 0.707 19581
74 1 1 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.851 0.199 19581
75 1 1 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.233 0.167 19581
76 1 1 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.532 0.168 19581
77 1 1 . 1 1 22 22 LEU H H 22 8.910 8.910 8.398 0.512 19581
78 1 1 . 1 1 23 23 SER HA H 23 4.130 4.130 3.958 0.172 19581
79 1 1 . 1 1 23 23 SER CA C 23 62.500 62.500 61.329 1.171 19581
80 1 1 . 1 1 23 23 SER CB C 23 62.700 62.700 62.942 -0.242 19581
81 1 1 . 1 1 23 23 SER H H 23 8.070 8.070 7.945 0.125 19581
82 1 1 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.772 0.058 19581
83 1 1 . 1 1 24 24 ILE CA C 24 64.900 64.900 63.979 0.921 19581
84 1 1 . 1 1 24 24 ILE CB C 24 38.300 38.300 37.975 0.325 19581
85 1 1 . 1 1 24 24 ILE H H 24 8.100 8.100 8.121 -0.021 19581
86 1 1 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.039 0.081 19581
87 1 1 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.759 -0.159 19581
88 1 1 . 1 1 25 25 LYS CB C 25 32.000 32.000 32.036 -0.036 19581
89 1 1 . 1 1 25 25 LYS H H 25 8.540 8.540 7.958 0.582 19581
90 1 1 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.151 0.049 19581
91 1 1 . 1 1 26 26 LYS CA C 26 57.800 57.800 57.498 0.302 19581
92 1 1 . 1 1 26 26 LYS CB C 26 32.400 32.400 32.815 -0.415 19581
93 1 1 . 1 1 26 26 LYS H H 26 8.350 8.350 7.739 0.611 19581
94 1 2 . 1 1 2 2 LYS HA H 2 4.210 4.210 4.151 0.059 19581
95 1 2 . 1 1 2 2 LYS CA C 2 58.800 58.800 58.643 0.157 19581
96 1 2 . 1 1 2 2 LYS CB C 2 33.100 33.100 31.824 1.276 19581
97 1 2 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.081 0.009 19581
98 1 2 . 1 1 3 3 LYS CA C 3 59.100 59.100 59.062 0.038 19581
99 1 2 . 1 1 3 3 LYS CB C 3 32.700 32.700 31.716 0.984 19581
100 1 2 . 1 1 3 3 LYS H H 3 8.170 8.170 8.367 -0.197 19581
101 1 2 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.092 0.198 19581
102 1 2 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.403 -0.003 19581
103 1 2 . 1 1 4 4 LEU CB C 4 42.300 42.300 41.678 0.622 19581
104 1 2 . 1 1 4 4 LEU H H 4 7.210 7.210 7.463 -0.253 19581
105 1 2 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.048 0.242 19581
106 1 2 . 1 1 5 5 PHE CA C 5 61.300 61.300 62.312 -1.012 19581
107 1 2 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.266 -0.366 19581
108 1 2 . 1 1 5 5 PHE H H 5 7.670 7.670 8.031 -0.361 19581
109 1 2 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.520 0.200 19581
110 1 2 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.447 -1.047 19581
111 1 2 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.768 0.232 19581
112 1 2 . 1 1 6 6 ILE H H 6 7.790 7.790 8.791 -1.001 19581
113 1 2 . 1 1 7 7 MET HA H 7 4.170 4.170 4.063 0.107 19581
114 1 2 . 1 1 7 7 MET CA C 7 58.700 58.700 58.988 -0.288 19581
115 1 2 . 1 1 7 7 MET CB C 7 32.500 32.500 32.182 0.318 19581
116 1 2 . 1 1 7 7 MET H H 7 7.800 7.800 7.437 0.363 19581
117 1 2 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.669 0.161 19581
118 1 2 . 1 1 8 8 ILE CA C 8 65.100 65.100 65.113 -0.013 19581
119 1 2 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.650 0.750 19581
120 1 2 . 1 1 8 8 ILE H H 8 8.190 8.190 7.678 0.512 19581
121 1 2 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.636 0.004 19581
122 1 2 . 1 1 9 9 VAL CA C 9 67.000 67.000 65.804 1.196 19581
123 1 2 . 1 1 9 9 VAL CB C 9 31.500 31.500 31.015 0.485 19581
124 1 2 . 1 1 9 9 VAL H H 9 8.350 8.350 7.852 0.498 19581
125 1 2 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.426 -0.526 19581
126 1 2 . 1 1 10 10 GLY H H 10 8.370 8.370 8.405 -0.035 19581
127 1 2 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.630 -0.330 19581
128 1 2 . 1 1 11 11 GLY H H 11 7.800 7.800 7.466 0.334 19581
129 1 2 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.107 0.153 19581
130 1 2 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.450 0.350 19581
131 1 2 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.509 0.591 19581
132 1 2 . 1 1 12 12 LEU H H 12 8.070 8.070 7.356 0.714 19581
133 1 2 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.733 -0.033 19581
134 1 2 . 1 1 13 13 VAL CA C 13 66.700 66.700 66.246 0.454 19581
135 1 2 . 1 1 13 13 VAL CB C 13 31.900 31.900 30.951 0.949 19581
136 1 2 . 1 1 13 13 VAL H H 13 8.450 8.450 8.529 -0.079 19581
137 1 2 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.139 -0.139 19581
138 1 2 . 1 1 14 14 GLY H H 14 7.900 7.900 7.845 0.055 19581
139 1 2 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.092 0.028 19581
140 1 2 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.737 -0.037 19581
141 1 2 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.228 0.772 19581
142 1 2 . 1 1 15 15 LEU H H 15 7.800 7.800 8.186 -0.386 19581
143 1 2 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.133 -0.023 19581
144 1 2 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.201 -0.001 19581
145 1 2 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.669 -0.269 19581
146 1 2 . 1 1 16 16 ARG H H 16 7.750 7.750 7.677 0.073 19581
147 1 2 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.787 0.083 19581
148 1 2 . 1 1 17 17 ILE CA C 17 65.000 65.000 65.027 -0.027 19581
149 1 2 . 1 1 17 17 ILE CB C 17 37.900 37.900 37.891 0.009 19581
150 1 2 . 1 1 17 17 ILE H H 17 7.910 7.910 7.510 0.400 19581
151 1 2 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.606 -0.046 19581
152 1 2 . 1 1 18 18 VAL CA C 18 67.500 67.500 66.542 0.958 19581
153 1 2 . 1 1 18 18 VAL CB C 18 31.600 31.600 30.927 0.673 19581
154 1 2 . 1 1 18 18 VAL H H 18 8.030 8.030 7.953 0.077 19581
155 1 2 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.057 0.283 19581
156 1 2 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.792 -0.792 19581
157 1 2 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.312 0.088 19581
158 1 2 . 1 1 19 19 PHE H H 19 8.370 8.370 8.652 -0.282 19581
159 1 2 . 1 1 20 20 ALA HA H 20 4.150 4.150 4.070 0.080 19581
160 1 2 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.474 0.426 19581
161 1 2 . 1 1 20 20 ALA CB C 20 17.400 17.400 18.130 -0.730 19581
162 1 2 . 1 1 20 20 ALA H H 20 8.190 8.190 7.769 0.421 19581
163 1 2 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.689 -0.059 19581
164 1 2 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.438 0.862 19581
165 1 2 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.028 0.672 19581
166 1 2 . 1 1 21 21 VAL H H 21 8.690 8.690 7.727 0.963 19581
167 1 2 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.867 0.183 19581
168 1 2 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.435 -0.035 19581
169 1 2 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.440 0.260 19581
170 1 2 . 1 1 22 22 LEU H H 22 8.910 8.910 8.533 0.377 19581
171 1 2 . 1 1 23 23 SER HA H 23 4.130 4.130 4.239 -0.109 19581
172 1 2 . 1 1 23 23 SER CA C 23 62.500 62.500 61.862 0.638 19581
173 1 2 . 1 1 23 23 SER CB C 23 62.700 62.700 63.317 -0.617 19581
174 1 2 . 1 1 23 23 SER H H 23 8.070 8.070 8.180 -0.110 19581
175 1 2 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.831 -0.001 19581
176 1 2 . 1 1 24 24 ILE CA C 24 64.900 64.900 64.075 0.825 19581
177 1 2 . 1 1 24 24 ILE CB C 24 38.300 38.300 37.980 0.320 19581
178 1 2 . 1 1 24 24 ILE H H 24 8.100 8.100 8.204 -0.104 19581
179 1 2 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.031 0.089 19581
180 1 2 . 1 1 25 25 LYS CA C 25 58.600 58.600 59.015 -0.415 19581
181 1 2 . 1 1 25 25 LYS CB C 25 32.000 32.000 32.340 -0.340 19581
182 1 2 . 1 1 25 25 LYS H H 25 8.540 8.540 8.063 0.477 19581
183 1 2 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.172 0.028 19581
184 1 2 . 1 1 26 26 LYS CA C 26 57.800 57.800 57.537 0.263 19581
185 1 2 . 1 1 26 26 LYS CB C 26 32.400 32.400 32.887 -0.487 19581
186 1 2 . 1 1 26 26 LYS H H 26 8.350 8.350 7.663 0.687 19581
187 1 3 . 1 1 2 2 LYS HA H 2 4.210 4.210 4.081 0.129 19581
188 1 3 . 1 1 2 2 LYS CA C 2 58.800 58.800 58.721 0.079 19581
189 1 3 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.693 0.407 19581
190 1 3 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.103 -0.013 19581
191 1 3 . 1 1 3 3 LYS CA C 3 59.100 59.100 59.194 -0.094 19581
192 1 3 . 1 1 3 3 LYS CB C 3 32.700 32.700 32.064 0.636 19581
193 1 3 . 1 1 3 3 LYS H H 3 8.170 8.170 8.293 -0.123 19581
194 1 3 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.046 0.244 19581
195 1 3 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.875 -0.475 19581
196 1 3 . 1 1 4 4 LEU CB C 4 42.300 42.300 41.069 1.231 19581
197 1 3 . 1 1 4 4 LEU H H 4 7.210 7.210 7.568 -0.358 19581
198 1 3 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.087 0.203 19581
199 1 3 . 1 1 5 5 PHE CA C 5 61.300 61.300 62.025 -0.725 19581
200 1 3 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.115 -0.215 19581
201 1 3 . 1 1 5 5 PHE H H 5 7.670 7.670 7.553 0.117 19581
202 1 3 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.437 0.283 19581
203 1 3 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.525 -1.125 19581
204 1 3 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.777 0.223 19581
205 1 3 . 1 1 6 6 ILE H H 6 7.790 7.790 8.689 -0.899 19581
206 1 3 . 1 1 7 7 MET HA H 7 4.170 4.170 4.036 0.134 19581
207 1 3 . 1 1 7 7 MET CA C 7 58.700 58.700 58.795 -0.095 19581
208 1 3 . 1 1 7 7 MET CB C 7 32.500 32.500 32.033 0.467 19581
209 1 3 . 1 1 7 7 MET H H 7 7.800 7.800 8.003 -0.203 19581
210 1 3 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.676 0.154 19581
211 1 3 . 1 1 8 8 ILE CA C 8 65.100 65.100 65.145 -0.045 19581
212 1 3 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.694 0.706 19581
213 1 3 . 1 1 8 8 ILE H H 8 8.190 8.190 7.632 0.558 19581
214 1 3 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.686 -0.046 19581
215 1 3 . 1 1 9 9 VAL CA C 9 67.000 67.000 65.767 1.233 19581
216 1 3 . 1 1 9 9 VAL CB C 9 31.500 31.500 30.537 0.963 19581
217 1 3 . 1 1 9 9 VAL H H 9 8.350 8.350 7.901 0.449 19581
218 1 3 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.252 -0.352 19581
219 1 3 . 1 1 10 10 GLY H H 10 8.370 8.370 8.437 -0.067 19581
220 1 3 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.612 -0.312 19581
221 1 3 . 1 1 11 11 GLY H H 11 7.800 7.800 7.625 0.175 19581
222 1 3 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.049 0.211 19581
223 1 3 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.414 0.386 19581
224 1 3 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.483 0.617 19581
225 1 3 . 1 1 12 12 LEU H H 12 8.070 8.070 7.343 0.727 19581
226 1 3 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.673 0.027 19581
227 1 3 . 1 1 13 13 VAL CA C 13 66.700 66.700 66.058 0.642 19581
228 1 3 . 1 1 13 13 VAL CB C 13 31.900 31.900 31.607 0.293 19581
229 1 3 . 1 1 13 13 VAL H H 13 8.450 8.450 8.421 0.029 19581
230 1 3 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.074 -0.074 19581
231 1 3 . 1 1 14 14 GLY H H 14 7.900 7.900 8.017 -0.117 19581
232 1 3 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.060 0.060 19581
233 1 3 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.600 0.100 19581
234 1 3 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.299 0.701 19581
235 1 3 . 1 1 15 15 LEU H H 15 7.800 7.800 7.793 0.007 19581
236 1 3 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.103 0.007 19581
237 1 3 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.249 -0.049 19581
238 1 3 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.799 -0.399 19581
239 1 3 . 1 1 16 16 ARG H H 16 7.750 7.750 7.749 0.001 19581
240 1 3 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.862 0.008 19581
241 1 3 . 1 1 17 17 ILE CA C 17 65.000 65.000 64.680 0.320 19581
242 1 3 . 1 1 17 17 ILE CB C 17 37.900 37.900 37.873 0.027 19581
243 1 3 . 1 1 17 17 ILE H H 17 7.910 7.910 7.569 0.341 19581
244 1 3 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.660 -0.100 19581
245 1 3 . 1 1 18 18 VAL CA C 18 67.500 67.500 66.290 1.210 19581
246 1 3 . 1 1 18 18 VAL CB C 18 31.600 31.600 31.007 0.593 19581
247 1 3 . 1 1 18 18 VAL H H 18 8.030 8.030 8.241 -0.211 19581
248 1 3 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.073 0.267 19581
249 1 3 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.570 -0.570 19581
250 1 3 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.548 -0.148 19581
251 1 3 . 1 1 19 19 PHE H H 19 8.370 8.370 8.795 -0.425 19581
252 1 3 . 1 1 20 20 ALA HA H 20 4.150 4.150 3.843 0.307 19581
253 1 3 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.318 0.582 19581
254 1 3 . 1 1 20 20 ALA CB C 20 17.400 17.400 17.933 -0.533 19581
255 1 3 . 1 1 20 20 ALA H H 20 8.190 8.190 7.671 0.519 19581
256 1 3 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.632 -0.002 19581
257 1 3 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.681 0.619 19581
258 1 3 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.539 0.161 19581
259 1 3 . 1 1 21 21 VAL H H 21 8.690 8.690 7.536 1.154 19581
260 1 3 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.834 0.216 19581
261 1 3 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.122 0.278 19581
262 1 3 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.344 0.355 19581
263 1 3 . 1 1 22 22 LEU H H 22 8.910 8.910 8.438 0.472 19581
264 1 3 . 1 1 23 23 SER HA H 23 4.130 4.130 3.992 0.138 19581
265 1 3 . 1 1 23 23 SER CA C 23 62.500 62.500 61.142 1.358 19581
266 1 3 . 1 1 23 23 SER CB C 23 62.700 62.700 62.906 -0.206 19581
267 1 3 . 1 1 23 23 SER H H 23 8.070 8.070 7.935 0.135 19581
268 1 3 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.750 0.080 19581
269 1 3 . 1 1 24 24 ILE CA C 24 64.900 64.900 64.137 0.763 19581
270 1 3 . 1 1 24 24 ILE CB C 24 38.300 38.300 37.986 0.314 19581
271 1 3 . 1 1 24 24 ILE H H 24 8.100 8.100 8.184 -0.084 19581
272 1 3 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.023 0.097 19581
273 1 3 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.685 -0.085 19581
274 1 3 . 1 1 25 25 LYS CB C 25 32.000 32.000 31.895 0.104 19581
275 1 3 . 1 1 25 25 LYS H H 25 8.540 8.540 7.970 0.570 19581
276 1 3 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.158 0.042 19581
277 1 3 . 1 1 26 26 LYS CA C 26 57.800 57.800 57.328 0.472 19581
278 1 3 . 1 1 26 26 LYS CB C 26 32.400 32.400 33.136 -0.736 19581
279 1 3 . 1 1 26 26 LYS H H 26 8.350 8.350 7.748 0.602 19581
280 1 4 . 1 1 2 2 LYS HA H 2 4.210 4.210 4.153 0.057 19581
281 1 4 . 1 1 2 2 LYS CA C 2 58.800 58.800 58.798 0.002 19581
282 1 4 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.232 0.868 19581
283 1 4 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.015 0.075 19581
284 1 4 . 1 1 3 3 LYS CA C 3 59.100 59.100 59.399 -0.299 19581
285 1 4 . 1 1 3 3 LYS CB C 3 32.700 32.700 32.013 0.687 19581
286 1 4 . 1 1 3 3 LYS H H 3 8.170 8.170 8.268 -0.098 19581
287 1 4 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.037 0.253 19581
288 1 4 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.939 -0.539 19581
289 1 4 . 1 1 4 4 LEU CB C 4 42.300 42.300 41.823 0.477 19581
290 1 4 . 1 1 4 4 LEU H H 4 7.210 7.210 7.697 -0.487 19581
291 1 4 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.043 0.247 19581
292 1 4 . 1 1 5 5 PHE CA C 5 61.300 61.300 62.057 -0.757 19581
293 1 4 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.111 -0.211 19581
294 1 4 . 1 1 5 5 PHE H H 5 7.670 7.670 7.558 0.112 19581
295 1 4 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.421 0.299 19581
296 1 4 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.527 -1.127 19581
297 1 4 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.768 0.232 19581
298 1 4 . 1 1 6 6 ILE H H 6 7.790 7.790 8.587 -0.797 19581
299 1 4 . 1 1 7 7 MET HA H 7 4.170 4.170 4.002 0.168 19581
300 1 4 . 1 1 7 7 MET CA C 7 58.700 58.700 59.363 -0.663 19581
301 1 4 . 1 1 7 7 MET CB C 7 32.500 32.500 32.498 0.002 19581
302 1 4 . 1 1 7 7 MET H H 7 7.800 7.800 7.662 0.138 19581
303 1 4 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.703 0.127 19581
304 1 4 . 1 1 8 8 ILE CA C 8 65.100 65.100 64.984 0.116 19581
305 1 4 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.893 0.507 19581
306 1 4 . 1 1 8 8 ILE H H 8 8.190 8.190 7.926 0.264 19581
307 1 4 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.654 -0.014 19581
308 1 4 . 1 1 9 9 VAL CA C 9 67.000 67.000 65.383 1.617 19581
309 1 4 . 1 1 9 9 VAL CB C 9 31.500 31.500 30.778 0.722 19581
310 1 4 . 1 1 9 9 VAL H H 9 8.350 8.350 8.132 0.218 19581
311 1 4 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.366 -0.466 19581
312 1 4 . 1 1 10 10 GLY H H 10 8.370 8.370 8.468 -0.098 19581
313 1 4 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.551 -0.251 19581
314 1 4 . 1 1 11 11 GLY H H 11 7.800 7.800 7.501 0.299 19581
315 1 4 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.062 0.198 19581
316 1 4 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.349 0.451 19581
317 1 4 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.486 0.614 19581
318 1 4 . 1 1 12 12 LEU H H 12 8.070 8.070 7.442 0.628 19581
319 1 4 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.745 -0.045 19581
320 1 4 . 1 1 13 13 VAL CA C 13 66.700 66.700 65.872 0.828 19581
321 1 4 . 1 1 13 13 VAL CB C 13 31.900 31.900 30.984 0.916 19581
322 1 4 . 1 1 13 13 VAL H H 13 8.450 8.450 7.965 0.485 19581
323 1 4 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.227 -0.227 19581
324 1 4 . 1 1 14 14 GLY H H 14 7.900 7.900 8.274 -0.374 19581
325 1 4 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.047 0.073 19581
326 1 4 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.586 0.114 19581
327 1 4 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.271 0.729 19581
328 1 4 . 1 1 15 15 LEU H H 15 7.800 7.800 7.757 0.043 19581
329 1 4 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.115 -0.005 19581
330 1 4 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.575 -0.375 19581
331 1 4 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.993 -0.593 19581
332 1 4 . 1 1 16 16 ARG H H 16 7.750 7.750 7.728 0.022 19581
333 1 4 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.772 0.098 19581
334 1 4 . 1 1 17 17 ILE CA C 17 65.000 65.000 64.808 0.192 19581
335 1 4 . 1 1 17 17 ILE CB C 17 37.900 37.900 37.748 0.152 19581
336 1 4 . 1 1 17 17 ILE H H 17 7.910 7.910 7.466 0.444 19581
337 1 4 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.646 -0.086 19581
338 1 4 . 1 1 18 18 VAL CA C 18 67.500 67.500 66.423 1.077 19581
339 1 4 . 1 1 18 18 VAL CB C 18 31.600 31.600 31.037 0.563 19581
340 1 4 . 1 1 18 18 VAL H H 18 8.030 8.030 8.302 -0.272 19581
341 1 4 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.065 0.275 19581
342 1 4 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.559 -0.559 19581
343 1 4 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.599 -0.199 19581
344 1 4 . 1 1 19 19 PHE H H 19 8.370 8.370 8.771 -0.401 19581
345 1 4 . 1 1 20 20 ALA HA H 20 4.150 4.150 3.803 0.347 19581
346 1 4 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.277 0.623 19581
347 1 4 . 1 1 20 20 ALA CB C 20 17.400 17.400 17.948 -0.548 19581
348 1 4 . 1 1 20 20 ALA H H 20 8.190 8.190 7.798 0.392 19581
349 1 4 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.617 0.013 19581
350 1 4 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.718 0.582 19581
351 1 4 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.509 0.191 19581
352 1 4 . 1 1 21 21 VAL H H 21 8.690 8.690 7.664 1.026 19581
353 1 4 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.823 0.227 19581
354 1 4 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.215 0.185 19581
355 1 4 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.275 0.425 19581
356 1 4 . 1 1 22 22 LEU H H 22 8.910 8.910 8.294 0.616 19581
357 1 4 . 1 1 23 23 SER HA H 23 4.130 4.130 4.027 0.103 19581
358 1 4 . 1 1 23 23 SER CA C 23 62.500 62.500 61.320 1.180 19581
359 1 4 . 1 1 23 23 SER CB C 23 62.700 62.700 62.844 -0.144 19581
360 1 4 . 1 1 23 23 SER H H 23 8.070 8.070 7.916 0.154 19581
361 1 4 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.736 0.094 19581
362 1 4 . 1 1 24 24 ILE CA C 24 64.900 64.900 63.931 0.969 19581
363 1 4 . 1 1 24 24 ILE CB C 24 38.300 38.300 37.886 0.414 19581
364 1 4 . 1 1 24 24 ILE H H 24 8.100 8.100 8.202 -0.102 19581
365 1 4 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.013 0.107 19581
366 1 4 . 1 1 25 25 LYS CA C 25 58.600 58.600 59.018 -0.418 19581
367 1 4 . 1 1 25 25 LYS CB C 25 32.000 32.000 32.215 -0.215 19581
368 1 4 . 1 1 25 25 LYS H H 25 8.540 8.540 8.098 0.442 19581
369 1 4 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.139 0.061 19581
370 1 4 . 1 1 26 26 LYS CA C 26 57.800 57.800 57.577 0.223 19581
371 1 4 . 1 1 26 26 LYS CB C 26 32.400 32.400 33.082 -0.682 19581
372 1 4 . 1 1 26 26 LYS H H 26 8.350 8.350 7.882 0.468 19581
373 1 5 . 1 1 2 2 LYS HA H 2 4.210 4.210 4.058 0.152 19581
374 1 5 . 1 1 2 2 LYS CA C 2 58.800 58.800 59.301 -0.501 19581
375 1 5 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.144 0.956 19581
376 1 5 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.120 -0.029 19581
377 1 5 . 1 1 3 3 LYS CA C 3 59.100 59.100 58.873 0.227 19581
378 1 5 . 1 1 3 3 LYS CB C 3 32.700 32.700 31.671 1.030 19581
379 1 5 . 1 1 3 3 LYS H H 3 8.170 8.170 8.342 -0.172 19581
380 1 5 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.078 0.212 19581
381 1 5 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.611 -0.211 19581
382 1 5 . 1 1 4 4 LEU CB C 4 42.300 42.300 41.362 0.938 19581
383 1 5 . 1 1 4 4 LEU H H 4 7.210 7.210 7.875 -0.665 19581
384 1 5 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.019 0.271 19581
385 1 5 . 1 1 5 5 PHE CA C 5 61.300 61.300 62.303 -1.003 19581
386 1 5 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.144 -0.244 19581
387 1 5 . 1 1 5 5 PHE H H 5 7.670 7.670 8.417 -0.747 19581
388 1 5 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.470 0.250 19581
389 1 5 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.473 -1.073 19581
390 1 5 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.811 0.189 19581
391 1 5 . 1 1 6 6 ILE H H 6 7.790 7.790 8.413 -0.623 19581
392 1 5 . 1 1 7 7 MET HA H 7 4.170 4.170 4.015 0.155 19581
393 1 5 . 1 1 7 7 MET CA C 7 58.700 58.700 59.432 -0.732 19581
394 1 5 . 1 1 7 7 MET CB C 7 32.500 32.500 32.522 -0.022 19581
395 1 5 . 1 1 7 7 MET H H 7 7.800 7.800 7.613 0.187 19581
396 1 5 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.668 0.162 19581
397 1 5 . 1 1 8 8 ILE CA C 8 65.100 65.100 65.085 0.015 19581
398 1 5 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.698 0.702 19581
399 1 5 . 1 1 8 8 ILE H H 8 8.190 8.190 7.904 0.286 19581
400 1 5 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.659 -0.019 19581
401 1 5 . 1 1 9 9 VAL CA C 9 67.000 67.000 65.445 1.555 19581
402 1 5 . 1 1 9 9 VAL CB C 9 31.500 31.500 30.970 0.530 19581
403 1 5 . 1 1 9 9 VAL H H 9 8.350 8.350 7.973 0.377 19581
404 1 5 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.538 -0.638 19581
405 1 5 . 1 1 10 10 GLY H H 10 8.370 8.370 8.462 -0.092 19581
406 1 5 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.767 -0.467 19581
407 1 5 . 1 1 11 11 GLY H H 11 7.800 7.800 7.466 0.334 19581
408 1 5 . 1 1 12 12 LEU HA H 12 4.260 4.260 3.980 0.280 19581
409 1 5 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.482 0.318 19581
410 1 5 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.417 0.682 19581
411 1 5 . 1 1 12 12 LEU H H 12 8.070 8.070 7.435 0.635 19581
412 1 5 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.660 0.040 19581
413 1 5 . 1 1 13 13 VAL CA C 13 66.700 66.700 66.537 0.163 19581
414 1 5 . 1 1 13 13 VAL CB C 13 31.900 31.900 31.285 0.615 19581
415 1 5 . 1 1 13 13 VAL H H 13 8.450 8.450 8.132 0.318 19581
416 1 5 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.163 -0.163 19581
417 1 5 . 1 1 14 14 GLY H H 14 7.900 7.900 8.289 -0.389 19581
418 1 5 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.114 0.006 19581
419 1 5 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.445 0.255 19581
420 1 5 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.223 0.777 19581
421 1 5 . 1 1 15 15 LEU H H 15 7.800 7.800 8.388 -0.588 19581
422 1 5 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.075 0.035 19581
423 1 5 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.606 -0.406 19581
424 1 5 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.903 -0.503 19581
425 1 5 . 1 1 16 16 ARG H H 16 7.750 7.750 7.633 0.117 19581
426 1 5 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.798 0.072 19581
427 1 5 . 1 1 17 17 ILE CA C 17 65.000 65.000 64.956 0.044 19581
428 1 5 . 1 1 17 17 ILE CB C 17 37.900 37.900 37.849 0.051 19581
429 1 5 . 1 1 17 17 ILE H H 17 7.910 7.910 7.518 0.392 19581
430 1 5 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.638 -0.078 19581
431 1 5 . 1 1 18 18 VAL CA C 18 67.500 67.500 66.685 0.815 19581
432 1 5 . 1 1 18 18 VAL CB C 18 31.600 31.600 31.334 0.266 19581
433 1 5 . 1 1 18 18 VAL H H 18 8.030 8.030 7.783 0.247 19581
434 1 5 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.031 0.309 19581
435 1 5 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.674 -0.674 19581
436 1 5 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.704 -0.304 19581
437 1 5 . 1 1 19 19 PHE H H 19 8.370 8.370 8.754 -0.384 19581
438 1 5 . 1 1 20 20 ALA HA H 20 4.150 4.150 3.817 0.333 19581
439 1 5 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.272 0.628 19581
440 1 5 . 1 1 20 20 ALA CB C 20 17.400 17.400 18.023 -0.623 19581
441 1 5 . 1 1 20 20 ALA H H 20 8.190 8.190 7.872 0.318 19581
442 1 5 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.502 0.128 19581
443 1 5 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.513 0.787 19581
444 1 5 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.625 0.075 19581
445 1 5 . 1 1 21 21 VAL H H 21 8.690 8.690 7.728 0.962 19581
446 1 5 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.802 0.248 19581
447 1 5 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.300 0.100 19581
448 1 5 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.520 0.180 19581
449 1 5 . 1 1 22 22 LEU H H 22 8.910 8.910 8.378 0.532 19581
450 1 5 . 1 1 23 23 SER HA H 23 4.130 4.130 3.941 0.189 19581
451 1 5 . 1 1 23 23 SER CA C 23 62.500 62.500 61.342 1.158 19581
452 1 5 . 1 1 23 23 SER CB C 23 62.700 62.700 62.886 -0.186 19581
453 1 5 . 1 1 23 23 SER H H 23 8.070 8.070 7.914 0.156 19581
454 1 5 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.769 0.061 19581
455 1 5 . 1 1 24 24 ILE CA C 24 64.900 64.900 64.018 0.882 19581
456 1 5 . 1 1 24 24 ILE CB C 24 38.300 38.300 37.985 0.315 19581
457 1 5 . 1 1 24 24 ILE H H 24 8.100 8.100 8.026 0.074 19581
458 1 5 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.038 0.082 19581
459 1 5 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.408 0.192 19581
460 1 5 . 1 1 25 25 LYS CB C 25 32.000 32.000 32.307 -0.307 19581
461 1 5 . 1 1 25 25 LYS H H 25 8.540 8.540 7.886 0.654 19581
462 1 5 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.159 0.041 19581
463 1 5 . 1 1 26 26 LYS CA C 26 57.800 57.800 57.550 0.250 19581
464 1 5 . 1 1 26 26 LYS CB C 26 32.400 32.400 32.951 -0.551 19581
465 1 5 . 1 1 26 26 LYS H H 26 8.350 8.350 7.746 0.604 19581
466 1 6 . 1 1 2 2 LYS HA H 2 4.210 4.210 4.057 0.153 19581
467 1 6 . 1 1 2 2 LYS CA C 2 58.800 58.800 59.389 -0.589 19581
468 1 6 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.087 1.014 19581
469 1 6 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.055 0.035 19581
470 1 6 . 1 1 3 3 LYS CA C 3 59.100 59.100 58.856 0.243 19581
471 1 6 . 1 1 3 3 LYS CB C 3 32.700 32.700 31.778 0.922 19581
472 1 6 . 1 1 3 3 LYS H H 3 8.170 8.170 8.168 0.002 19581
473 1 6 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.136 0.154 19581
474 1 6 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.341 0.059 19581
475 1 6 . 1 1 4 4 LEU CB C 4 42.300 42.300 40.881 1.419 19581
476 1 6 . 1 1 4 4 LEU H H 4 7.210 7.210 8.152 -0.942 19581
477 1 6 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.149 0.141 19581
478 1 6 . 1 1 5 5 PHE CA C 5 61.300 61.300 61.936 -0.636 19581
479 1 6 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.256 -0.356 19581
480 1 6 . 1 1 5 5 PHE H H 5 7.670 7.670 7.620 0.050 19581
481 1 6 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.670 0.050 19581
482 1 6 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.436 -1.036 19581
483 1 6 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.914 0.086 19581
484 1 6 . 1 1 6 6 ILE H H 6 7.790 7.790 8.083 -0.293 19581
485 1 6 . 1 1 7 7 MET HA H 7 4.170 4.170 4.102 0.068 19581
486 1 6 . 1 1 7 7 MET CA C 7 58.700 58.700 58.523 0.177 19581
487 1 6 . 1 1 7 7 MET CB C 7 32.500 32.500 31.765 0.735 19581
488 1 6 . 1 1 7 7 MET H H 7 7.800 7.800 8.006 -0.206 19581
489 1 6 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.780 0.050 19581
490 1 6 . 1 1 8 8 ILE CA C 8 65.100 65.100 64.554 0.546 19581
491 1 6 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.849 0.551 19581
492 1 6 . 1 1 8 8 ILE H H 8 8.190 8.190 7.498 0.692 19581
493 1 6 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.812 -0.172 19581
494 1 6 . 1 1 9 9 VAL CA C 9 67.000 67.000 65.416 1.584 19581
495 1 6 . 1 1 9 9 VAL CB C 9 31.500 31.500 30.660 0.840 19581
496 1 6 . 1 1 9 9 VAL H H 9 8.350 8.350 7.480 0.870 19581
497 1 6 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.072 -0.172 19581
498 1 6 . 1 1 10 10 GLY H H 10 8.370 8.370 8.506 -0.136 19581
499 1 6 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.690 -0.390 19581
500 1 6 . 1 1 11 11 GLY H H 11 7.800 7.800 7.614 0.186 19581
501 1 6 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.048 0.212 19581
502 1 6 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.466 0.334 19581
503 1 6 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.422 0.677 19581
504 1 6 . 1 1 12 12 LEU H H 12 8.070 8.070 7.503 0.567 19581
505 1 6 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.671 0.029 19581
506 1 6 . 1 1 13 13 VAL CA C 13 66.700 66.700 66.750 -0.050 19581
507 1 6 . 1 1 13 13 VAL CB C 13 31.900 31.900 31.209 0.691 19581
508 1 6 . 1 1 13 13 VAL H H 13 8.450 8.450 7.870 0.580 19581
509 1 6 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.227 -0.227 19581
510 1 6 . 1 1 14 14 GLY H H 14 7.900 7.900 8.098 -0.198 19581
511 1 6 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.023 0.097 19581
512 1 6 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.577 0.123 19581
513 1 6 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.218 0.782 19581
514 1 6 . 1 1 15 15 LEU H H 15 7.800 7.800 8.189 -0.389 19581
515 1 6 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.050 0.060 19581
516 1 6 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.819 -0.619 19581
517 1 6 . 1 1 16 16 ARG CB C 16 29.400 29.400 30.027 -0.627 19581
518 1 6 . 1 1 16 16 ARG H H 16 7.750 7.750 7.546 0.204 19581
519 1 6 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.743 0.127 19581
520 1 6 . 1 1 17 17 ILE CA C 17 65.000 65.000 65.279 -0.279 19581
521 1 6 . 1 1 17 17 ILE CB C 17 37.900 37.900 37.865 0.035 19581
522 1 6 . 1 1 17 17 ILE H H 17 7.910 7.910 7.500 0.410 19581
523 1 6 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.639 -0.079 19581
524 1 6 . 1 1 18 18 VAL CA C 18 67.500 67.500 66.888 0.612 19581
525 1 6 . 1 1 18 18 VAL CB C 18 31.600 31.600 31.411 0.189 19581
526 1 6 . 1 1 18 18 VAL H H 18 8.030 8.030 8.253 -0.223 19581
527 1 6 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.046 0.294 19581
528 1 6 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.518 -0.518 19581
529 1 6 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.786 -0.386 19581
530 1 6 . 1 1 19 19 PHE H H 19 8.370 8.370 8.679 -0.309 19581
531 1 6 . 1 1 20 20 ALA HA H 20 4.150 4.150 3.814 0.336 19581
532 1 6 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.279 0.621 19581
533 1 6 . 1 1 20 20 ALA CB C 20 17.400 17.400 18.043 -0.643 19581
534 1 6 . 1 1 20 20 ALA H H 20 8.190 8.190 8.056 0.134 19581
535 1 6 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.644 -0.014 19581
536 1 6 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.462 0.838 19581
537 1 6 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.078 0.622 19581
538 1 6 . 1 1 21 21 VAL H H 21 8.690 8.690 7.670 1.020 19581
539 1 6 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.791 0.259 19581
540 1 6 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.394 0.006 19581
541 1 6 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.531 0.169 19581
542 1 6 . 1 1 22 22 LEU H H 22 8.910 8.910 8.472 0.438 19581
543 1 6 . 1 1 23 23 SER HA H 23 4.130 4.130 3.949 0.181 19581
544 1 6 . 1 1 23 23 SER CA C 23 62.500 62.500 62.344 0.156 19581
545 1 6 . 1 1 23 23 SER CB C 23 62.700 62.700 62.741 -0.041 19581
546 1 6 . 1 1 23 23 SER H H 23 8.070 8.070 7.978 0.092 19581
547 1 6 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.742 0.088 19581
548 1 6 . 1 1 24 24 ILE CA C 24 64.900 64.900 63.919 0.981 19581
549 1 6 . 1 1 24 24 ILE CB C 24 38.300 38.300 38.022 0.278 19581
550 1 6 . 1 1 24 24 ILE H H 24 8.100 8.100 7.872 0.228 19581
551 1 6 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.059 0.061 19581
552 1 6 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.717 -0.117 19581
553 1 6 . 1 1 25 25 LYS CB C 25 32.000 32.000 32.408 -0.408 19581
554 1 6 . 1 1 25 25 LYS H H 25 8.540 8.540 7.895 0.645 19581
555 1 6 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.215 -0.015 19581
556 1 6 . 1 1 26 26 LYS CA C 26 57.800 57.800 56.339 1.461 19581
557 1 6 . 1 1 26 26 LYS CB C 26 32.400 32.400 32.538 -0.138 19581
558 1 6 . 1 1 26 26 LYS H H 26 8.350 8.350 7.567 0.783 19581
559 1 7 . 1 1 2 2 LYS HA H 2 4.210 4.210 4.133 0.077 19581
560 1 7 . 1 1 2 2 LYS CA C 2 58.800 58.800 58.759 0.041 19581
561 1 7 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.454 0.646 19581
562 1 7 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.096 -0.006 19581
563 1 7 . 1 1 3 3 LYS CA C 3 59.100 59.100 59.213 -0.113 19581
564 1 7 . 1 1 3 3 LYS CB C 3 32.700 32.700 31.997 0.703 19581
565 1 7 . 1 1 3 3 LYS H H 3 8.170 8.170 8.397 -0.227 19581
566 1 7 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.108 0.182 19581
567 1 7 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.535 -0.135 19581
568 1 7 . 1 1 4 4 LEU CB C 4 42.300 42.300 41.006 1.294 19581
569 1 7 . 1 1 4 4 LEU H H 4 7.210 7.210 7.553 -0.343 19581
570 1 7 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.058 0.232 19581
571 1 7 . 1 1 5 5 PHE CA C 5 61.300 61.300 62.237 -0.937 19581
572 1 7 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.145 -0.245 19581
573 1 7 . 1 1 5 5 PHE H H 5 7.670 7.670 7.776 -0.106 19581
574 1 7 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.480 0.240 19581
575 1 7 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.563 -1.163 19581
576 1 7 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.810 0.190 19581
577 1 7 . 1 1 6 6 ILE H H 6 7.790 7.790 8.614 -0.824 19581
578 1 7 . 1 1 7 7 MET HA H 7 4.170 4.170 4.003 0.167 19581
579 1 7 . 1 1 7 7 MET CA C 7 58.700 58.700 59.362 -0.662 19581
580 1 7 . 1 1 7 7 MET CB C 7 32.500 32.500 32.197 0.303 19581
581 1 7 . 1 1 7 7 MET H H 7 7.800 7.800 7.775 0.025 19581
582 1 7 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.663 0.167 19581
583 1 7 . 1 1 8 8 ILE CA C 8 65.100 65.100 65.103 -0.003 19581
584 1 7 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.446 0.954 19581
585 1 7 . 1 1 8 8 ILE H H 8 8.190 8.190 7.735 0.455 19581
586 1 7 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.665 -0.025 19581
587 1 7 . 1 1 9 9 VAL CA C 9 67.000 67.000 65.546 1.454 19581
588 1 7 . 1 1 9 9 VAL CB C 9 31.500 31.500 30.124 1.376 19581
589 1 7 . 1 1 9 9 VAL H H 9 8.350 8.350 7.790 0.560 19581
590 1 7 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.259 -0.359 19581
591 1 7 . 1 1 10 10 GLY H H 10 8.370 8.370 8.469 -0.099 19581
592 1 7 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.663 -0.363 19581
593 1 7 . 1 1 11 11 GLY H H 11 7.800 7.800 7.833 -0.033 19581
594 1 7 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.085 0.175 19581
595 1 7 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.492 0.308 19581
596 1 7 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.493 0.607 19581
597 1 7 . 1 1 12 12 LEU H H 12 8.070 8.070 7.430 0.640 19581
598 1 7 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.730 -0.030 19581
599 1 7 . 1 1 13 13 VAL CA C 13 66.700 66.700 65.828 0.872 19581
600 1 7 . 1 1 13 13 VAL CB C 13 31.900 31.900 30.722 1.178 19581
601 1 7 . 1 1 13 13 VAL H H 13 8.450 8.450 8.135 0.315 19581
602 1 7 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.403 -0.403 19581
603 1 7 . 1 1 14 14 GLY H H 14 7.900 7.900 8.220 -0.320 19581
604 1 7 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.092 0.028 19581
605 1 7 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.492 0.208 19581
606 1 7 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.363 0.637 19581
607 1 7 . 1 1 15 15 LEU H H 15 7.800 7.800 7.515 0.285 19581
608 1 7 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.122 -0.012 19581
609 1 7 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.736 -0.536 19581
610 1 7 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.915 -0.515 19581
611 1 7 . 1 1 16 16 ARG H H 16 7.750 7.750 7.610 0.140 19581
612 1 7 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.809 0.061 19581
613 1 7 . 1 1 17 17 ILE CA C 17 65.000 65.000 64.841 0.159 19581
614 1 7 . 1 1 17 17 ILE CB C 17 37.900 37.900 37.811 0.089 19581
615 1 7 . 1 1 17 17 ILE H H 17 7.910 7.910 7.410 0.500 19581
616 1 7 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.504 0.056 19581
617 1 7 . 1 1 18 18 VAL CA C 18 67.500 67.500 66.778 0.722 19581
618 1 7 . 1 1 18 18 VAL CB C 18 31.600 31.600 31.472 0.128 19581
619 1 7 . 1 1 18 18 VAL H H 18 8.030 8.030 8.189 -0.159 19581
620 1 7 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.082 0.258 19581
621 1 7 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.481 -0.481 19581
622 1 7 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.463 -0.063 19581
623 1 7 . 1 1 19 19 PHE H H 19 8.370 8.370 8.190 0.180 19581
624 1 7 . 1 1 20 20 ALA HA H 20 4.150 4.150 4.073 0.077 19581
625 1 7 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.463 0.437 19581
626 1 7 . 1 1 20 20 ALA CB C 20 17.400 17.400 18.135 -0.735 19581
627 1 7 . 1 1 20 20 ALA H H 20 8.190 8.190 7.769 0.421 19581
628 1 7 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.694 -0.064 19581
629 1 7 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.497 0.803 19581
630 1 7 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.074 0.626 19581
631 1 7 . 1 1 21 21 VAL H H 21 8.690 8.690 7.857 0.833 19581
632 1 7 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.867 0.183 19581
633 1 7 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.365 0.035 19581
634 1 7 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.396 0.304 19581
635 1 7 . 1 1 22 22 LEU H H 22 8.910 8.910 8.514 0.396 19581
636 1 7 . 1 1 23 23 SER HA H 23 4.130 4.130 4.179 -0.049 19581
637 1 7 . 1 1 23 23 SER CA C 23 62.500 62.500 61.628 0.872 19581
638 1 7 . 1 1 23 23 SER CB C 23 62.700 62.700 63.301 -0.601 19581
639 1 7 . 1 1 23 23 SER H H 23 8.070 8.070 8.188 -0.118 19581
640 1 7 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.855 -0.025 19581
641 1 7 . 1 1 24 24 ILE CA C 24 64.900 64.900 63.778 1.122 19581
642 1 7 . 1 1 24 24 ILE CB C 24 38.300 38.300 38.193 0.107 19581
643 1 7 . 1 1 24 24 ILE H H 24 8.100 8.100 8.130 -0.030 19581
644 1 7 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.079 0.041 19581
645 1 7 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.248 0.352 19581
646 1 7 . 1 1 25 25 LYS CB C 25 32.000 32.000 32.371 -0.371 19581
647 1 7 . 1 1 25 25 LYS H H 25 8.540 8.540 7.862 0.678 19581
648 1 7 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.203 -0.003 19581
649 1 7 . 1 1 26 26 LYS CA C 26 57.800 57.800 57.422 0.378 19581
650 1 7 . 1 1 26 26 LYS CB C 26 32.400 32.400 33.307 -0.907 19581
651 1 7 . 1 1 26 26 LYS H H 26 8.350 8.350 7.691 0.659 19581
652 1 8 . 1 1 2 2 LYS HA H 2 4.210 4.210 4.122 0.088 19581
653 1 8 . 1 1 2 2 LYS CA C 2 58.800 58.800 58.548 0.252 19581
654 1 8 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.514 0.586 19581
655 1 8 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.069 0.021 19581
656 1 8 . 1 1 3 3 LYS CA C 3 59.100 59.100 59.261 -0.162 19581
657 1 8 . 1 1 3 3 LYS CB C 3 32.700 32.700 32.000 0.701 19581
658 1 8 . 1 1 3 3 LYS H H 3 8.170 8.170 8.378 -0.208 19581
659 1 8 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.048 0.242 19581
660 1 8 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.706 -0.306 19581
661 1 8 . 1 1 4 4 LEU CB C 4 42.300 42.300 41.743 0.557 19581
662 1 8 . 1 1 4 4 LEU H H 4 7.210 7.210 7.581 -0.371 19581
663 1 8 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.049 0.241 19581
664 1 8 . 1 1 5 5 PHE CA C 5 61.300 61.300 62.048 -0.748 19581
665 1 8 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.185 -0.285 19581
666 1 8 . 1 1 5 5 PHE H H 5 7.670 7.670 7.541 0.129 19581
667 1 8 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.489 0.231 19581
668 1 8 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.543 -1.143 19581
669 1 8 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.792 0.208 19581
670 1 8 . 1 1 6 6 ILE H H 6 7.790 7.790 8.802 -1.012 19581
671 1 8 . 1 1 7 7 MET HA H 7 4.170 4.170 4.089 0.081 19581
672 1 8 . 1 1 7 7 MET CA C 7 58.700 58.700 58.064 0.636 19581
673 1 8 . 1 1 7 7 MET CB C 7 32.500 32.500 31.718 0.782 19581
674 1 8 . 1 1 7 7 MET H H 7 7.800 7.800 7.790 0.010 19581
675 1 8 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.714 0.116 19581
676 1 8 . 1 1 8 8 ILE CA C 8 65.100 65.100 64.981 0.119 19581
677 1 8 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.640 0.760 19581
678 1 8 . 1 1 8 8 ILE H H 8 8.190 8.190 7.671 0.519 19581
679 1 8 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.702 -0.062 19581
680 1 8 . 1 1 9 9 VAL CA C 9 67.000 67.000 65.116 1.884 19581
681 1 8 . 1 1 9 9 VAL CB C 9 31.500 31.500 30.149 1.351 19581
682 1 8 . 1 1 9 9 VAL H H 9 8.350 8.350 7.925 0.425 19581
683 1 8 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.469 -0.569 19581
684 1 8 . 1 1 10 10 GLY H H 10 8.370 8.370 8.531 -0.161 19581
685 1 8 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.436 -0.136 19581
686 1 8 . 1 1 11 11 GLY H H 11 7.800 7.800 7.364 0.436 19581
687 1 8 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.054 0.206 19581
688 1 8 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.451 0.349 19581
689 1 8 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.514 0.586 19581
690 1 8 . 1 1 12 12 LEU H H 12 8.070 8.070 7.361 0.709 19581
691 1 8 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.639 0.061 19581
692 1 8 . 1 1 13 13 VAL CA C 13 66.700 66.700 66.333 0.367 19581
693 1 8 . 1 1 13 13 VAL CB C 13 31.900 31.900 31.441 0.459 19581
694 1 8 . 1 1 13 13 VAL H H 13 8.450 8.450 8.506 -0.056 19581
695 1 8 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.258 -0.258 19581
696 1 8 . 1 1 14 14 GLY H H 14 7.900 7.900 7.622 0.278 19581
697 1 8 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.052 0.068 19581
698 1 8 . 1 1 15 15 LEU CA C 15 57.700 57.700 58.017 -0.317 19581
699 1 8 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.207 0.793 19581
700 1 8 . 1 1 15 15 LEU H H 15 7.800 7.800 8.324 -0.524 19581
701 1 8 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.147 -0.037 19581
702 1 8 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.367 -0.167 19581
703 1 8 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.543 -0.143 19581
704 1 8 . 1 1 16 16 ARG H H 16 7.750 7.750 7.626 0.124 19581
705 1 8 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.773 0.097 19581
706 1 8 . 1 1 17 17 ILE CA C 17 65.000 65.000 65.000 0.000 19581
707 1 8 . 1 1 17 17 ILE CB C 17 37.900 37.900 37.691 0.209 19581
708 1 8 . 1 1 17 17 ILE H H 17 7.910 7.910 7.293 0.617 19581
709 1 8 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.587 -0.027 19581
710 1 8 . 1 1 18 18 VAL CA C 18 67.500 67.500 67.075 0.425 19581
711 1 8 . 1 1 18 18 VAL CB C 18 31.600 31.600 31.210 0.390 19581
712 1 8 . 1 1 18 18 VAL H H 18 8.030 8.030 8.388 -0.358 19581
713 1 8 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.077 0.263 19581
714 1 8 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.368 -0.368 19581
715 1 8 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.446 -0.046 19581
716 1 8 . 1 1 19 19 PHE H H 19 8.370 8.370 8.179 0.191 19581
717 1 8 . 1 1 20 20 ALA HA H 20 4.150 4.150 4.069 0.081 19581
718 1 8 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.477 0.423 19581
719 1 8 . 1 1 20 20 ALA CB C 20 17.400 17.400 18.180 -0.780 19581
720 1 8 . 1 1 20 20 ALA H H 20 8.190 8.190 8.078 0.112 19581
721 1 8 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.682 -0.052 19581
722 1 8 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.567 0.733 19581
723 1 8 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.032 0.668 19581
724 1 8 . 1 1 21 21 VAL H H 21 8.690 8.690 8.190 0.500 19581
725 1 8 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.843 0.207 19581
726 1 8 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.452 -0.051 19581
727 1 8 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.500 0.200 19581
728 1 8 . 1 1 22 22 LEU H H 22 8.910 8.910 8.423 0.487 19581
729 1 8 . 1 1 23 23 SER HA H 23 4.130 4.130 4.188 -0.058 19581
730 1 8 . 1 1 23 23 SER CA C 23 62.500 62.500 61.532 0.968 19581
731 1 8 . 1 1 23 23 SER CB C 23 62.700 62.700 63.296 -0.596 19581
732 1 8 . 1 1 23 23 SER H H 23 8.070 8.070 8.112 -0.042 19581
733 1 8 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.841 -0.011 19581
734 1 8 . 1 1 24 24 ILE CA C 24 64.900 64.900 63.985 0.915 19581
735 1 8 . 1 1 24 24 ILE CB C 24 38.300 38.300 38.037 0.263 19581
736 1 8 . 1 1 24 24 ILE H H 24 8.100 8.100 8.191 -0.091 19581
737 1 8 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.067 0.053 19581
738 1 8 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.688 -0.088 19581
739 1 8 . 1 1 25 25 LYS CB C 25 32.000 32.000 32.339 -0.339 19581
740 1 8 . 1 1 25 25 LYS H H 25 8.540 8.540 7.968 0.572 19581
741 1 8 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.234 -0.034 19581
742 1 8 . 1 1 26 26 LYS CA C 26 57.800 57.800 56.212 1.588 19581
743 1 8 . 1 1 26 26 LYS CB C 26 32.400 32.400 32.847 -0.447 19581
744 1 8 . 1 1 26 26 LYS H H 26 8.350 8.350 7.615 0.735 19581
745 1 9 . 1 1 2 2 LYS HA H 2 4.210 4.210 3.965 0.245 19581
746 1 9 . 1 1 2 2 LYS CA C 2 58.800 58.800 59.168 -0.368 19581
747 1 9 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.181 0.919 19581
748 1 9 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.108 -0.018 19581
749 1 9 . 1 1 3 3 LYS CA C 3 59.100 59.100 58.821 0.279 19581
750 1 9 . 1 1 3 3 LYS CB C 3 32.700 32.700 31.896 0.804 19581
751 1 9 . 1 1 3 3 LYS H H 3 8.170 8.170 8.276 -0.106 19581
752 1 9 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.131 0.159 19581
753 1 9 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.363 0.037 19581
754 1 9 . 1 1 4 4 LEU CB C 4 42.300 42.300 40.954 1.346 19581
755 1 9 . 1 1 4 4 LEU H H 4 7.210 7.210 7.726 -0.516 19581
756 1 9 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.073 0.217 19581
757 1 9 . 1 1 5 5 PHE CA C 5 61.300 61.300 62.303 -1.003 19581
758 1 9 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.070 -0.170 19581
759 1 9 . 1 1 5 5 PHE H H 5 7.670 7.670 7.667 0.003 19581
760 1 9 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.435 0.285 19581
761 1 9 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.516 -1.116 19581
762 1 9 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.803 0.197 19581
763 1 9 . 1 1 6 6 ILE H H 6 7.790 7.790 8.614 -0.824 19581
764 1 9 . 1 1 7 7 MET HA H 7 4.170 4.170 4.032 0.138 19581
765 1 9 . 1 1 7 7 MET CA C 7 58.700 58.700 58.768 -0.068 19581
766 1 9 . 1 1 7 7 MET CB C 7 32.500 32.500 32.256 0.244 19581
767 1 9 . 1 1 7 7 MET H H 7 7.800 7.800 7.686 0.114 19581
768 1 9 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.759 0.071 19581
769 1 9 . 1 1 8 8 ILE CA C 8 65.100 65.100 64.781 0.319 19581
770 1 9 . 1 1 8 8 ILE CB C 8 38.400 38.400 38.068 0.332 19581
771 1 9 . 1 1 8 8 ILE H H 8 8.190 8.190 7.915 0.275 19581
772 1 9 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.649 -0.009 19581
773 1 9 . 1 1 9 9 VAL CA C 9 67.000 67.000 65.383 1.617 19581
774 1 9 . 1 1 9 9 VAL CB C 9 31.500 31.500 30.264 1.236 19581
775 1 9 . 1 1 9 9 VAL H H 9 8.350 8.350 8.114 0.236 19581
776 1 9 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.161 -0.261 19581
777 1 9 . 1 1 10 10 GLY H H 10 8.370 8.370 8.209 0.161 19581
778 1 9 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.304 -0.004 19581
779 1 9 . 1 1 11 11 GLY H H 11 7.800 7.800 7.545 0.255 19581
780 1 9 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.125 0.135 19581
781 1 9 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.257 0.543 19581
782 1 9 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.538 0.562 19581
783 1 9 . 1 1 12 12 LEU H H 12 8.070 8.070 7.507 0.563 19581
784 1 9 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.746 -0.046 19581
785 1 9 . 1 1 13 13 VAL CA C 13 66.700 66.700 66.161 0.539 19581
786 1 9 . 1 1 13 13 VAL CB C 13 31.900 31.900 31.626 0.274 19581
787 1 9 . 1 1 13 13 VAL H H 13 8.450 8.450 8.448 0.002 19581
788 1 9 . 1 1 14 14 GLY CA C 14 47.000 47.000 46.965 0.035 19581
789 1 9 . 1 1 14 14 GLY H H 14 7.900 7.900 7.531 0.369 19581
790 1 9 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.046 0.074 19581
791 1 9 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.027 0.673 19581
792 1 9 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.372 0.628 19581
793 1 9 . 1 1 15 15 LEU H H 15 7.800 7.800 7.615 0.185 19581
794 1 9 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.140 -0.030 19581
795 1 9 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.353 -0.153 19581
796 1 9 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.526 -0.126 19581
797 1 9 . 1 1 16 16 ARG H H 16 7.750 7.750 8.094 -0.344 19581
798 1 9 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.886 -0.016 19581
799 1 9 . 1 1 17 17 ILE CA C 17 65.000 65.000 64.715 0.285 19581
800 1 9 . 1 1 17 17 ILE CB C 17 37.900 37.900 38.172 -0.272 19581
801 1 9 . 1 1 17 17 ILE H H 17 7.910 7.910 7.630 0.280 19581
802 1 9 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.605 -0.045 19581
803 1 9 . 1 1 18 18 VAL CA C 18 67.500 67.500 66.418 1.082 19581
804 1 9 . 1 1 18 18 VAL CB C 18 31.600 31.600 30.870 0.730 19581
805 1 9 . 1 1 18 18 VAL H H 18 8.030 8.030 7.693 0.337 19581
806 1 9 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.075 0.265 19581
807 1 9 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.775 -0.775 19581
808 1 9 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.268 0.132 19581
809 1 9 . 1 1 19 19 PHE H H 19 8.370 8.370 8.858 -0.488 19581
810 1 9 . 1 1 20 20 ALA HA H 20 4.150 4.150 4.045 0.105 19581
811 1 9 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.428 0.472 19581
812 1 9 . 1 1 20 20 ALA CB C 20 17.400 17.400 18.044 -0.644 19581
813 1 9 . 1 1 20 20 ALA H H 20 8.190 8.190 7.691 0.499 19581
814 1 9 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.679 -0.049 19581
815 1 9 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.786 0.514 19581
816 1 9 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.537 0.164 19581
817 1 9 . 1 1 21 21 VAL H H 21 8.690 8.690 7.847 0.843 19581
818 1 9 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.858 0.192 19581
819 1 9 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.281 0.119 19581
820 1 9 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.495 0.205 19581
821 1 9 . 1 1 22 22 LEU H H 22 8.910 8.910 8.483 0.427 19581
822 1 9 . 1 1 23 23 SER HA H 23 4.130 4.130 4.238 -0.108 19581
823 1 9 . 1 1 23 23 SER CA C 23 62.500 62.500 62.009 0.491 19581
824 1 9 . 1 1 23 23 SER CB C 23 62.700 62.700 63.233 -0.533 19581
825 1 9 . 1 1 23 23 SER H H 23 8.070 8.070 8.288 -0.218 19581
826 1 9 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.836 -0.006 19581
827 1 9 . 1 1 24 24 ILE CA C 24 64.900 64.900 64.136 0.764 19581
828 1 9 . 1 1 24 24 ILE CB C 24 38.300 38.300 37.961 0.339 19581
829 1 9 . 1 1 24 24 ILE H H 24 8.100 8.100 8.392 -0.292 19581
830 1 9 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.043 0.077 19581
831 1 9 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.759 -0.159 19581
832 1 9 . 1 1 25 25 LYS CB C 25 32.000 32.000 31.988 0.011 19581
833 1 9 . 1 1 25 25 LYS H H 25 8.540 8.540 8.069 0.471 19581
834 1 9 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.179 0.021 19581
835 1 9 . 1 1 26 26 LYS CA C 26 57.800 57.800 57.352 0.448 19581
836 1 9 . 1 1 26 26 LYS CB C 26 32.400 32.400 33.166 -0.766 19581
837 1 9 . 1 1 26 26 LYS H H 26 8.350 8.350 7.663 0.687 19581
838 1 10 . 1 1 2 2 LYS HA H 2 4.210 4.210 4.046 0.164 19581
839 1 10 . 1 1 2 2 LYS CA C 2 58.800 58.800 59.163 -0.362 19581
840 1 10 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.582 0.518 19581
841 1 10 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.114 -0.024 19581
842 1 10 . 1 1 3 3 LYS CA C 3 59.100 59.100 59.168 -0.068 19581
843 1 10 . 1 1 3 3 LYS CB C 3 32.700 32.700 32.039 0.661 19581
844 1 10 . 1 1 3 3 LYS H H 3 8.170 8.170 8.447 -0.277 19581
845 1 10 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.140 0.150 19581
846 1 10 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.597 -0.197 19581
847 1 10 . 1 1 4 4 LEU CB C 4 42.300 42.300 40.906 1.394 19581
848 1 10 . 1 1 4 4 LEU H H 4 7.210 7.210 7.906 -0.696 19581
849 1 10 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.068 0.222 19581
850 1 10 . 1 1 5 5 PHE CA C 5 61.300 61.300 62.338 -1.038 19581
851 1 10 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.120 -0.220 19581
852 1 10 . 1 1 5 5 PHE H H 5 7.670 7.670 8.045 -0.375 19581
853 1 10 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.446 0.274 19581
854 1 10 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.523 -1.123 19581
855 1 10 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.781 0.219 19581
856 1 10 . 1 1 6 6 ILE H H 6 7.790 7.790 8.769 -0.979 19581
857 1 10 . 1 1 7 7 MET HA H 7 4.170 4.170 4.037 0.133 19581
858 1 10 . 1 1 7 7 MET CA C 7 58.700 58.700 58.568 0.132 19581
859 1 10 . 1 1 7 7 MET CB C 7 32.500 32.500 31.992 0.508 19581
860 1 10 . 1 1 7 7 MET H H 7 7.800 7.800 7.793 0.007 19581
861 1 10 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.738 0.092 19581
862 1 10 . 1 1 8 8 ILE CA C 8 65.100 65.100 64.996 0.104 19581
863 1 10 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.809 0.591 19581
864 1 10 . 1 1 8 8 ILE H H 8 8.190 8.190 7.793 0.397 19581
865 1 10 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.710 -0.070 19581
866 1 10 . 1 1 9 9 VAL CA C 9 67.000 67.000 65.135 1.865 19581
867 1 10 . 1 1 9 9 VAL CB C 9 31.500 31.500 30.206 1.294 19581
868 1 10 . 1 1 9 9 VAL H H 9 8.350 8.350 7.995 0.355 19581
869 1 10 . 1 1 10 10 GLY CA C 10 46.900 46.900 46.812 0.088 19581
870 1 10 . 1 1 10 10 GLY H H 10 8.370 8.370 8.455 -0.085 19581
871 1 10 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.397 -0.097 19581
872 1 10 . 1 1 11 11 GLY H H 11 7.800 7.800 7.394 0.406 19581
873 1 10 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.044 0.216 19581
874 1 10 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.541 0.258 19581
875 1 10 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.449 0.651 19581
876 1 10 . 1 1 12 12 LEU H H 12 8.070 8.070 7.428 0.642 19581
877 1 10 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.774 -0.074 19581
878 1 10 . 1 1 13 13 VAL CA C 13 66.700 66.700 66.016 0.684 19581
879 1 10 . 1 1 13 13 VAL CB C 13 31.900 31.900 31.166 0.734 19581
880 1 10 . 1 1 13 13 VAL H H 13 8.450 8.450 7.862 0.588 19581
881 1 10 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.224 -0.224 19581
882 1 10 . 1 1 14 14 GLY H H 14 7.900 7.900 7.995 -0.095 19581
883 1 10 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.056 0.064 19581
884 1 10 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.682 0.018 19581
885 1 10 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.410 0.590 19581
886 1 10 . 1 1 15 15 LEU H H 15 7.800 7.800 7.507 0.293 19581
887 1 10 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.105 0.005 19581
888 1 10 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.532 -0.332 19581
889 1 10 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.885 -0.485 19581
890 1 10 . 1 1 16 16 ARG H H 16 7.750 7.750 7.697 0.053 19581
891 1 10 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.839 0.031 19581
892 1 10 . 1 1 17 17 ILE CA C 17 65.000 65.000 64.756 0.244 19581
893 1 10 . 1 1 17 17 ILE CB C 17 37.900 37.900 37.799 0.101 19581
894 1 10 . 1 1 17 17 ILE H H 17 7.910 7.910 7.253 0.657 19581
895 1 10 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.628 -0.068 19581
896 1 10 . 1 1 18 18 VAL CA C 18 67.500 67.500 66.625 0.875 19581
897 1 10 . 1 1 18 18 VAL CB C 18 31.600 31.600 31.012 0.588 19581
898 1 10 . 1 1 18 18 VAL H H 18 8.030 8.030 8.543 -0.513 19581
899 1 10 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.103 0.237 19581
900 1 10 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.913 -0.913 19581
901 1 10 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.323 0.077 19581
902 1 10 . 1 1 19 19 PHE H H 19 8.370 8.370 8.691 -0.321 19581
903 1 10 . 1 1 20 20 ALA HA H 20 4.150 4.150 3.872 0.278 19581
904 1 10 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.070 0.830 19581
905 1 10 . 1 1 20 20 ALA CB C 20 17.400 17.400 18.046 -0.646 19581
906 1 10 . 1 1 20 20 ALA H H 20 8.190 8.190 7.652 0.538 19581
907 1 10 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.636 -0.006 19581
908 1 10 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.501 0.798 19581
909 1 10 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.031 0.669 19581
910 1 10 . 1 1 21 21 VAL H H 21 8.690 8.690 8.006 0.684 19581
911 1 10 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.851 0.199 19581
912 1 10 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.224 0.176 19581
913 1 10 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.538 0.162 19581
914 1 10 . 1 1 22 22 LEU H H 22 8.910 8.910 8.556 0.354 19581
915 1 10 . 1 1 23 23 SER HA H 23 4.130 4.130 4.043 0.087 19581
916 1 10 . 1 1 23 23 SER CA C 23 62.500 62.500 61.397 1.103 19581
917 1 10 . 1 1 23 23 SER CB C 23 62.700 62.700 62.880 -0.180 19581
918 1 10 . 1 1 23 23 SER H H 23 8.070 8.070 7.882 0.188 19581
919 1 10 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.703 0.127 19581
920 1 10 . 1 1 24 24 ILE CA C 24 64.900 64.900 64.039 0.861 19581
921 1 10 . 1 1 24 24 ILE CB C 24 38.300 38.300 37.870 0.430 19581
922 1 10 . 1 1 24 24 ILE H H 24 8.100 8.100 8.198 -0.098 19581
923 1 10 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.022 0.098 19581
924 1 10 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.780 -0.180 19581
925 1 10 . 1 1 25 25 LYS CB C 25 32.000 32.000 32.039 -0.040 19581
926 1 10 . 1 1 25 25 LYS H H 25 8.540 8.540 7.873 0.667 19581
927 1 10 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.174 0.026 19581
928 1 10 . 1 1 26 26 LYS CA C 26 57.800 57.800 57.041 0.759 19581
929 1 10 . 1 1 26 26 LYS CB C 26 32.400 32.400 33.166 -0.766 19581
930 1 10 . 1 1 26 26 LYS H H 26 8.350 8.350 7.775 0.575 19581
931 1 11 . 1 1 2 2 LYS HA H 2 4.210 4.210 4.039 0.171 19581
932 1 11 . 1 1 2 2 LYS CA C 2 58.800 58.800 58.797 0.003 19581
933 1 11 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.053 1.047 19581
934 1 11 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.129 -0.039 19581
935 1 11 . 1 1 3 3 LYS CA C 3 59.100 59.100 58.933 0.167 19581
936 1 11 . 1 1 3 3 LYS CB C 3 32.700 32.700 31.793 0.907 19581
937 1 11 . 1 1 3 3 LYS H H 3 8.170 8.170 8.204 -0.034 19581
938 1 11 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.045 0.245 19581
939 1 11 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.880 -0.480 19581
940 1 11 . 1 1 4 4 LEU CB C 4 42.300 42.300 41.676 0.624 19581
941 1 11 . 1 1 4 4 LEU H H 4 7.210 7.210 7.548 -0.338 19581
942 1 11 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.026 0.264 19581
943 1 11 . 1 1 5 5 PHE CA C 5 61.300 61.300 62.353 -1.053 19581
944 1 11 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.204 -0.304 19581
945 1 11 . 1 1 5 5 PHE H H 5 7.670 7.670 8.136 -0.466 19581
946 1 11 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.538 0.182 19581
947 1 11 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.571 -1.171 19581
948 1 11 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.847 0.153 19581
949 1 11 . 1 1 6 6 ILE H H 6 7.790 7.790 8.488 -0.698 19581
950 1 11 . 1 1 7 7 MET HA H 7 4.170 4.170 4.040 0.130 19581
951 1 11 . 1 1 7 7 MET CA C 7 58.700 58.700 59.288 -0.588 19581
952 1 11 . 1 1 7 7 MET CB C 7 32.500 32.500 32.387 0.113 19581
953 1 11 . 1 1 7 7 MET H H 7 7.800 7.800 7.553 0.247 19581
954 1 11 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.660 0.170 19581
955 1 11 . 1 1 8 8 ILE CA C 8 65.100 65.100 65.098 0.002 19581
956 1 11 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.461 0.939 19581
957 1 11 . 1 1 8 8 ILE H H 8 8.190 8.190 8.040 0.150 19581
958 1 11 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.650 -0.010 19581
959 1 11 . 1 1 9 9 VAL CA C 9 67.000 67.000 65.444 1.556 19581
960 1 11 . 1 1 9 9 VAL CB C 9 31.500 31.500 30.057 1.443 19581
961 1 11 . 1 1 9 9 VAL H H 9 8.350 8.350 7.917 0.433 19581
962 1 11 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.470 -0.570 19581
963 1 11 . 1 1 10 10 GLY H H 10 8.370 8.370 8.319 0.051 19581
964 1 11 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.502 -0.202 19581
965 1 11 . 1 1 11 11 GLY H H 11 7.800 7.800 7.538 0.262 19581
966 1 11 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.074 0.186 19581
967 1 11 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.467 0.334 19581
968 1 11 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.423 0.677 19581
969 1 11 . 1 1 12 12 LEU H H 12 8.070 8.070 7.406 0.664 19581
970 1 11 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.750 -0.050 19581
971 1 11 . 1 1 13 13 VAL CA C 13 66.700 66.700 66.091 0.608 19581
972 1 11 . 1 1 13 13 VAL CB C 13 31.900 31.900 30.819 1.081 19581
973 1 11 . 1 1 13 13 VAL H H 13 8.450 8.450 8.424 0.026 19581
974 1 11 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.196 -0.196 19581
975 1 11 . 1 1 14 14 GLY H H 14 7.900 7.900 8.419 -0.519 19581
976 1 11 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.034 0.086 19581
977 1 11 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.142 0.558 19581
978 1 11 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.488 0.512 19581
979 1 11 . 1 1 15 15 LEU H H 15 7.800 7.800 7.522 0.278 19581
980 1 11 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.159 -0.049 19581
981 1 11 . 1 1 16 16 ARG CA C 16 59.200 59.200 58.951 0.249 19581
982 1 11 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.165 0.235 19581
983 1 11 . 1 1 16 16 ARG H H 16 7.750 7.750 8.192 -0.442 19581
984 1 11 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.808 0.062 19581
985 1 11 . 1 1 17 17 ILE CA C 17 65.000 65.000 64.852 0.148 19581
986 1 11 . 1 1 17 17 ILE CB C 17 37.900 37.900 37.883 0.017 19581
987 1 11 . 1 1 17 17 ILE H H 17 7.910 7.910 7.524 0.386 19581
988 1 11 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.600 -0.040 19581
989 1 11 . 1 1 18 18 VAL CA C 18 67.500 67.500 66.840 0.660 19581
990 1 11 . 1 1 18 18 VAL CB C 18 31.600 31.600 31.245 0.354 19581
991 1 11 . 1 1 18 18 VAL H H 18 8.030 8.030 7.732 0.298 19581
992 1 11 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.063 0.277 19581
993 1 11 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.799 -0.799 19581
994 1 11 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.462 -0.062 19581
995 1 11 . 1 1 19 19 PHE H H 19 8.370 8.370 8.726 -0.356 19581
996 1 11 . 1 1 20 20 ALA HA H 20 4.150 4.150 4.168 -0.018 19581
997 1 11 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.006 0.894 19581
998 1 11 . 1 1 20 20 ALA CB C 20 17.400 17.400 18.401 -1.001 19581
999 1 11 . 1 1 20 20 ALA H H 20 8.190 8.190 7.775 0.415 19581
1000 1 11 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.740 -0.110 19581
1001 1 11 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.455 0.845 19581
1002 1 11 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.633 0.067 19581
1003 1 11 . 1 1 21 21 VAL H H 21 8.690 8.690 7.682 1.008 19581
1004 1 11 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.826 0.224 19581
1005 1 11 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.507 -0.107 19581
1006 1 11 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.310 0.390 19581
1007 1 11 . 1 1 22 22 LEU H H 22 8.910 8.910 8.491 0.419 19581
1008 1 11 . 1 1 23 23 SER HA H 23 4.130 4.130 4.161 -0.031 19581
1009 1 11 . 1 1 23 23 SER CA C 23 62.500 62.500 61.329 1.171 19581
1010 1 11 . 1 1 23 23 SER CB C 23 62.700 62.700 63.211 -0.511 19581
1011 1 11 . 1 1 23 23 SER H H 23 8.070 8.070 8.420 -0.350 19581
1012 1 11 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.869 -0.039 19581
1013 1 11 . 1 1 24 24 ILE CA C 24 64.900 64.900 63.995 0.905 19581
1014 1 11 . 1 1 24 24 ILE CB C 24 38.300 38.300 38.074 0.226 19581
1015 1 11 . 1 1 24 24 ILE H H 24 8.100 8.100 7.729 0.371 19581
1016 1 11 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.091 0.029 19581
1017 1 11 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.402 0.198 19581
1018 1 11 . 1 1 25 25 LYS CB C 25 32.000 32.000 32.174 -0.174 19581
1019 1 11 . 1 1 25 25 LYS H H 25 8.540 8.540 7.957 0.583 19581
1020 1 11 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.192 0.008 19581
1021 1 11 . 1 1 26 26 LYS CA C 26 57.800 57.800 57.208 0.592 19581
1022 1 11 . 1 1 26 26 LYS CB C 26 32.400 32.400 33.049 -0.649 19581
1023 1 11 . 1 1 26 26 LYS H H 26 8.350 8.350 7.632 0.718 19581
1024 1 12 . 1 1 2 2 LYS HA H 2 4.210 4.210 4.115 0.095 19581
1025 1 12 . 1 1 2 2 LYS CA C 2 58.800 58.800 58.596 0.204 19581
1026 1 12 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.461 0.639 19581
1027 1 12 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.082 0.008 19581
1028 1 12 . 1 1 3 3 LYS CA C 3 59.100 59.100 59.363 -0.263 19581
1029 1 12 . 1 1 3 3 LYS CB C 3 32.700 32.700 32.008 0.692 19581
1030 1 12 . 1 1 3 3 LYS H H 3 8.170 8.170 8.371 -0.201 19581
1031 1 12 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.010 0.280 19581
1032 1 12 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.331 0.069 19581
1033 1 12 . 1 1 4 4 LEU CB C 4 42.300 42.300 41.739 0.562 19581
1034 1 12 . 1 1 4 4 LEU H H 4 7.210 7.210 7.559 -0.349 19581
1035 1 12 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.086 0.204 19581
1036 1 12 . 1 1 5 5 PHE CA C 5 61.300 61.300 62.145 -0.845 19581
1037 1 12 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.356 -0.456 19581
1038 1 12 . 1 1 5 5 PHE H H 5 7.670 7.670 7.662 0.008 19581
1039 1 12 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.476 0.244 19581
1040 1 12 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.638 -1.238 19581
1041 1 12 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.815 0.186 19581
1042 1 12 . 1 1 6 6 ILE H H 6 7.790 7.790 8.715 -0.925 19581
1043 1 12 . 1 1 7 7 MET HA H 7 4.170 4.170 4.048 0.122 19581
1044 1 12 . 1 1 7 7 MET CA C 7 58.700 58.700 58.503 0.197 19581
1045 1 12 . 1 1 7 7 MET CB C 7 32.500 32.500 31.956 0.544 19581
1046 1 12 . 1 1 7 7 MET H H 7 7.800 7.800 7.664 0.136 19581
1047 1 12 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.733 0.097 19581
1048 1 12 . 1 1 8 8 ILE CA C 8 65.100 65.100 64.895 0.205 19581
1049 1 12 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.875 0.525 19581
1050 1 12 . 1 1 8 8 ILE H H 8 8.190 8.190 7.644 0.546 19581
1051 1 12 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.647 -0.007 19581
1052 1 12 . 1 1 9 9 VAL CA C 9 67.000 67.000 65.375 1.625 19581
1053 1 12 . 1 1 9 9 VAL CB C 9 31.500 31.500 30.329 1.171 19581
1054 1 12 . 1 1 9 9 VAL H H 9 8.350 8.350 7.970 0.380 19581
1055 1 12 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.275 -0.375 19581
1056 1 12 . 1 1 10 10 GLY H H 10 8.370 8.370 8.288 0.082 19581
1057 1 12 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.585 -0.285 19581
1058 1 12 . 1 1 11 11 GLY H H 11 7.800 7.800 7.625 0.175 19581
1059 1 12 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.031 0.229 19581
1060 1 12 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.561 0.239 19581
1061 1 12 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.501 0.599 19581
1062 1 12 . 1 1 12 12 LEU H H 12 8.070 8.070 7.382 0.688 19581
1063 1 12 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.702 -0.002 19581
1064 1 12 . 1 1 13 13 VAL CA C 13 66.700 66.700 66.170 0.530 19581
1065 1 12 . 1 1 13 13 VAL CB C 13 31.900 31.900 30.855 1.045 19581
1066 1 12 . 1 1 13 13 VAL H H 13 8.450 8.450 8.185 0.265 19581
1067 1 12 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.233 -0.233 19581
1068 1 12 . 1 1 14 14 GLY H H 14 7.900 7.900 7.944 -0.044 19581
1069 1 12 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.091 0.029 19581
1070 1 12 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.186 0.514 19581
1071 1 12 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.051 0.949 19581
1072 1 12 . 1 1 15 15 LEU H H 15 7.800 7.800 8.301 -0.501 19581
1073 1 12 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.100 0.010 19581
1074 1 12 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.085 0.115 19581
1075 1 12 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.724 -0.324 19581
1076 1 12 . 1 1 16 16 ARG H H 16 7.750 7.750 7.639 0.111 19581
1077 1 12 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.751 0.119 19581
1078 1 12 . 1 1 17 17 ILE CA C 17 65.000 65.000 64.990 0.010 19581
1079 1 12 . 1 1 17 17 ILE CB C 17 37.900 37.900 38.039 -0.139 19581
1080 1 12 . 1 1 17 17 ILE H H 17 7.910 7.910 7.536 0.374 19581
1081 1 12 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.541 0.019 19581
1082 1 12 . 1 1 18 18 VAL CA C 18 67.500 67.500 66.684 0.816 19581
1083 1 12 . 1 1 18 18 VAL CB C 18 31.600 31.600 31.654 -0.053 19581
1084 1 12 . 1 1 18 18 VAL H H 18 8.030 8.030 7.883 0.147 19581
1085 1 12 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.055 0.285 19581
1086 1 12 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.463 -0.463 19581
1087 1 12 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.763 -0.363 19581
1088 1 12 . 1 1 19 19 PHE H H 19 8.370 8.370 8.836 -0.466 19581
1089 1 12 . 1 1 20 20 ALA HA H 20 4.150 4.150 3.812 0.338 19581
1090 1 12 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.203 0.697 19581
1091 1 12 . 1 1 20 20 ALA CB C 20 17.400 17.400 18.021 -0.621 19581
1092 1 12 . 1 1 20 20 ALA H H 20 8.190 8.190 7.648 0.542 19581
1093 1 12 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.512 0.118 19581
1094 1 12 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.523 0.777 19581
1095 1 12 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.626 0.074 19581
1096 1 12 . 1 1 21 21 VAL H H 21 8.690 8.690 7.670 1.020 19581
1097 1 12 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.813 0.237 19581
1098 1 12 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.142 0.259 19581
1099 1 12 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.622 0.078 19581
1100 1 12 . 1 1 22 22 LEU H H 22 8.910 8.910 8.428 0.482 19581
1101 1 12 . 1 1 23 23 SER HA H 23 4.130 4.130 3.999 0.131 19581
1102 1 12 . 1 1 23 23 SER CA C 23 62.500 62.500 61.249 1.250 19581
1103 1 12 . 1 1 23 23 SER CB C 23 62.700 62.700 62.891 -0.191 19581
1104 1 12 . 1 1 23 23 SER H H 23 8.070 8.070 7.835 0.235 19581
1105 1 12 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.758 0.072 19581
1106 1 12 . 1 1 24 24 ILE CA C 24 64.900 64.900 64.065 0.835 19581
1107 1 12 . 1 1 24 24 ILE CB C 24 38.300 38.300 37.902 0.398 19581
1108 1 12 . 1 1 24 24 ILE H H 24 8.100 8.100 8.172 -0.072 19581
1109 1 12 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.048 0.072 19581
1110 1 12 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.739 -0.139 19581
1111 1 12 . 1 1 25 25 LYS CB C 25 32.000 32.000 32.122 -0.122 19581
1112 1 12 . 1 1 25 25 LYS H H 25 8.540 8.540 7.954 0.586 19581
1113 1 12 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.188 0.012 19581
1114 1 12 . 1 1 26 26 LYS CA C 26 57.800 57.800 56.846 0.954 19581
1115 1 12 . 1 1 26 26 LYS CB C 26 32.400 32.400 33.189 -0.789 19581
1116 1 12 . 1 1 26 26 LYS H H 26 8.350 8.350 7.503 0.847 19581
1117 1 13 . 1 1 2 2 LYS HA H 2 4.210 4.210 4.129 0.081 19581
1118 1 13 . 1 1 2 2 LYS CA C 2 58.800 58.800 58.712 0.088 19581
1119 1 13 . 1 1 2 2 LYS CB C 2 33.100 33.100 31.780 1.320 19581
1120 1 13 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.090 -0.000 19581
1121 1 13 . 1 1 3 3 LYS CA C 3 59.100 59.100 59.134 -0.034 19581
1122 1 13 . 1 1 3 3 LYS CB C 3 32.700 32.700 32.002 0.698 19581
1123 1 13 . 1 1 3 3 LYS H H 3 8.170 8.170 8.285 -0.115 19581
1124 1 13 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.061 0.229 19581
1125 1 13 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.278 0.122 19581
1126 1 13 . 1 1 4 4 LEU CB C 4 42.300 42.300 41.721 0.579 19581
1127 1 13 . 1 1 4 4 LEU H H 4 7.210 7.210 7.869 -0.659 19581
1128 1 13 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.073 0.217 19581
1129 1 13 . 1 1 5 5 PHE CA C 5 61.300 61.300 61.941 -0.642 19581
1130 1 13 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.197 -0.296 19581
1131 1 13 . 1 1 5 5 PHE H H 5 7.670 7.670 7.512 0.158 19581
1132 1 13 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.420 0.300 19581
1133 1 13 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.510 -1.109 19581
1134 1 13 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.725 0.275 19581
1135 1 13 . 1 1 6 6 ILE H H 6 7.790 7.790 8.322 -0.532 19581
1136 1 13 . 1 1 7 7 MET HA H 7 4.170 4.170 4.003 0.167 19581
1137 1 13 . 1 1 7 7 MET CA C 7 58.700 58.700 59.381 -0.681 19581
1138 1 13 . 1 1 7 7 MET CB C 7 32.500 32.500 32.471 0.029 19581
1139 1 13 . 1 1 7 7 MET H H 7 7.800 7.800 7.398 0.402 19581
1140 1 13 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.668 0.162 19581
1141 1 13 . 1 1 8 8 ILE CA C 8 65.100 65.100 65.010 0.090 19581
1142 1 13 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.707 0.693 19581
1143 1 13 . 1 1 8 8 ILE H H 8 8.190 8.190 7.821 0.369 19581
1144 1 13 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.629 0.011 19581
1145 1 13 . 1 1 9 9 VAL CA C 9 67.000 67.000 65.507 1.493 19581
1146 1 13 . 1 1 9 9 VAL CB C 9 31.500 31.500 30.508 0.992 19581
1147 1 13 . 1 1 9 9 VAL H H 9 8.350 8.350 7.935 0.415 19581
1148 1 13 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.340 -0.440 19581
1149 1 13 . 1 1 10 10 GLY H H 10 8.370 8.370 8.307 0.063 19581
1150 1 13 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.682 -0.382 19581
1151 1 13 . 1 1 11 11 GLY H H 11 7.800 7.800 7.488 0.312 19581
1152 1 13 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.009 0.251 19581
1153 1 13 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.443 0.357 19581
1154 1 13 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.517 0.584 19581
1155 1 13 . 1 1 12 12 LEU H H 12 8.070 8.070 7.352 0.718 19581
1156 1 13 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.598 0.102 19581
1157 1 13 . 1 1 13 13 VAL CA C 13 66.700 66.700 66.232 0.468 19581
1158 1 13 . 1 1 13 13 VAL CB C 13 31.900 31.900 31.401 0.499 19581
1159 1 13 . 1 1 13 13 VAL H H 13 8.450 8.450 7.815 0.635 19581
1160 1 13 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.353 -0.353 19581
1161 1 13 . 1 1 14 14 GLY H H 14 7.900 7.900 8.302 -0.402 19581
1162 1 13 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.091 0.029 19581
1163 1 13 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.309 0.391 19581
1164 1 13 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.035 0.965 19581
1165 1 13 . 1 1 15 15 LEU H H 15 7.800 7.800 7.796 0.004 19581
1166 1 13 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.090 0.020 19581
1167 1 13 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.227 -0.027 19581
1168 1 13 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.811 -0.411 19581
1169 1 13 . 1 1 16 16 ARG H H 16 7.750 7.750 7.521 0.229 19581
1170 1 13 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.724 0.146 19581
1171 1 13 . 1 1 17 17 ILE CA C 17 65.000 65.000 65.485 -0.485 19581
1172 1 13 . 1 1 17 17 ILE CB C 17 37.900 37.900 37.864 0.036 19581
1173 1 13 . 1 1 17 17 ILE H H 17 7.910 7.910 7.683 0.227 19581
1174 1 13 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.605 -0.045 19581
1175 1 13 . 1 1 18 18 VAL CA C 18 67.500 67.500 67.142 0.358 19581
1176 1 13 . 1 1 18 18 VAL CB C 18 31.600 31.600 31.378 0.222 19581
1177 1 13 . 1 1 18 18 VAL H H 18 8.030 8.030 8.184 -0.154 19581
1178 1 13 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.083 0.257 19581
1179 1 13 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.016 -0.016 19581
1180 1 13 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.624 -0.224 19581
1181 1 13 . 1 1 19 19 PHE H H 19 8.370 8.370 8.599 -0.229 19581
1182 1 13 . 1 1 20 20 ALA HA H 20 4.150 4.150 3.748 0.402 19581
1183 1 13 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.290 0.610 19581
1184 1 13 . 1 1 20 20 ALA CB C 20 17.400 17.400 17.979 -0.579 19581
1185 1 13 . 1 1 20 20 ALA H H 20 8.190 8.190 8.023 0.167 19581
1186 1 13 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.622 0.008 19581
1187 1 13 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.738 0.562 19581
1188 1 13 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.502 0.198 19581
1189 1 13 . 1 1 21 21 VAL H H 21 8.690 8.690 8.159 0.531 19581
1190 1 13 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.796 0.254 19581
1191 1 13 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.446 -0.046 19581
1192 1 13 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.390 0.310 19581
1193 1 13 . 1 1 22 22 LEU H H 22 8.910 8.910 8.157 0.753 19581
1194 1 13 . 1 1 23 23 SER HA H 23 4.130 4.130 3.939 0.191 19581
1195 1 13 . 1 1 23 23 SER CA C 23 62.500 62.500 61.651 0.849 19581
1196 1 13 . 1 1 23 23 SER CB C 23 62.700 62.700 63.042 -0.342 19581
1197 1 13 . 1 1 23 23 SER H H 23 8.070 8.070 7.892 0.178 19581
1198 1 13 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.771 0.059 19581
1199 1 13 . 1 1 24 24 ILE CA C 24 64.900 64.900 64.122 0.778 19581
1200 1 13 . 1 1 24 24 ILE CB C 24 38.300 38.300 38.012 0.288 19581
1201 1 13 . 1 1 24 24 ILE H H 24 8.100 8.100 8.011 0.089 19581
1202 1 13 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.055 0.065 19581
1203 1 13 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.562 0.038 19581
1204 1 13 . 1 1 25 25 LYS CB C 25 32.000 32.000 32.163 -0.163 19581
1205 1 13 . 1 1 25 25 LYS H H 25 8.540 8.540 7.953 0.587 19581
1206 1 13 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.205 -0.005 19581
1207 1 13 . 1 1 26 26 LYS CA C 26 57.800 57.800 56.555 1.245 19581
1208 1 13 . 1 1 26 26 LYS CB C 26 32.400 32.400 32.795 -0.396 19581
1209 1 13 . 1 1 26 26 LYS H H 26 8.350 8.350 7.569 0.781 19581
1210 1 14 . 1 1 2 2 LYS HA H 2 4.210 4.210 4.114 0.096 19581
1211 1 14 . 1 1 2 2 LYS CA C 2 58.800 58.800 59.099 -0.299 19581
1212 1 14 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.148 0.952 19581
1213 1 14 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.129 -0.039 19581
1214 1 14 . 1 1 3 3 LYS CA C 3 59.100 59.100 59.124 -0.024 19581
1215 1 14 . 1 1 3 3 LYS CB C 3 32.700 32.700 32.111 0.589 19581
1216 1 14 . 1 1 3 3 LYS H H 3 8.170 8.170 8.390 -0.220 19581
1217 1 14 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.093 0.197 19581
1218 1 14 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.671 -0.271 19581
1219 1 14 . 1 1 4 4 LEU CB C 4 42.300 42.300 40.928 1.372 19581
1220 1 14 . 1 1 4 4 LEU H H 4 7.210 7.210 7.916 -0.706 19581
1221 1 14 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.067 0.223 19581
1222 1 14 . 1 1 5 5 PHE CA C 5 61.300 61.300 62.256 -0.956 19581
1223 1 14 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.129 -0.229 19581
1224 1 14 . 1 1 5 5 PHE H H 5 7.670 7.670 8.155 -0.485 19581
1225 1 14 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.466 0.254 19581
1226 1 14 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.433 -1.033 19581
1227 1 14 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.758 0.242 19581
1228 1 14 . 1 1 6 6 ILE H H 6 7.790 7.790 8.359 -0.569 19581
1229 1 14 . 1 1 7 7 MET HA H 7 4.170 4.170 4.076 0.094 19581
1230 1 14 . 1 1 7 7 MET CA C 7 58.700 58.700 58.080 0.620 19581
1231 1 14 . 1 1 7 7 MET CB C 7 32.500 32.500 31.513 0.987 19581
1232 1 14 . 1 1 7 7 MET H H 7 7.800 7.800 7.888 -0.088 19581
1233 1 14 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.708 0.122 19581
1234 1 14 . 1 1 8 8 ILE CA C 8 65.100 65.100 65.002 0.098 19581
1235 1 14 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.670 0.730 19581
1236 1 14 . 1 1 8 8 ILE H H 8 8.190 8.190 7.592 0.598 19581
1237 1 14 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.706 -0.066 19581
1238 1 14 . 1 1 9 9 VAL CA C 9 67.000 67.000 65.647 1.353 19581
1239 1 14 . 1 1 9 9 VAL CB C 9 31.500 31.500 30.629 0.871 19581
1240 1 14 . 1 1 9 9 VAL H H 9 8.350 8.350 7.740 0.610 19581
1241 1 14 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.310 -0.410 19581
1242 1 14 . 1 1 10 10 GLY H H 10 8.370 8.370 8.493 -0.123 19581
1243 1 14 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.776 -0.476 19581
1244 1 14 . 1 1 11 11 GLY H H 11 7.800 7.800 7.517 0.283 19581
1245 1 14 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.033 0.227 19581
1246 1 14 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.639 0.161 19581
1247 1 14 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.510 0.590 19581
1248 1 14 . 1 1 12 12 LEU H H 12 8.070 8.070 7.343 0.727 19581
1249 1 14 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.707 -0.007 19581
1250 1 14 . 1 1 13 13 VAL CA C 13 66.700 66.700 66.099 0.601 19581
1251 1 14 . 1 1 13 13 VAL CB C 13 31.900 31.900 30.983 0.917 19581
1252 1 14 . 1 1 13 13 VAL H H 13 8.450 8.450 7.838 0.612 19581
1253 1 14 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.185 -0.186 19581
1254 1 14 . 1 1 14 14 GLY H H 14 7.900 7.900 8.246 -0.346 19581
1255 1 14 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.055 0.065 19581
1256 1 14 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.839 -0.139 19581
1257 1 14 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.319 0.681 19581
1258 1 14 . 1 1 15 15 LEU H H 15 7.800 7.800 8.363 -0.563 19581
1259 1 14 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.068 0.042 19581
1260 1 14 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.511 -0.311 19581
1261 1 14 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.878 -0.478 19581
1262 1 14 . 1 1 16 16 ARG H H 16 7.750 7.750 7.633 0.117 19581
1263 1 14 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.801 0.069 19581
1264 1 14 . 1 1 17 17 ILE CA C 17 65.000 65.000 64.657 0.343 19581
1265 1 14 . 1 1 17 17 ILE CB C 17 37.900 37.900 37.894 0.006 19581
1266 1 14 . 1 1 17 17 ILE H H 17 7.910 7.910 7.444 0.466 19581
1267 1 14 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.529 0.031 19581
1268 1 14 . 1 1 18 18 VAL CA C 18 67.500 67.500 66.799 0.701 19581
1269 1 14 . 1 1 18 18 VAL CB C 18 31.600 31.600 31.631 -0.031 19581
1270 1 14 . 1 1 18 18 VAL H H 18 8.030 8.030 8.389 -0.359 19581
1271 1 14 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.045 0.295 19581
1272 1 14 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.641 -0.641 19581
1273 1 14 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.800 -0.400 19581
1274 1 14 . 1 1 19 19 PHE H H 19 8.370 8.370 8.730 -0.360 19581
1275 1 14 . 1 1 20 20 ALA HA H 20 4.150 4.150 3.808 0.342 19581
1276 1 14 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.193 0.707 19581
1277 1 14 . 1 1 20 20 ALA CB C 20 17.400 17.400 18.015 -0.615 19581
1278 1 14 . 1 1 20 20 ALA H H 20 8.190 8.190 7.686 0.504 19581
1279 1 14 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.495 0.135 19581
1280 1 14 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.626 0.674 19581
1281 1 14 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.640 0.060 19581
1282 1 14 . 1 1 21 21 VAL H H 21 8.690 8.690 7.914 0.776 19581
1283 1 14 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.785 0.265 19581
1284 1 14 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.257 0.143 19581
1285 1 14 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.473 0.227 19581
1286 1 14 . 1 1 22 22 LEU H H 22 8.910 8.910 8.351 0.559 19581
1287 1 14 . 1 1 23 23 SER HA H 23 4.130 4.130 3.947 0.183 19581
1288 1 14 . 1 1 23 23 SER CA C 23 62.500 62.500 61.588 0.912 19581
1289 1 14 . 1 1 23 23 SER CB C 23 62.700 62.700 62.981 -0.281 19581
1290 1 14 . 1 1 23 23 SER H H 23 8.070 8.070 7.870 0.200 19581
1291 1 14 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.783 0.047 19581
1292 1 14 . 1 1 24 24 ILE CA C 24 64.900 64.900 64.018 0.882 19581
1293 1 14 . 1 1 24 24 ILE CB C 24 38.300 38.300 38.014 0.286 19581
1294 1 14 . 1 1 24 24 ILE H H 24 8.100 8.100 8.006 0.094 19581
1295 1 14 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.054 0.066 19581
1296 1 14 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.454 0.146 19581
1297 1 14 . 1 1 25 25 LYS CB C 25 32.000 32.000 32.196 -0.196 19581
1298 1 14 . 1 1 25 25 LYS H H 25 8.540 8.540 7.918 0.622 19581
1299 1 14 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.160 0.040 19581
1300 1 14 . 1 1 26 26 LYS CA C 26 57.800 57.800 56.747 1.053 19581
1301 1 14 . 1 1 26 26 LYS CB C 26 32.400 32.400 32.950 -0.550 19581
1302 1 14 . 1 1 26 26 LYS H H 26 8.350 8.350 7.511 0.839 19581
1303 1 15 . 1 1 2 2 LYS HA H 2 4.210 4.210 4.052 0.158 19581
1304 1 15 . 1 1 2 2 LYS CA C 2 58.800 58.800 58.953 -0.153 19581
1305 1 15 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.608 0.491 19581
1306 1 15 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.134 -0.044 19581
1307 1 15 . 1 1 3 3 LYS CA C 3 59.100 59.100 59.254 -0.154 19581
1308 1 15 . 1 1 3 3 LYS CB C 3 32.700 32.700 32.212 0.487 19581
1309 1 15 . 1 1 3 3 LYS H H 3 8.170 8.170 8.134 0.036 19581
1310 1 15 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.057 0.233 19581
1311 1 15 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.704 -0.304 19581
1312 1 15 . 1 1 4 4 LEU CB C 4 42.300 42.300 41.608 0.691 19581
1313 1 15 . 1 1 4 4 LEU H H 4 7.210 7.210 7.875 -0.665 19581
1314 1 15 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.030 0.260 19581
1315 1 15 . 1 1 5 5 PHE CA C 5 61.300 61.300 62.320 -1.020 19581
1316 1 15 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.240 -0.340 19581
1317 1 15 . 1 1 5 5 PHE H H 5 7.670 7.670 8.061 -0.391 19581
1318 1 15 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.535 0.185 19581
1319 1 15 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.566 -1.166 19581
1320 1 15 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.822 0.178 19581
1321 1 15 . 1 1 6 6 ILE H H 6 7.790 7.790 8.593 -0.803 19581
1322 1 15 . 1 1 7 7 MET HA H 7 4.170 4.170 4.058 0.112 19581
1323 1 15 . 1 1 7 7 MET CA C 7 58.700 58.700 58.785 -0.085 19581
1324 1 15 . 1 1 7 7 MET CB C 7 32.500 32.500 31.900 0.600 19581
1325 1 15 . 1 1 7 7 MET H H 7 7.800 7.800 7.759 0.041 19581
1326 1 15 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.662 0.168 19581
1327 1 15 . 1 1 8 8 ILE CA C 8 65.100 65.100 65.272 -0.172 19581
1328 1 15 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.507 0.893 19581
1329 1 15 . 1 1 8 8 ILE H H 8 8.190 8.190 7.823 0.367 19581
1330 1 15 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.674 -0.034 19581
1331 1 15 . 1 1 9 9 VAL CA C 9 67.000 67.000 65.996 1.004 19581
1332 1 15 . 1 1 9 9 VAL CB C 9 31.500 31.500 30.655 0.845 19581
1333 1 15 . 1 1 9 9 VAL H H 9 8.350 8.350 7.750 0.600 19581
1334 1 15 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.132 -0.232 19581
1335 1 15 . 1 1 10 10 GLY H H 10 8.370 8.370 8.523 -0.153 19581
1336 1 15 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.694 -0.394 19581
1337 1 15 . 1 1 11 11 GLY H H 11 7.800 7.800 7.985 -0.185 19581
1338 1 15 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.037 0.223 19581
1339 1 15 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.387 0.413 19581
1340 1 15 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.373 0.727 19581
1341 1 15 . 1 1 12 12 LEU H H 12 8.070 8.070 7.522 0.548 19581
1342 1 15 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.737 -0.037 19581
1343 1 15 . 1 1 13 13 VAL CA C 13 66.700 66.700 66.175 0.525 19581
1344 1 15 . 1 1 13 13 VAL CB C 13 31.900 31.900 31.420 0.480 19581
1345 1 15 . 1 1 13 13 VAL H H 13 8.450 8.450 7.764 0.686 19581
1346 1 15 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.133 -0.133 19581
1347 1 15 . 1 1 14 14 GLY H H 14 7.900 7.900 8.308 -0.408 19581
1348 1 15 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.051 0.069 19581
1349 1 15 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.462 0.238 19581
1350 1 15 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.304 0.696 19581
1351 1 15 . 1 1 15 15 LEU H H 15 7.800 7.800 7.620 0.180 19581
1352 1 15 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.103 0.007 19581
1353 1 15 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.559 -0.359 19581
1354 1 15 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.884 -0.484 19581
1355 1 15 . 1 1 16 16 ARG H H 16 7.750 7.750 7.807 -0.057 19581
1356 1 15 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.902 -0.032 19581
1357 1 15 . 1 1 17 17 ILE CA C 17 65.000 65.000 63.142 1.858 19581
1358 1 15 . 1 1 17 17 ILE CB C 17 37.900 37.900 36.755 1.145 19581
1359 1 15 . 1 1 17 17 ILE H H 17 7.910 7.910 7.331 0.579 19581
1360 1 15 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.647 -0.087 19581
1361 1 15 . 1 1 18 18 VAL CA C 18 67.500 67.500 66.684 0.816 19581
1362 1 15 . 1 1 18 18 VAL CB C 18 31.600 31.600 30.969 0.631 19581
1363 1 15 . 1 1 18 18 VAL H H 18 8.030 8.030 8.263 -0.233 19581
1364 1 15 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.076 0.264 19581
1365 1 15 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.254 -0.254 19581
1366 1 15 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.470 -0.070 19581
1367 1 15 . 1 1 19 19 PHE H H 19 8.370 8.370 8.816 -0.446 19581
1368 1 15 . 1 1 20 20 ALA HA H 20 4.150 4.150 3.798 0.352 19581
1369 1 15 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.215 0.685 19581
1370 1 15 . 1 1 20 20 ALA CB C 20 17.400 17.400 18.022 -0.622 19581
1371 1 15 . 1 1 20 20 ALA H H 20 8.190 8.190 7.732 0.458 19581
1372 1 15 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.505 0.125 19581
1373 1 15 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.541 0.759 19581
1374 1 15 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.587 0.113 19581
1375 1 15 . 1 1 21 21 VAL H H 21 8.690 8.690 7.749 0.941 19581
1376 1 15 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.858 0.192 19581
1377 1 15 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.096 0.304 19581
1378 1 15 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.591 0.109 19581
1379 1 15 . 1 1 22 22 LEU H H 22 8.910 8.910 8.287 0.623 19581
1380 1 15 . 1 1 23 23 SER HA H 23 4.130 4.130 4.036 0.094 19581
1381 1 15 . 1 1 23 23 SER CA C 23 62.500 62.500 61.125 1.375 19581
1382 1 15 . 1 1 23 23 SER CB C 23 62.700 62.700 62.949 -0.249 19581
1383 1 15 . 1 1 23 23 SER H H 23 8.070 8.070 7.851 0.219 19581
1384 1 15 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.737 0.093 19581
1385 1 15 . 1 1 24 24 ILE CA C 24 64.900 64.900 64.122 0.778 19581
1386 1 15 . 1 1 24 24 ILE CB C 24 38.300 38.300 37.894 0.406 19581
1387 1 15 . 1 1 24 24 ILE H H 24 8.100 8.100 8.293 -0.193 19581
1388 1 15 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.057 0.063 19581
1389 1 15 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.633 -0.033 19581
1390 1 15 . 1 1 25 25 LYS CB C 25 32.000 32.000 31.991 0.009 19581
1391 1 15 . 1 1 25 25 LYS H H 25 8.540 8.540 7.895 0.645 19581
1392 1 15 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.143 0.057 19581
1393 1 15 . 1 1 26 26 LYS CA C 26 57.800 57.800 57.351 0.449 19581
1394 1 15 . 1 1 26 26 LYS CB C 26 32.400 32.400 32.913 -0.513 19581
1395 1 15 . 1 1 26 26 LYS H H 26 8.350 8.350 7.716 0.634 19581
1396 1 16 . 1 1 2 2 LYS HA H 2 4.210 4.210 4.189 0.021 19581
1397 1 16 . 1 1 2 2 LYS CA C 2 58.800 58.800 58.503 0.297 19581
1398 1 16 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.582 0.518 19581
1399 1 16 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.117 -0.027 19581
1400 1 16 . 1 1 3 3 LYS CA C 3 59.100 59.100 59.101 -0.001 19581
1401 1 16 . 1 1 3 3 LYS CB C 3 32.700 32.700 32.168 0.532 19581
1402 1 16 . 1 1 3 3 LYS H H 3 8.170 8.170 8.388 -0.218 19581
1403 1 16 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.102 0.188 19581
1404 1 16 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.633 -0.233 19581
1405 1 16 . 1 1 4 4 LEU CB C 4 42.300 42.300 40.903 1.397 19581
1406 1 16 . 1 1 4 4 LEU H H 4 7.210 7.210 7.944 -0.734 19581
1407 1 16 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.062 0.228 19581
1408 1 16 . 1 1 5 5 PHE CA C 5 61.300 61.300 62.180 -0.880 19581
1409 1 16 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.103 -0.203 19581
1410 1 16 . 1 1 5 5 PHE H H 5 7.670 7.670 7.614 0.056 19581
1411 1 16 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.481 0.239 19581
1412 1 16 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.473 -1.073 19581
1413 1 16 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.786 0.214 19581
1414 1 16 . 1 1 6 6 ILE H H 6 7.790 7.790 8.538 -0.748 19581
1415 1 16 . 1 1 7 7 MET HA H 7 4.170 4.170 4.067 0.103 19581
1416 1 16 . 1 1 7 7 MET CA C 7 58.700 58.700 58.364 0.336 19581
1417 1 16 . 1 1 7 7 MET CB C 7 32.500 32.500 31.901 0.599 19581
1418 1 16 . 1 1 7 7 MET H H 7 7.800 7.800 7.829 -0.029 19581
1419 1 16 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.727 0.103 19581
1420 1 16 . 1 1 8 8 ILE CA C 8 65.100 65.100 65.073 0.027 19581
1421 1 16 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.724 0.676 19581
1422 1 16 . 1 1 8 8 ILE H H 8 8.190 8.190 7.986 0.204 19581
1423 1 16 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.698 -0.058 19581
1424 1 16 . 1 1 9 9 VAL CA C 9 67.000 67.000 65.021 1.979 19581
1425 1 16 . 1 1 9 9 VAL CB C 9 31.500 31.500 30.055 1.444 19581
1426 1 16 . 1 1 9 9 VAL H H 9 8.350 8.350 8.043 0.307 19581
1427 1 16 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.354 -0.454 19581
1428 1 16 . 1 1 10 10 GLY H H 10 8.370 8.370 8.444 -0.074 19581
1429 1 16 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.473 -0.173 19581
1430 1 16 . 1 1 11 11 GLY H H 11 7.800 7.800 7.462 0.338 19581
1431 1 16 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.047 0.213 19581
1432 1 16 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.461 0.339 19581
1433 1 16 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.506 0.594 19581
1434 1 16 . 1 1 12 12 LEU H H 12 8.070 8.070 7.380 0.690 19581
1435 1 16 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.651 0.049 19581
1436 1 16 . 1 1 13 13 VAL CA C 13 66.700 66.700 66.105 0.595 19581
1437 1 16 . 1 1 13 13 VAL CB C 13 31.900 31.900 31.436 0.465 19581
1438 1 16 . 1 1 13 13 VAL H H 13 8.450 8.450 8.143 0.307 19581
1439 1 16 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.244 -0.244 19581
1440 1 16 . 1 1 14 14 GLY H H 14 7.900 7.900 8.294 -0.394 19581
1441 1 16 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.101 0.019 19581
1442 1 16 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.292 0.408 19581
1443 1 16 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.208 0.792 19581
1444 1 16 . 1 1 15 15 LEU H H 15 7.800 7.800 7.398 0.402 19581
1445 1 16 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.125 -0.015 19581
1446 1 16 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.315 -0.114 19581
1447 1 16 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.744 -0.344 19581
1448 1 16 . 1 1 16 16 ARG H H 16 7.750 7.750 7.886 -0.136 19581
1449 1 16 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.887 -0.017 19581
1450 1 16 . 1 1 17 17 ILE CA C 17 65.000 65.000 65.001 -0.001 19581
1451 1 16 . 1 1 17 17 ILE CB C 17 37.900 37.900 37.939 -0.039 19581
1452 1 16 . 1 1 17 17 ILE H H 17 7.910 7.910 7.623 0.287 19581
1453 1 16 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.633 -0.073 19581
1454 1 16 . 1 1 18 18 VAL CA C 18 67.500 67.500 66.772 0.728 19581
1455 1 16 . 1 1 18 18 VAL CB C 18 31.600 31.600 31.250 0.350 19581
1456 1 16 . 1 1 18 18 VAL H H 18 8.030 8.030 8.246 -0.216 19581
1457 1 16 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.064 0.276 19581
1458 1 16 . 1 1 19 19 PHE CA C 19 61.000 61.000 60.887 0.113 19581
1459 1 16 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.570 -0.170 19581
1460 1 16 . 1 1 19 19 PHE H H 19 8.370 8.370 8.623 -0.253 19581
1461 1 16 . 1 1 20 20 ALA HA H 20 4.150 4.150 3.721 0.429 19581
1462 1 16 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.256 0.644 19581
1463 1 16 . 1 1 20 20 ALA CB C 20 17.400 17.400 17.904 -0.504 19581
1464 1 16 . 1 1 20 20 ALA H H 20 8.190 8.190 7.544 0.646 19581
1465 1 16 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.630 0.000 19581
1466 1 16 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.678 0.622 19581
1467 1 16 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.506 0.194 19581
1468 1 16 . 1 1 21 21 VAL H H 21 8.690 8.690 7.769 0.921 19581
1469 1 16 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.814 0.236 19581
1470 1 16 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.372 0.028 19581
1471 1 16 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.562 0.138 19581
1472 1 16 . 1 1 22 22 LEU H H 22 8.910 8.910 8.336 0.574 19581
1473 1 16 . 1 1 23 23 SER HA H 23 4.130 4.130 4.039 0.091 19581
1474 1 16 . 1 1 23 23 SER CA C 23 62.500 62.500 61.347 1.153 19581
1475 1 16 . 1 1 23 23 SER CB C 23 62.700 62.700 62.926 -0.226 19581
1476 1 16 . 1 1 23 23 SER H H 23 8.070 8.070 8.011 0.059 19581
1477 1 16 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.731 0.099 19581
1478 1 16 . 1 1 24 24 ILE CA C 24 64.900 64.900 64.138 0.762 19581
1479 1 16 . 1 1 24 24 ILE CB C 24 38.300 38.300 37.895 0.405 19581
1480 1 16 . 1 1 24 24 ILE H H 24 8.100 8.100 8.214 -0.114 19581
1481 1 16 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.039 0.081 19581
1482 1 16 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.710 -0.110 19581
1483 1 16 . 1 1 25 25 LYS CB C 25 32.000 32.000 31.958 0.042 19581
1484 1 16 . 1 1 25 25 LYS H H 25 8.540 8.540 8.063 0.477 19581
1485 1 16 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.190 0.010 19581
1486 1 16 . 1 1 26 26 LYS CA C 26 57.800 57.800 57.222 0.578 19581
1487 1 16 . 1 1 26 26 LYS CB C 26 32.400 32.400 33.346 -0.946 19581
1488 1 16 . 1 1 26 26 LYS H H 26 8.350 8.350 7.668 0.682 19581
1489 1 17 . 1 1 2 2 LYS HA H 2 4.210 4.210 4.107 0.103 19581
1490 1 17 . 1 1 2 2 LYS CA C 2 58.800 58.800 58.624 0.176 19581
1491 1 17 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.477 0.623 19581
1492 1 17 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.088 0.002 19581
1493 1 17 . 1 1 3 3 LYS CA C 3 59.100 59.100 59.210 -0.110 19581
1494 1 17 . 1 1 3 3 LYS CB C 3 32.700 32.700 32.104 0.596 19581
1495 1 17 . 1 1 3 3 LYS H H 3 8.170 8.170 8.124 0.046 19581
1496 1 17 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.001 0.289 19581
1497 1 17 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.824 -0.424 19581
1498 1 17 . 1 1 4 4 LEU CB C 4 42.300 42.300 41.742 0.558 19581
1499 1 17 . 1 1 4 4 LEU H H 4 7.210 7.210 7.642 -0.432 19581
1500 1 17 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.049 0.241 19581
1501 1 17 . 1 1 5 5 PHE CA C 5 61.300 61.300 62.170 -0.870 19581
1502 1 17 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.161 -0.261 19581
1503 1 17 . 1 1 5 5 PHE H H 5 7.670 7.670 7.584 0.086 19581
1504 1 17 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.575 0.145 19581
1505 1 17 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.528 -1.127 19581
1506 1 17 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.860 0.140 19581
1507 1 17 . 1 1 6 6 ILE H H 6 7.790 7.790 8.357 -0.567 19581
1508 1 17 . 1 1 7 7 MET HA H 7 4.170 4.170 4.009 0.161 19581
1509 1 17 . 1 1 7 7 MET CA C 7 58.700 58.700 59.387 -0.687 19581
1510 1 17 . 1 1 7 7 MET CB C 7 32.500 32.500 32.402 0.098 19581
1511 1 17 . 1 1 7 7 MET H H 7 7.800 7.800 7.775 0.025 19581
1512 1 17 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.728 0.102 19581
1513 1 17 . 1 1 8 8 ILE CA C 8 65.100 65.100 64.756 0.344 19581
1514 1 17 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.698 0.702 19581
1515 1 17 . 1 1 8 8 ILE H H 8 8.190 8.190 7.674 0.516 19581
1516 1 17 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.787 -0.147 19581
1517 1 17 . 1 1 9 9 VAL CA C 9 67.000 67.000 64.993 2.007 19581
1518 1 17 . 1 1 9 9 VAL CB C 9 31.500 31.500 30.092 1.408 19581
1519 1 17 . 1 1 9 9 VAL H H 9 8.350 8.350 7.827 0.523 19581
1520 1 17 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.354 -0.454 19581
1521 1 17 . 1 1 10 10 GLY H H 10 8.370 8.370 8.538 -0.168 19581
1522 1 17 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.473 -0.173 19581
1523 1 17 . 1 1 11 11 GLY H H 11 7.800 7.800 7.485 0.315 19581
1524 1 17 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.124 0.136 19581
1525 1 17 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.285 0.515 19581
1526 1 17 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.519 0.581 19581
1527 1 17 . 1 1 12 12 LEU H H 12 8.070 8.070 7.598 0.472 19581
1528 1 17 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.764 -0.064 19581
1529 1 17 . 1 1 13 13 VAL CA C 13 66.700 66.700 65.857 0.843 19581
1530 1 17 . 1 1 13 13 VAL CB C 13 31.900 31.900 30.649 1.250 19581
1531 1 17 . 1 1 13 13 VAL H H 13 8.450 8.450 8.439 0.011 19581
1532 1 17 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.335 -0.335 19581
1533 1 17 . 1 1 14 14 GLY H H 14 7.900 7.900 8.037 -0.137 19581
1534 1 17 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.119 0.001 19581
1535 1 17 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.625 0.075 19581
1536 1 17 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.254 0.746 19581
1537 1 17 . 1 1 15 15 LEU H H 15 7.800 7.800 7.600 0.200 19581
1538 1 17 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.144 -0.034 19581
1539 1 17 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.171 0.029 19581
1540 1 17 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.420 -0.020 19581
1541 1 17 . 1 1 16 16 ARG H H 16 7.750 7.750 7.704 0.046 19581
1542 1 17 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.860 0.010 19581
1543 1 17 . 1 1 17 17 ILE CA C 17 65.000 65.000 65.105 -0.105 19581
1544 1 17 . 1 1 17 17 ILE CB C 17 37.900 37.900 37.742 0.158 19581
1545 1 17 . 1 1 17 17 ILE H H 17 7.910 7.910 7.403 0.507 19581
1546 1 17 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.597 -0.037 19581
1547 1 17 . 1 1 18 18 VAL CA C 18 67.500 67.500 67.077 0.423 19581
1548 1 17 . 1 1 18 18 VAL CB C 18 31.600 31.600 31.269 0.331 19581
1549 1 17 . 1 1 18 18 VAL H H 18 8.030 8.030 8.342 -0.312 19581
1550 1 17 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.068 0.272 19581
1551 1 17 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.648 -0.648 19581
1552 1 17 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.489 -0.089 19581
1553 1 17 . 1 1 19 19 PHE H H 19 8.370 8.370 8.336 0.034 19581
1554 1 17 . 1 1 20 20 ALA HA H 20 4.150 4.150 4.054 0.096 19581
1555 1 17 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.430 0.470 19581
1556 1 17 . 1 1 20 20 ALA CB C 20 17.400 17.400 18.109 -0.709 19581
1557 1 17 . 1 1 20 20 ALA H H 20 8.190 8.190 8.067 0.123 19581
1558 1 17 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.555 0.075 19581
1559 1 17 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.712 0.588 19581
1560 1 17 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.668 0.032 19581
1561 1 17 . 1 1 21 21 VAL H H 21 8.690 8.690 8.109 0.581 19581
1562 1 17 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.839 0.211 19581
1563 1 17 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.143 0.257 19581
1564 1 17 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.648 0.052 19581
1565 1 17 . 1 1 22 22 LEU H H 22 8.910 8.910 8.387 0.523 19581
1566 1 17 . 1 1 23 23 SER HA H 23 4.130 4.130 4.234 -0.104 19581
1567 1 17 . 1 1 23 23 SER CA C 23 62.500 62.500 62.138 0.362 19581
1568 1 17 . 1 1 23 23 SER CB C 23 62.700 62.700 63.123 -0.423 19581
1569 1 17 . 1 1 23 23 SER H H 23 8.070 8.070 8.165 -0.095 19581
1570 1 17 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.817 0.013 19581
1571 1 17 . 1 1 24 24 ILE CA C 24 64.900 64.900 63.958 0.943 19581
1572 1 17 . 1 1 24 24 ILE CB C 24 38.300 38.300 37.964 0.336 19581
1573 1 17 . 1 1 24 24 ILE H H 24 8.100 8.100 8.362 -0.262 19581
1574 1 17 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.068 0.052 19581
1575 1 17 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.568 0.032 19581
1576 1 17 . 1 1 25 25 LYS CB C 25 32.000 32.000 32.051 -0.051 19581
1577 1 17 . 1 1 25 25 LYS H H 25 8.540 8.540 8.066 0.474 19581
1578 1 17 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.218 -0.018 19581
1579 1 17 . 1 1 26 26 LYS CA C 26 57.800 57.800 56.818 0.982 19581
1580 1 17 . 1 1 26 26 LYS CB C 26 32.400 32.400 32.932 -0.532 19581
1581 1 17 . 1 1 26 26 LYS H H 26 8.350 8.350 7.676 0.674 19581
1582 1 18 . 1 1 2 2 LYS HA H 2 4.210 4.210 4.101 0.109 19581
1583 1 18 . 1 1 2 2 LYS CA C 2 58.800 58.800 58.791 0.009 19581
1584 1 18 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.302 0.798 19581
1585 1 18 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.121 -0.031 19581
1586 1 18 . 1 1 3 3 LYS CA C 3 59.100 59.100 59.026 0.074 19581
1587 1 18 . 1 1 3 3 LYS CB C 3 32.700 32.700 32.121 0.579 19581
1588 1 18 . 1 1 3 3 LYS H H 3 8.170 8.170 8.171 -0.002 19581
1589 1 18 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.023 0.267 19581
1590 1 18 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.530 -0.130 19581
1591 1 18 . 1 1 4 4 LEU CB C 4 42.300 42.300 41.738 0.562 19581
1592 1 18 . 1 1 4 4 LEU H H 4 7.210 7.210 7.761 -0.551 19581
1593 1 18 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.097 0.193 19581
1594 1 18 . 1 1 5 5 PHE CA C 5 61.300 61.300 61.824 -0.524 19581
1595 1 18 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.253 -0.353 19581
1596 1 18 . 1 1 5 5 PHE H H 5 7.670 7.670 7.472 0.198 19581
1597 1 18 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.406 0.314 19581
1598 1 18 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.455 -1.055 19581
1599 1 18 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.752 0.248 19581
1600 1 18 . 1 1 6 6 ILE H H 6 7.790 7.790 8.720 -0.930 19581
1601 1 18 . 1 1 7 7 MET HA H 7 4.170 4.170 4.034 0.136 19581
1602 1 18 . 1 1 7 7 MET CA C 7 58.700 58.700 58.896 -0.196 19581
1603 1 18 . 1 1 7 7 MET CB C 7 32.500 32.500 32.015 0.485 19581
1604 1 18 . 1 1 7 7 MET H H 7 7.800 7.800 7.614 0.186 19581
1605 1 18 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.688 0.142 19581
1606 1 18 . 1 1 8 8 ILE CA C 8 65.100 65.100 65.215 -0.115 19581
1607 1 18 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.551 0.849 19581
1608 1 18 . 1 1 8 8 ILE H H 8 8.190 8.190 7.828 0.362 19581
1609 1 18 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.669 -0.029 19581
1610 1 18 . 1 1 9 9 VAL CA C 9 67.000 67.000 65.477 1.523 19581
1611 1 18 . 1 1 9 9 VAL CB C 9 31.500 31.500 29.992 1.508 19581
1612 1 18 . 1 1 9 9 VAL H H 9 8.350 8.350 8.020 0.330 19581
1613 1 18 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.403 -0.503 19581
1614 1 18 . 1 1 10 10 GLY H H 10 8.370 8.370 8.404 -0.034 19581
1615 1 18 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.843 -0.543 19581
1616 1 18 . 1 1 11 11 GLY H H 11 7.800 7.800 7.990 -0.190 19581
1617 1 18 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.008 0.252 19581
1618 1 18 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.363 0.437 19581
1619 1 18 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.410 0.689 19581
1620 1 18 . 1 1 12 12 LEU H H 12 8.070 8.070 7.437 0.633 19581
1621 1 18 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.617 0.083 19581
1622 1 18 . 1 1 13 13 VAL CA C 13 66.700 66.700 66.118 0.582 19581
1623 1 18 . 1 1 13 13 VAL CB C 13 31.900 31.900 31.567 0.333 19581
1624 1 18 . 1 1 13 13 VAL H H 13 8.450 8.450 7.811 0.639 19581
1625 1 18 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.102 -0.102 19581
1626 1 18 . 1 1 14 14 GLY H H 14 7.900 7.900 8.508 -0.608 19581
1627 1 18 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.036 0.084 19581
1628 1 18 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.639 0.061 19581
1629 1 18 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.368 0.632 19581
1630 1 18 . 1 1 15 15 LEU H H 15 7.800 7.800 7.938 -0.138 19581
1631 1 18 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.115 -0.005 19581
1632 1 18 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.393 -0.193 19581
1633 1 18 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.919 -0.519 19581
1634 1 18 . 1 1 16 16 ARG H H 16 7.750 7.750 7.813 -0.063 19581
1635 1 18 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.901 -0.031 19581
1636 1 18 . 1 1 17 17 ILE CA C 17 65.000 65.000 62.957 2.043 19581
1637 1 18 . 1 1 17 17 ILE CB C 17 37.900 37.900 36.913 0.987 19581
1638 1 18 . 1 1 17 17 ILE H H 17 7.910 7.910 7.501 0.409 19581
1639 1 18 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.651 -0.091 19581
1640 1 18 . 1 1 18 18 VAL CA C 18 67.500 67.500 66.983 0.517 19581
1641 1 18 . 1 1 18 18 VAL CB C 18 31.600 31.600 31.310 0.290 19581
1642 1 18 . 1 1 18 18 VAL H H 18 8.030 8.030 8.161 -0.131 19581
1643 1 18 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.093 0.247 19581
1644 1 18 . 1 1 19 19 PHE CA C 19 61.000 61.000 60.885 0.115 19581
1645 1 18 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.553 -0.152 19581
1646 1 18 . 1 1 19 19 PHE H H 19 8.370 8.370 8.846 -0.476 19581
1647 1 18 . 1 1 20 20 ALA HA H 20 4.150 4.150 3.765 0.385 19581
1648 1 18 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.235 0.665 19581
1649 1 18 . 1 1 20 20 ALA CB C 20 17.400 17.400 17.989 -0.590 19581
1650 1 18 . 1 1 20 20 ALA H H 20 8.190 8.190 7.661 0.529 19581
1651 1 18 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.646 -0.016 19581
1652 1 18 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.406 0.894 19581
1653 1 18 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.043 0.657 19581
1654 1 18 . 1 1 21 21 VAL H H 21 8.690 8.690 7.662 1.028 19581
1655 1 18 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.864 0.186 19581
1656 1 18 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.346 0.054 19581
1657 1 18 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.587 0.112 19581
1658 1 18 . 1 1 22 22 LEU H H 22 8.910 8.910 8.490 0.420 19581
1659 1 18 . 1 1 23 23 SER HA H 23 4.130 4.130 4.056 0.074 19581
1660 1 18 . 1 1 23 23 SER CA C 23 62.500 62.500 61.176 1.323 19581
1661 1 18 . 1 1 23 23 SER CB C 23 62.700 62.700 62.889 -0.189 19581
1662 1 18 . 1 1 23 23 SER H H 23 8.070 8.070 8.015 0.055 19581
1663 1 18 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.732 0.098 19581
1664 1 18 . 1 1 24 24 ILE CA C 24 64.900 64.900 64.172 0.728 19581
1665 1 18 . 1 1 24 24 ILE CB C 24 38.300 38.300 37.921 0.379 19581
1666 1 18 . 1 1 24 24 ILE H H 24 8.100 8.100 8.204 -0.104 19581
1667 1 18 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.036 0.084 19581
1668 1 18 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.971 -0.371 19581
1669 1 18 . 1 1 25 25 LYS CB C 25 32.000 32.000 32.031 -0.031 19581
1670 1 18 . 1 1 25 25 LYS H H 25 8.540 8.540 8.092 0.448 19581
1671 1 18 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.192 0.008 19581
1672 1 18 . 1 1 26 26 LYS CA C 26 57.800 57.800 57.082 0.718 19581
1673 1 18 . 1 1 26 26 LYS CB C 26 32.400 32.400 33.272 -0.871 19581
1674 1 18 . 1 1 26 26 LYS H H 26 8.350 8.350 7.762 0.588 19581
1675 1 19 . 1 1 2 2 LYS HA H 2 4.210 4.210 4.063 0.147 19581
1676 1 19 . 1 1 2 2 LYS CA C 2 58.800 58.800 58.470 0.330 19581
1677 1 19 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.060 1.040 19581
1678 1 19 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.100 -0.010 19581
1679 1 19 . 1 1 3 3 LYS CA C 3 59.100 59.100 58.910 0.190 19581
1680 1 19 . 1 1 3 3 LYS CB C 3 32.700 32.700 31.982 0.718 19581
1681 1 19 . 1 1 3 3 LYS H H 3 8.170 8.170 8.145 0.025 19581
1682 1 19 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.009 0.281 19581
1683 1 19 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.601 -0.201 19581
1684 1 19 . 1 1 4 4 LEU CB C 4 42.300 42.300 41.646 0.654 19581
1685 1 19 . 1 1 4 4 LEU H H 4 7.210 7.210 7.753 -0.543 19581
1686 1 19 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.086 0.204 19581
1687 1 19 . 1 1 5 5 PHE CA C 5 61.300 61.300 61.959 -0.659 19581
1688 1 19 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.219 -0.319 19581
1689 1 19 . 1 1 5 5 PHE H H 5 7.670 7.670 7.473 0.197 19581
1690 1 19 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.436 0.284 19581
1691 1 19 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.525 -1.125 19581
1692 1 19 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.790 0.210 19581
1693 1 19 . 1 1 6 6 ILE H H 6 7.790 7.790 8.458 -0.668 19581
1694 1 19 . 1 1 7 7 MET HA H 7 4.170 4.170 4.040 0.130 19581
1695 1 19 . 1 1 7 7 MET CA C 7 58.700 58.700 58.635 0.065 19581
1696 1 19 . 1 1 7 7 MET CB C 7 32.500 32.500 32.087 0.413 19581
1697 1 19 . 1 1 7 7 MET H H 7 7.800 7.800 7.896 -0.096 19581
1698 1 19 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.787 0.043 19581
1699 1 19 . 1 1 8 8 ILE CA C 8 65.100 65.100 64.785 0.314 19581
1700 1 19 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.971 0.429 19581
1701 1 19 . 1 1 8 8 ILE H H 8 8.190 8.190 7.789 0.401 19581
1702 1 19 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.717 -0.077 19581
1703 1 19 . 1 1 9 9 VAL CA C 9 67.000 67.000 64.983 2.017 19581
1704 1 19 . 1 1 9 9 VAL CB C 9 31.500 31.500 29.929 1.571 19581
1705 1 19 . 1 1 9 9 VAL H H 9 8.350 8.350 8.199 0.151 19581
1706 1 19 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.218 -0.318 19581
1707 1 19 . 1 1 10 10 GLY H H 10 8.370 8.370 8.525 -0.155 19581
1708 1 19 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.529 -0.229 19581
1709 1 19 . 1 1 11 11 GLY H H 11 7.800 7.800 7.469 0.331 19581
1710 1 19 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.077 0.183 19581
1711 1 19 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.345 0.455 19581
1712 1 19 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.573 0.527 19581
1713 1 19 . 1 1 12 12 LEU H H 12 8.070 8.070 7.537 0.533 19581
1714 1 19 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.641 0.059 19581
1715 1 19 . 1 1 13 13 VAL CA C 13 66.700 66.700 66.142 0.558 19581
1716 1 19 . 1 1 13 13 VAL CB C 13 31.900 31.900 31.466 0.434 19581
1717 1 19 . 1 1 13 13 VAL H H 13 8.450 8.450 8.376 0.074 19581
1718 1 19 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.094 -0.094 19581
1719 1 19 . 1 1 14 14 GLY H H 14 7.900 7.900 7.826 0.074 19581
1720 1 19 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.016 0.104 19581
1721 1 19 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.883 -0.183 19581
1722 1 19 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.251 0.749 19581
1723 1 19 . 1 1 15 15 LEU H H 15 7.800 7.800 7.895 -0.095 19581
1724 1 19 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.073 0.037 19581
1725 1 19 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.622 -0.422 19581
1726 1 19 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.885 -0.485 19581
1727 1 19 . 1 1 16 16 ARG H H 16 7.750 7.750 7.867 -0.117 19581
1728 1 19 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.778 0.092 19581
1729 1 19 . 1 1 17 17 ILE CA C 17 65.000 65.000 64.874 0.127 19581
1730 1 19 . 1 1 17 17 ILE CB C 17 37.900 37.900 37.932 -0.032 19581
1731 1 19 . 1 1 17 17 ILE H H 17 7.910 7.910 7.515 0.395 19581
1732 1 19 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.607 -0.047 19581
1733 1 19 . 1 1 18 18 VAL CA C 18 67.500 67.500 66.845 0.655 19581
1734 1 19 . 1 1 18 18 VAL CB C 18 31.600 31.600 31.209 0.391 19581
1735 1 19 . 1 1 18 18 VAL H H 18 8.030 8.030 8.170 -0.140 19581
1736 1 19 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.054 0.286 19581
1737 1 19 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.728 -0.728 19581
1738 1 19 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.447 -0.047 19581
1739 1 19 . 1 1 19 19 PHE H H 19 8.370 8.370 8.685 -0.315 19581
1740 1 19 . 1 1 20 20 ALA HA H 20 4.150 4.150 4.044 0.106 19581
1741 1 19 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.460 0.440 19581
1742 1 19 . 1 1 20 20 ALA CB C 20 17.400 17.400 18.061 -0.661 19581
1743 1 19 . 1 1 20 20 ALA H H 20 8.190 8.190 7.764 0.426 19581
1744 1 19 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.563 0.067 19581
1745 1 19 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.592 0.708 19581
1746 1 19 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.673 0.027 19581
1747 1 19 . 1 1 21 21 VAL H H 21 8.690 8.690 7.589 1.101 19581
1748 1 19 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.857 0.193 19581
1749 1 19 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.106 0.294 19581
1750 1 19 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.420 0.279 19581
1751 1 19 . 1 1 22 22 LEU H H 22 8.910 8.910 8.491 0.419 19581
1752 1 19 . 1 1 23 23 SER HA H 23 4.130 4.130 4.236 -0.106 19581
1753 1 19 . 1 1 23 23 SER CA C 23 62.500 62.500 61.350 1.149 19581
1754 1 19 . 1 1 23 23 SER CB C 23 62.700 62.700 63.307 -0.607 19581
1755 1 19 . 1 1 23 23 SER H H 23 8.070 8.070 8.196 -0.126 19581
1756 1 19 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.818 0.012 19581
1757 1 19 . 1 1 24 24 ILE CA C 24 64.900 64.900 64.098 0.802 19581
1758 1 19 . 1 1 24 24 ILE CB C 24 38.300 38.300 37.963 0.337 19581
1759 1 19 . 1 1 24 24 ILE H H 24 8.100 8.100 8.374 -0.274 19581
1760 1 19 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.054 0.066 19581
1761 1 19 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.843 -0.243 19581
1762 1 19 . 1 1 25 25 LYS CB C 25 32.000 32.000 31.982 0.018 19581
1763 1 19 . 1 1 25 25 LYS H H 25 8.540 8.540 8.116 0.424 19581
1764 1 19 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.207 -0.007 19581
1765 1 19 . 1 1 26 26 LYS CA C 26 57.800 57.800 57.112 0.688 19581
1766 1 19 . 1 1 26 26 LYS CB C 26 32.400 32.400 33.213 -0.813 19581
1767 1 19 . 1 1 26 26 LYS H H 26 8.350 8.350 7.759 0.591 19581
1768 1 20 . 1 1 2 2 LYS HA H 2 4.210 4.210 4.065 0.145 19581
1769 1 20 . 1 1 2 2 LYS CA C 2 58.800 58.800 59.116 -0.316 19581
1770 1 20 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.118 0.982 19581
1771 1 20 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.090 -0.000 19581
1772 1 20 . 1 1 3 3 LYS CA C 3 59.100 59.100 58.897 0.203 19581
1773 1 20 . 1 1 3 3 LYS CB C 3 32.700 32.700 31.794 0.906 19581
1774 1 20 . 1 1 3 3 LYS H H 3 8.170 8.170 8.236 -0.066 19581
1775 1 20 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.130 0.160 19581
1776 1 20 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.362 0.038 19581
1777 1 20 . 1 1 4 4 LEU CB C 4 42.300 42.300 41.017 1.283 19581
1778 1 20 . 1 1 4 4 LEU H H 4 7.210 7.210 7.818 -0.608 19581
1779 1 20 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.070 0.220 19581
1780 1 20 . 1 1 5 5 PHE CA C 5 61.300 61.300 62.281 -0.981 19581
1781 1 20 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.150 -0.250 19581
1782 1 20 . 1 1 5 5 PHE H H 5 7.670 7.670 7.444 0.226 19581
1783 1 20 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.608 0.112 19581
1784 1 20 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.472 -1.072 19581
1785 1 20 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.844 0.156 19581
1786 1 20 . 1 1 6 6 ILE H H 6 7.790 7.790 8.449 -0.659 19581
1787 1 20 . 1 1 7 7 MET HA H 7 4.170 4.170 4.099 0.071 19581
1788 1 20 . 1 1 7 7 MET CA C 7 58.700 58.700 58.047 0.653 19581
1789 1 20 . 1 1 7 7 MET CB C 7 32.500 32.500 31.778 0.722 19581
1790 1 20 . 1 1 7 7 MET H H 7 7.800 7.800 7.478 0.322 19581
1791 1 20 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.745 0.085 19581
1792 1 20 . 1 1 8 8 ILE CA C 8 65.100 65.100 64.862 0.238 19581
1793 1 20 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.723 0.677 19581
1794 1 20 . 1 1 8 8 ILE H H 8 8.190 8.190 7.675 0.515 19581
1795 1 20 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.773 -0.133 19581
1796 1 20 . 1 1 9 9 VAL CA C 9 67.000 67.000 64.823 2.177 19581
1797 1 20 . 1 1 9 9 VAL CB C 9 31.500 31.500 30.024 1.476 19581
1798 1 20 . 1 1 9 9 VAL H H 9 8.350 8.350 7.818 0.532 19581
1799 1 20 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.419 -0.519 19581
1800 1 20 . 1 1 10 10 GLY H H 10 8.370 8.370 8.424 -0.054 19581
1801 1 20 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.303 -0.003 19581
1802 1 20 . 1 1 11 11 GLY H H 11 7.800 7.800 7.425 0.375 19581
1803 1 20 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.152 0.108 19581
1804 1 20 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.350 0.450 19581
1805 1 20 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.547 0.553 19581
1806 1 20 . 1 1 12 12 LEU H H 12 8.070 8.070 7.688 0.382 19581
1807 1 20 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.786 -0.086 19581
1808 1 20 . 1 1 13 13 VAL CA C 13 66.700 66.700 66.092 0.608 19581
1809 1 20 . 1 1 13 13 VAL CB C 13 31.900 31.900 30.685 1.215 19581
1810 1 20 . 1 1 13 13 VAL H H 13 8.450 8.450 8.579 -0.129 19581
1811 1 20 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.096 -0.096 19581
1812 1 20 . 1 1 14 14 GLY H H 14 7.900 7.900 7.733 0.167 19581
1813 1 20 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.066 0.054 19581
1814 1 20 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.637 0.063 19581
1815 1 20 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.384 0.616 19581
1816 1 20 . 1 1 15 15 LEU H H 15 7.800 7.800 7.498 0.302 19581
1817 1 20 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.091 0.019 19581
1818 1 20 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.666 -0.466 19581
1819 1 20 . 1 1 16 16 ARG CB C 16 29.400 29.400 30.033 -0.633 19581
1820 1 20 . 1 1 16 16 ARG H H 16 7.750 7.750 7.679 0.071 19581
1821 1 20 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.770 0.100 19581
1822 1 20 . 1 1 17 17 ILE CA C 17 65.000 65.000 65.068 -0.068 19581
1823 1 20 . 1 1 17 17 ILE CB C 17 37.900 37.900 37.769 0.131 19581
1824 1 20 . 1 1 17 17 ILE H H 17 7.910 7.910 7.326 0.584 19581
1825 1 20 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.641 -0.081 19581
1826 1 20 . 1 1 18 18 VAL CA C 18 67.500 67.500 66.986 0.514 19581
1827 1 20 . 1 1 18 18 VAL CB C 18 31.600 31.600 31.389 0.211 19581
1828 1 20 . 1 1 18 18 VAL H H 18 8.030 8.030 8.388 -0.358 19581
1829 1 20 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.071 0.269 19581
1830 1 20 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.430 -0.430 19581
1831 1 20 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.723 -0.323 19581
1832 1 20 . 1 1 19 19 PHE H H 19 8.370 8.370 8.725 -0.355 19581
1833 1 20 . 1 1 20 20 ALA HA H 20 4.150 4.150 3.821 0.329 19581
1834 1 20 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.253 0.647 19581
1835 1 20 . 1 1 20 20 ALA CB C 20 17.400 17.400 18.039 -0.639 19581
1836 1 20 . 1 1 20 20 ALA H H 20 8.190 8.190 8.037 0.153 19581
1837 1 20 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.533 0.097 19581
1838 1 20 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.501 0.799 19581
1839 1 20 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.645 0.055 19581
1840 1 20 . 1 1 21 21 VAL H H 21 8.690 8.690 7.949 0.741 19581
1841 1 20 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.841 0.209 19581
1842 1 20 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.084 0.316 19581
1843 1 20 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.695 0.005 19581
1844 1 20 . 1 1 22 22 LEU H H 22 8.910 8.910 8.204 0.706 19581
1845 1 20 . 1 1 23 23 SER HA H 23 4.130 4.130 4.000 0.130 19581
1846 1 20 . 1 1 23 23 SER CA C 23 62.500 62.500 61.907 0.593 19581
1847 1 20 . 1 1 23 23 SER CB C 23 62.700 62.700 62.776 -0.076 19581
1848 1 20 . 1 1 23 23 SER H H 23 8.070 8.070 7.970 0.100 19581
1849 1 20 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.746 0.084 19581
1850 1 20 . 1 1 24 24 ILE CA C 24 64.900 64.900 63.841 1.059 19581
1851 1 20 . 1 1 24 24 ILE CB C 24 38.300 38.300 37.896 0.404 19581
1852 1 20 . 1 1 24 24 ILE H H 24 8.100 8.100 8.302 -0.202 19581
1853 1 20 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.008 0.112 19581
1854 1 20 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.928 -0.328 19581
1855 1 20 . 1 1 25 25 LYS CB C 25 32.000 32.000 32.125 -0.125 19581
1856 1 20 . 1 1 25 25 LYS H H 25 8.540 8.540 7.836 0.704 19581
1857 1 20 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.120 0.080 19581
1858 1 20 . 1 1 26 26 LYS CA C 26 57.800 57.800 57.839 -0.039 19581
1859 1 20 . 1 1 26 26 LYS CB C 26 32.400 32.400 33.210 -0.810 19581
1860 1 20 . 1 1 26 26 LYS H H 26 8.350 8.350 7.786 0.564 19581
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Entity_delta_chem_shifts_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Data_low_range
_SPARTA_output.Data_high_range
_SPARTA_output.Entry_ID
1 1 1 "Average Difference" N 0 0.000 0.000 0.000 19581
2 1 1 "Average Difference" HA 28 0.181 -0.141 0.116 19581
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19581
4 1 1 "Average Difference" CA 25 0.701 -0.155 0.698 19581
5 1 1 "Average Difference" CB 22 0.585 -0.257 0.539 19581
6 1 1 "Average Difference" HN 24 0.438 -0.110 0.433 19581
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19581
8 1 2 "Average Difference" HA 28 0.156 -0.107 0.116 19581
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19581
10 1 2 "Average Difference" CA 25 0.573 -0.060 0.581 19581
11 1 2 "Average Difference" CB 22 0.616 -0.281 0.560 19581
12 1 2 "Average Difference" HN 24 0.451 -0.131 0.441 19581
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19581
14 1 3 "Average Difference" HA 28 0.174 -0.134 0.113 19581
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19581
16 1 3 "Average Difference" CA 25 0.623 -0.162 0.614 19581
17 1 3 "Average Difference" CB 22 0.541 -0.253 0.490 19581
18 1 3 "Average Difference" HN 24 0.455 -0.140 0.442 19581
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19581
20 1 4 "Average Difference" HA 28 0.186 -0.147 0.116 19581
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19581
22 1 4 "Average Difference" CA 25 0.678 -0.099 0.684 19581
23 1 4 "Average Difference" CB 22 0.524 -0.223 0.485 19581
24 1 4 "Average Difference" HN 24 0.426 -0.130 0.415 19581
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19581
26 1 5 "Average Difference" HA 28 0.199 -0.160 0.120 19581
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19581
28 1 5 "Average Difference" CA 25 0.658 -0.061 0.669 19581
29 1 5 "Average Difference" CB 22 0.546 -0.208 0.516 19581
30 1 5 "Average Difference" HN 24 0.470 -0.105 0.468 19581
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19581
32 1 6 "Average Difference" HA 28 0.167 -0.121 0.117 19581
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19581
34 1 6 "Average Difference" CA 25 0.645 -0.124 0.646 19581
35 1 6 "Average Difference" CB 22 0.632 -0.291 0.574 19581
36 1 6 "Average Difference" HN 24 0.494 -0.175 0.472 19581
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19581
38 1 7 "Average Difference" HA 28 0.161 -0.114 0.115 19581
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19581
40 1 7 "Average Difference" CA 25 0.643 -0.104 0.647 19581
41 1 7 "Average Difference" CB 22 0.687 -0.259 0.651 19581
42 1 7 "Average Difference" HN 24 0.426 -0.160 0.403 19581
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19581
44 1 8 "Average Difference" HA 28 0.157 -0.110 0.114 19581
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19581
46 1 8 "Average Difference" CA 25 0.697 -0.174 0.689 19581
47 1 8 "Average Difference" CB 22 0.585 -0.267 0.532 19581
48 1 8 "Average Difference" HN 24 0.442 -0.126 0.433 19581
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19581
50 1 9 "Average Difference" HA 28 0.157 -0.103 0.121 19581
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19581
52 1 9 "Average Difference" CA 25 0.624 -0.172 0.612 19581
53 1 9 "Average Difference" CB 22 0.602 -0.255 0.558 19581
54 1 9 "Average Difference" HN 24 0.418 -0.122 0.409 19581
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19581
56 1 10 "Average Difference" HA 28 0.155 -0.115 0.106 19581
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19581
58 1 10 "Average Difference" CA 25 0.702 -0.171 0.695 19581
59 1 10 "Average Difference" CB 22 0.626 -0.311 0.556 19581
60 1 10 "Average Difference" HN 24 0.478 -0.124 0.471 19581
61 1 11 "Average Difference" N 0 0.000 0.000 0.000 19581
62 1 11 "Average Difference" HA 28 0.166 -0.109 0.127 19581
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19581
64 1 11 "Average Difference" CA 25 0.692 -0.149 0.690 19581
65 1 11 "Average Difference" CB 22 0.654 -0.277 0.606 19581
66 1 11 "Average Difference" HN 24 0.456 -0.129 0.447 19581
67 1 12 "Average Difference" N 0 0.000 0.000 0.000 19581
68 1 12 "Average Difference" HA 28 0.182 -0.148 0.108 19581
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19581
70 1 12 "Average Difference" CA 25 0.669 -0.218 0.646 19581
71 1 12 "Average Difference" CB 22 0.573 -0.200 0.550 19581
72 1 12 "Average Difference" HN 24 0.474 -0.169 0.452 19581
73 1 13 "Average Difference" N 0 0.000 0.000 0.000 19581
74 1 13 "Average Difference" HA 28 0.205 -0.165 0.124 19581
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19581
76 1 13 "Average Difference" CA 25 0.609 -0.129 0.607 19581
77 1 13 "Average Difference" CB 22 0.558 -0.240 0.515 19581
78 1 13 "Average Difference" HN 24 0.431 -0.189 0.396 19581
79 1 14 "Average Difference" N 0 0.000 0.000 0.000 19581
80 1 14 "Average Difference" HA 28 0.184 -0.147 0.113 19581
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19581
82 1 14 "Average Difference" CA 25 0.634 -0.146 0.629 19581
83 1 14 "Average Difference" CB 22 0.621 -0.260 0.577 19581
84 1 14 "Average Difference" HN 24 0.503 -0.133 0.496 19581
85 1 15 "Average Difference" N 0 0.000 0.000 0.000 19581
86 1 15 "Average Difference" HA 28 0.175 -0.133 0.115 19581
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19581
88 1 15 "Average Difference" CA 25 0.706 -0.190 0.694 19581
89 1 15 "Average Difference" CB 22 0.567 -0.283 0.503 19581
90 1 15 "Average Difference" HN 24 0.489 -0.126 0.483 19581
91 1 16 "Average Difference" N 0 0.000 0.000 0.000 19581
92 1 16 "Average Difference" HA 28 0.175 -0.125 0.124 19581
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19581
94 1 16 "Average Difference" CA 25 0.652 -0.213 0.629 19581
95 1 16 "Average Difference" CB 22 0.617 -0.269 0.569 19581
96 1 16 "Average Difference" HN 24 0.448 -0.126 0.439 19581
97 1 17 "Average Difference" N 0 0.000 0.000 0.000 19581
98 1 17 "Average Difference" HA 28 0.159 -0.101 0.125 19581
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19581
100 1 17 "Average Difference" CA 25 0.676 -0.124 0.678 19581
101 1 17 "Average Difference" CB 22 0.577 -0.251 0.531 19581
102 1 17 "Average Difference" HN 24 0.366 -0.133 0.348 19581
103 1 18 "Average Difference" N 0 0.000 0.000 0.000 19581
104 1 18 "Average Difference" HA 28 0.194 -0.145 0.131 19581
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19581
106 1 18 "Average Difference" CA 25 0.736 -0.240 0.710 19581
107 1 18 "Average Difference" CB 22 0.631 -0.291 0.574 19581
108 1 18 "Average Difference" HN 24 0.466 -0.108 0.463 19581
109 1 19 "Average Difference" N 0 0.000 0.000 0.000 19581
110 1 19 "Average Difference" HA 28 0.161 -0.118 0.112 19581
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19581
112 1 19 "Average Difference" CA 25 0.669 -0.184 0.657 19581
113 1 19 "Average Difference" CB 22 0.606 -0.220 0.578 19581
114 1 19 "Average Difference" HN 24 0.402 -0.109 0.396 19581
115 1 20 "Average Difference" N 0 0.000 0.000 0.000 19581
116 1 20 "Average Difference" HA 28 0.158 -0.115 0.109 19581
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19581
118 1 20 "Average Difference" CA 25 0.685 -0.162 0.680 19581
119 1 20 "Average Difference" CB 22 0.696 -0.297 0.644 19581
120 1 20 "Average Difference" HN 24 0.432 -0.167 0.407 19581
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 19581
_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 HA H 2 4.210 4.210 4.092 0.118 19581
2 1 . 1 1 2 2 LYS CA C 2 58.800 58.800 58.832 -0.032 19581
3 1 . 1 1 2 2 LYS CB C 2 33.100 33.100 32.279 0.821 19581
4 1 . 1 1 3 3 LYS HA H 3 4.090 4.090 4.097 -0.007 19581
5 1 . 1 1 3 3 LYS CA C 3 59.100 59.100 59.100 0.000 19581
6 1 . 1 1 3 3 LYS CB C 3 32.700 32.700 31.975 0.725 19581
7 1 . 1 1 3 3 LYS H H 3 8.170 8.170 8.287 -0.117 19581
8 1 . 1 1 4 4 LEU HA H 4 4.290 4.290 4.071 0.219 19581
9 1 . 1 1 4 4 LEU CA C 4 57.400 57.400 57.588 -0.188 19581
10 1 . 1 1 4 4 LEU CB C 4 42.300 42.300 41.363 0.937 19581
11 1 . 1 1 4 4 LEU H H 4 7.210 7.210 7.741 -0.531 19581
12 1 . 1 1 5 5 PHE HA H 5 4.290 4.290 4.065 0.225 19581
13 1 . 1 1 5 5 PHE CA C 5 61.300 61.300 62.161 -0.861 19581
14 1 . 1 1 5 5 PHE CB C 5 38.900 38.900 39.180 -0.279 19581
15 1 . 1 1 5 5 PHE H H 5 7.670 7.670 7.749 -0.079 19581
16 1 . 1 1 6 6 ILE HA H 6 3.720 3.720 3.489 0.231 19581
17 1 . 1 1 6 6 ILE CA C 6 64.400 64.400 65.511 -1.111 19581
18 1 . 1 1 6 6 ILE CB C 6 38.000 38.000 37.801 0.199 19581
19 1 . 1 1 6 6 ILE H H 6 7.790 7.790 8.555 -0.765 19581
20 1 . 1 1 7 7 MET HA H 7 4.170 4.170 4.043 0.127 19581
21 1 . 1 1 7 7 MET CA C 7 58.700 58.700 58.842 -0.142 19581
22 1 . 1 1 7 7 MET CB C 7 32.500 32.500 32.106 0.394 19581
23 1 . 1 1 7 7 MET H H 7 7.800 7.800 7.716 0.084 19581
24 1 . 1 1 8 8 ILE HA H 8 3.830 3.830 3.708 0.122 19581
25 1 . 1 1 8 8 ILE CA C 8 65.100 65.100 64.987 0.113 19581
26 1 . 1 1 8 8 ILE CB C 8 38.400 38.400 37.715 0.685 19581
27 1 . 1 1 8 8 ILE H H 8 8.190 8.190 7.767 0.423 19581
28 1 . 1 1 9 9 VAL HA H 9 3.640 3.640 3.694 -0.054 19581
29 1 . 1 1 9 9 VAL CA C 9 67.000 67.000 65.360 1.640 19581
30 1 . 1 1 9 9 VAL CB C 9 31.500 31.500 30.356 1.144 19581
31 1 . 1 1 9 9 VAL H H 9 8.350 8.350 7.910 0.440 19581
32 1 . 1 1 10 10 GLY CA C 10 46.900 46.900 47.306 -0.406 19581
33 1 . 1 1 10 10 GLY H H 10 8.370 8.370 8.435 -0.065 19581
34 1 . 1 1 11 11 GLY CA C 11 46.300 46.300 46.571 -0.271 19581
35 1 . 1 1 11 11 GLY H H 11 7.800 7.800 7.568 0.233 19581
36 1 . 1 1 12 12 LEU HA H 12 4.260 4.260 4.062 0.198 19581
37 1 . 1 1 12 12 LEU CA C 12 57.800 57.800 57.422 0.379 19581
38 1 . 1 1 12 12 LEU CB C 12 42.100 42.100 41.483 0.617 19581
39 1 . 1 1 12 12 LEU H H 12 8.070 8.070 7.440 0.630 19581
40 1 . 1 1 13 13 VAL HA H 13 3.700 3.700 3.698 0.002 19581
41 1 . 1 1 13 13 VAL CA C 13 66.700 66.700 66.158 0.542 19581
42 1 . 1 1 13 13 VAL CB C 13 31.900 31.900 31.187 0.713 19581
43 1 . 1 1 13 13 VAL H H 13 8.450 8.450 8.180 0.270 19581
44 1 . 1 1 14 14 GLY CA C 14 47.000 47.000 47.192 -0.192 19581
45 1 . 1 1 14 14 GLY H H 14 7.900 7.900 8.097 -0.197 19581
46 1 . 1 1 15 15 LEU HA H 15 4.120 4.120 4.066 0.054 19581
47 1 . 1 1 15 15 LEU CA C 15 57.700 57.700 57.526 0.174 19581
48 1 . 1 1 15 15 LEU CB C 15 42.000 42.000 41.274 0.726 19581
49 1 . 1 1 15 15 LEU H H 15 7.800 7.800 7.834 -0.034 19581
50 1 . 1 1 16 16 ARG HA H 16 4.110 4.110 4.109 0.001 19581
51 1 . 1 1 16 16 ARG CA C 16 59.200 59.200 59.406 -0.206 19581
52 1 . 1 1 16 16 ARG CB C 16 29.400 29.400 29.764 -0.364 19581
53 1 . 1 1 16 16 ARG H H 16 7.750 7.750 7.759 -0.009 19581
54 1 . 1 1 17 17 ILE HA H 17 3.870 3.870 3.815 0.055 19581
55 1 . 1 1 17 17 ILE CA C 17 65.000 65.000 64.750 0.250 19581
56 1 . 1 1 17 17 ILE CB C 17 37.900 37.900 37.767 0.133 19581
57 1 . 1 1 17 17 ILE H H 17 7.910 7.910 7.472 0.438 19581
58 1 . 1 1 18 18 VAL HA H 18 3.560 3.560 3.605 -0.045 19581
59 1 . 1 1 18 18 VAL CA C 18 67.500 67.500 66.769 0.731 19581
60 1 . 1 1 18 18 VAL CB C 18 31.600 31.600 31.263 0.337 19581
61 1 . 1 1 18 18 VAL H H 18 8.030 8.030 8.168 -0.138 19581
62 1 . 1 1 19 19 PHE HA H 19 4.340 4.340 4.066 0.274 19581
63 1 . 1 1 19 19 PHE CA C 19 61.000 61.000 61.490 -0.490 19581
64 1 . 1 1 19 19 PHE CB C 19 38.400 38.400 38.555 -0.155 19581
65 1 . 1 1 19 19 PHE H H 19 8.370 8.370 8.656 -0.286 19581
66 1 . 1 1 20 20 ALA HA H 20 4.150 4.150 3.897 0.253 19581
67 1 . 1 1 20 20 ALA CA C 20 55.900 55.900 55.293 0.607 19581
68 1 . 1 1 20 20 ALA CB C 20 17.400 17.400 18.054 -0.654 19581
69 1 . 1 1 20 20 ALA H H 20 8.190 8.190 7.817 0.373 19581
70 1 . 1 1 21 21 VAL HA H 21 3.630 3.630 3.611 0.019 19581
71 1 . 1 1 21 21 VAL CA C 21 67.300 67.300 66.573 0.727 19581
72 1 . 1 1 21 21 VAL CB C 21 31.700 31.700 31.403 0.297 19581
73 1 . 1 1 21 21 VAL H H 21 8.690 8.690 7.823 0.867 19581
74 1 . 1 1 22 22 LEU HA H 22 4.050 4.050 3.834 0.216 19581
75 1 . 1 1 22 22 LEU CA C 22 58.400 58.400 58.276 0.124 19581
76 1 . 1 1 22 22 LEU CB C 22 41.700 41.700 41.493 0.206 19581
77 1 . 1 1 22 22 LEU H H 22 8.910 8.910 8.406 0.504 19581
78 1 . 1 1 23 23 SER HA H 23 4.130 4.130 4.070 0.060 19581
79 1 . 1 1 23 23 SER CA C 23 62.500 62.500 61.538 0.962 19581
80 1 . 1 1 23 23 SER CB C 23 62.700 62.700 63.022 -0.322 19581
81 1 . 1 1 23 23 SER H H 23 8.070 8.070 8.028 0.042 19581
82 1 . 1 1 24 24 ILE HA H 24 3.830 3.830 3.780 0.050 19581
83 1 . 1 1 24 24 ILE CA C 24 64.900 64.900 64.026 0.874 19581
84 1 . 1 1 24 24 ILE CB C 24 38.300 38.300 37.971 0.329 19581
85 1 . 1 1 24 24 ILE H H 24 8.100 8.100 8.159 -0.059 19581
86 1 . 1 1 25 25 LYS HA H 25 4.120 4.120 4.046 0.074 19581
87 1 . 1 1 25 25 LYS CA C 25 58.600 58.600 58.694 -0.094 19581
88 1 . 1 1 25 25 LYS CB C 25 32.000 32.000 32.137 -0.137 19581
89 1 . 1 1 25 25 LYS H H 25 8.540 8.540 7.975 0.565 19581
90 1 . 1 1 26 26 LYS HA H 26 4.200 4.200 4.180 0.020 19581
91 1 . 1 1 26 26 LYS CA C 26 57.800 57.800 57.132 0.668 19581
92 1 . 1 1 26 26 LYS CB C 26 32.400 32.400 33.038 -0.638 19581
93 1 . 1 1 26 26 LYS H H 26 8.350 8.350 7.684 0.666 19581
stop_
save_