data_19582
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19582
_Entry.PDB_ID 2MG2
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 19582
_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 4.430 4.430 4.513 -0.083 19582
2 1 1 . 1 1 2 2 LYS CA C 2 56.600 56.600 56.528 0.072 19582
3 1 1 . 1 1 2 2 LYS CB C 2 33.500 33.500 33.236 0.264 19582
4 1 1 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.432 -0.052 19582
5 1 1 . 1 1 3 3 LYS CA C 3 56.700 56.700 55.484 1.216 19582
6 1 1 . 1 1 3 3 LYS CB C 3 33.300 33.300 33.401 -0.101 19582
7 1 1 . 1 1 3 3 LYS H H 3 8.380 8.380 7.753 0.627 19582
8 1 1 . 1 1 4 4 ASN CB C 4 39.500 39.500 40.868 -1.368 19582
9 1 1 . 1 1 4 4 ASN H H 4 8.570 8.570 8.349 0.221 19582
10 1 1 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.400 0.060 19582
11 1 1 . 1 1 5 5 TRP CA C 5 59.200 59.200 59.589 -0.389 19582
12 1 1 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.897 0.303 19582
13 1 1 . 1 1 5 5 TRP H H 5 8.000 8.000 8.887 -0.887 19582
14 1 1 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.744 0.536 19582
15 1 1 . 1 1 6 6 PHE CA C 6 59.000 59.000 59.963 -0.963 19582
16 1 1 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.246 0.254 19582
17 1 1 . 1 1 6 6 PHE H H 6 7.400 7.400 7.145 0.255 19582
18 1 1 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.666 -0.076 19582
19 1 1 . 1 1 7 7 ASP CA C 7 55.700 55.700 56.328 -0.628 19582
20 1 1 . 1 1 7 7 ASP CB C 7 41.400 41.400 42.061 -0.661 19582
21 1 1 . 1 1 7 7 ASP H H 7 7.860 7.860 7.927 -0.067 19582
22 1 1 . 1 1 8 8 ILE HA H 8 4.050 4.050 3.997 0.053 19582
23 1 1 . 1 1 8 8 ILE CA C 8 65.400 65.400 63.398 2.002 19582
24 1 1 . 1 1 8 8 ILE CB C 8 38.600 38.600 36.565 2.035 19582
25 1 1 . 1 1 8 8 ILE H H 8 7.840 7.840 7.633 0.207 19582
26 1 1 . 1 1 9 9 THR HA H 9 4.050 4.050 4.036 0.014 19582
27 1 1 . 1 1 9 9 THR CA C 9 64.000 64.000 66.727 -2.727 19582
28 1 1 . 1 1 9 9 THR CB C 9 69.100 69.100 68.448 0.652 19582
29 1 1 . 1 1 9 9 THR H H 9 8.080 8.080 7.875 0.205 19582
30 1 1 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.505 0.145 19582
31 1 1 . 1 1 10 10 ASN CB C 10 38.700 38.700 38.350 0.350 19582
32 1 1 . 1 1 10 10 ASN H H 10 7.930 7.930 7.840 0.090 19582
33 1 1 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.478 0.272 19582
34 1 1 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.311 0.189 19582
35 1 1 . 1 1 11 11 TRP H H 11 7.910 7.910 7.674 0.236 19582
36 1 1 . 1 1 12 12 LEU HA H 12 4.050 4.050 4.035 0.015 19582
37 1 1 . 1 1 12 12 LEU CA C 12 57.900 57.900 58.541 -0.641 19582
38 1 1 . 1 1 12 12 LEU CB C 12 41.800 41.800 41.275 0.525 19582
39 1 1 . 1 1 12 12 LEU H H 12 8.000 8.000 8.091 -0.091 19582
40 1 1 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.283 -0.033 19582
41 1 1 . 1 1 13 13 TRP CA C 13 60.300 60.300 62.480 -2.180 19582
42 1 1 . 1 1 13 13 TRP CB C 13 28.700 28.700 29.090 -0.390 19582
43 1 1 . 1 1 13 13 TRP H H 13 7.850 7.850 8.111 -0.261 19582
44 1 1 . 1 1 14 14 TYR HA H 14 4.050 4.050 4.096 -0.046 19582
45 1 1 . 1 1 14 14 TYR CA C 14 61.300 61.300 62.583 -1.283 19582
46 1 1 . 1 1 14 14 TYR H H 14 7.400 7.400 7.659 -0.259 19582
47 1 1 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.791 0.009 19582
48 1 1 . 1 1 15 15 ILE CA C 15 64.300 64.300 64.496 -0.196 19582
49 1 1 . 1 1 15 15 ILE CB C 15 37.700 37.700 37.811 -0.111 19582
50 1 1 . 1 1 15 15 ILE H H 15 7.930 7.930 7.582 0.348 19582
51 1 1 . 1 1 16 16 LYS HA H 16 3.920 3.920 3.969 -0.049 19582
52 1 1 . 1 1 16 16 LYS CA C 16 60.100 60.100 58.970 1.130 19582
53 1 1 . 1 1 16 16 LYS CB C 16 32.000 32.000 31.948 0.052 19582
54 1 1 . 1 1 16 16 LYS H H 16 7.880 7.880 7.833 0.047 19582
55 1 1 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.724 0.356 19582
56 1 1 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.798 0.402 19582
57 1 1 . 1 1 17 17 LEU CB C 17 41.700 41.700 41.430 0.270 19582
58 1 1 . 1 1 17 17 LEU H H 17 7.580 7.580 8.023 -0.443 19582
59 1 1 . 1 1 18 18 PHE HA H 18 4.140 4.140 4.037 0.103 19582
60 1 1 . 1 1 18 18 PHE CA C 18 61.900 61.900 61.854 0.046 19582
61 1 1 . 1 1 18 18 PHE CB C 18 38.900 38.900 38.850 0.050 19582
62 1 1 . 1 1 18 18 PHE H H 18 8.140 8.140 7.492 0.648 19582
63 1 1 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.570 0.020 19582
64 1 1 . 1 1 19 19 ILE CA C 19 65.100 65.100 65.129 -0.029 19582
65 1 1 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.605 0.295 19582
66 1 1 . 1 1 19 19 ILE H H 19 8.470 8.470 7.448 1.022 19582
67 1 1 . 1 1 20 20 MET HA H 20 4.130 4.130 4.015 0.115 19582
68 1 1 . 1 1 20 20 MET CA C 20 59.100 59.100 58.920 0.180 19582
69 1 1 . 1 1 20 20 MET CB C 20 32.600 32.600 32.263 0.337 19582
70 1 1 . 1 1 20 20 MET H H 20 8.110 8.110 7.188 0.922 19582
71 1 1 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.561 0.249 19582
72 1 1 . 1 1 21 21 ILE CA C 21 65.100 65.100 65.420 -0.320 19582
73 1 1 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.601 0.699 19582
74 1 1 . 1 1 21 21 ILE H H 21 8.550 8.550 8.184 0.366 19582
75 1 1 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.447 0.153 19582
76 1 1 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.314 0.586 19582
77 1 1 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.965 0.235 19582
78 1 1 . 1 1 22 22 VAL H H 22 8.640 8.640 8.241 0.399 19582
79 1 1 . 1 1 23 23 GLY CA C 23 46.900 46.900 47.120 -0.220 19582
80 1 1 . 1 1 23 23 GLY H H 23 8.320 8.320 8.189 0.131 19582
81 1 1 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.883 1.717 19582
82 1 1 . 1 1 24 24 GLY H H 24 7.620 7.620 7.384 0.236 19582
83 1 1 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.348 -0.118 19582
84 1 1 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.116 -0.016 19582
85 1 1 . 1 1 25 25 LEU H H 25 8.050 8.050 7.769 0.281 19582
86 1 1 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.781 0.049 19582
87 1 1 . 1 1 26 26 VAL CA C 26 65.300 65.300 64.720 0.580 19582
88 1 1 . 1 1 26 26 VAL CB C 26 32.000 32.000 32.259 -0.259 19582
89 1 1 . 1 1 26 26 VAL H H 26 8.310 8.310 8.234 0.076 19582
90 1 1 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.144 0.076 19582
91 1 1 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.559 1.141 19582
92 1 1 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.434 0.065 19582
93 1 1 . 1 1 27 27 LYS H H 27 7.850 7.850 8.396 -0.546 19582
94 1 2 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.535 -0.105 19582
95 1 2 . 1 1 2 2 LYS CA C 2 56.600 56.600 56.026 0.573 19582
96 1 2 . 1 1 2 2 LYS CB C 2 33.500 33.500 32.835 0.665 19582
97 1 2 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.423 -0.043 19582
98 1 2 . 1 1 3 3 LYS CA C 3 56.700 56.700 55.863 0.837 19582
99 1 2 . 1 1 3 3 LYS CB C 3 33.300 33.300 32.711 0.589 19582
100 1 2 . 1 1 3 3 LYS H H 3 8.380 8.380 7.827 0.553 19582
101 1 2 . 1 1 4 4 ASN CB C 4 39.500 39.500 39.314 0.186 19582
102 1 2 . 1 1 4 4 ASN H H 4 8.570 8.570 8.814 -0.244 19582
103 1 2 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.394 0.066 19582
104 1 2 . 1 1 5 5 TRP CA C 5 59.200 59.200 58.981 0.219 19582
105 1 2 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.644 0.556 19582
106 1 2 . 1 1 5 5 TRP H H 5 8.000 8.000 9.067 -1.067 19582
107 1 2 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.539 0.741 19582
108 1 2 . 1 1 6 6 PHE CA C 6 59.000 59.000 60.564 -1.564 19582
109 1 2 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.385 0.115 19582
110 1 2 . 1 1 6 6 PHE H H 6 7.400 7.400 7.409 -0.009 19582
111 1 2 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.650 -0.060 19582
112 1 2 . 1 1 7 7 ASP CA C 7 55.700 55.700 56.792 -1.092 19582
113 1 2 . 1 1 7 7 ASP CB C 7 41.400 41.400 41.492 -0.092 19582
114 1 2 . 1 1 7 7 ASP H H 7 7.860 7.860 7.809 0.051 19582
115 1 2 . 1 1 8 8 ILE HA H 8 4.050 4.050 3.923 0.127 19582
116 1 2 . 1 1 8 8 ILE CA C 8 65.400 65.400 64.281 1.119 19582
117 1 2 . 1 1 8 8 ILE CB C 8 38.600 38.600 37.025 1.575 19582
118 1 2 . 1 1 8 8 ILE H H 8 7.840 7.840 7.480 0.360 19582
119 1 2 . 1 1 9 9 THR HA H 9 4.050 4.050 4.064 -0.014 19582
120 1 2 . 1 1 9 9 THR CA C 9 64.000 64.000 66.299 -2.299 19582
121 1 2 . 1 1 9 9 THR CB C 9 69.100 69.100 68.592 0.508 19582
122 1 2 . 1 1 9 9 THR H H 9 8.080 8.080 7.772 0.308 19582
123 1 2 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.686 -0.036 19582
124 1 2 . 1 1 10 10 ASN CB C 10 38.700 38.700 38.183 0.517 19582
125 1 2 . 1 1 10 10 ASN H H 10 7.930 7.930 7.374 0.556 19582
126 1 2 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.237 0.513 19582
127 1 2 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.419 0.081 19582
128 1 2 . 1 1 11 11 TRP H H 11 7.910 7.910 7.679 0.231 19582
129 1 2 . 1 1 12 12 LEU HA H 12 4.050 4.050 4.003 0.048 19582
130 1 2 . 1 1 12 12 LEU CA C 12 57.900 57.900 58.421 -0.521 19582
131 1 2 . 1 1 12 12 LEU CB C 12 41.800 41.800 41.276 0.524 19582
132 1 2 . 1 1 12 12 LEU H H 12 8.000 8.000 8.082 -0.082 19582
133 1 2 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.431 -0.181 19582
134 1 2 . 1 1 13 13 TRP CA C 13 60.300 60.300 59.209 1.091 19582
135 1 2 . 1 1 13 13 TRP CB C 13 28.700 28.700 28.340 0.360 19582
136 1 2 . 1 1 13 13 TRP H H 13 7.850 7.850 7.558 0.292 19582
137 1 2 . 1 1 14 14 TYR HA H 14 4.050 4.050 3.433 0.617 19582
138 1 2 . 1 1 14 14 TYR CA C 14 61.300 61.300 62.127 -0.827 19582
139 1 2 . 1 1 14 14 TYR H H 14 7.400 7.400 6.862 0.538 19582
140 1 2 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.602 0.198 19582
141 1 2 . 1 1 15 15 ILE CA C 15 64.300 64.300 65.796 -1.496 19582
142 1 2 . 1 1 15 15 ILE CB C 15 37.700 37.700 37.812 -0.112 19582
143 1 2 . 1 1 15 15 ILE H H 15 7.930 7.930 8.529 -0.599 19582
144 1 2 . 1 1 16 16 LYS HA H 16 3.920 3.920 4.068 -0.148 19582
145 1 2 . 1 1 16 16 LYS CA C 16 60.100 60.100 59.458 0.642 19582
146 1 2 . 1 1 16 16 LYS CB C 16 32.000 32.000 32.239 -0.239 19582
147 1 2 . 1 1 16 16 LYS H H 16 7.880 7.880 7.551 0.329 19582
148 1 2 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.995 0.085 19582
149 1 2 . 1 1 17 17 LEU CA C 17 58.200 58.200 58.044 0.156 19582
150 1 2 . 1 1 17 17 LEU CB C 17 41.700 41.700 41.502 0.198 19582
151 1 2 . 1 1 17 17 LEU H H 17 7.580 7.580 8.178 -0.598 19582
152 1 2 . 1 1 18 18 PHE HA H 18 4.140 4.140 3.918 0.222 19582
153 1 2 . 1 1 18 18 PHE CA C 18 61.900 61.900 62.449 -0.549 19582
154 1 2 . 1 1 18 18 PHE CB C 18 38.900 38.900 39.078 -0.178 19582
155 1 2 . 1 1 18 18 PHE H H 18 8.140 8.140 7.818 0.322 19582
156 1 2 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.500 0.090 19582
157 1 2 . 1 1 19 19 ILE CA C 19 65.100 65.100 65.304 -0.204 19582
158 1 2 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.853 0.047 19582
159 1 2 . 1 1 19 19 ILE H H 19 8.470 8.470 7.492 0.978 19582
160 1 2 . 1 1 20 20 MET HA H 20 4.130 4.130 4.104 0.026 19582
161 1 2 . 1 1 20 20 MET CA C 20 59.100 59.100 58.900 0.200 19582
162 1 2 . 1 1 20 20 MET CB C 20 32.600 32.600 32.420 0.180 19582
163 1 2 . 1 1 20 20 MET H H 20 8.110 8.110 8.026 0.084 19582
164 1 2 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.691 0.119 19582
165 1 2 . 1 1 21 21 ILE CA C 21 65.100 65.100 64.665 0.435 19582
166 1 2 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.853 0.447 19582
167 1 2 . 1 1 21 21 ILE H H 21 8.550 8.550 7.680 0.870 19582
168 1 2 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.505 0.095 19582
169 1 2 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.213 0.687 19582
170 1 2 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.430 0.770 19582
171 1 2 . 1 1 22 22 VAL H H 22 8.640 8.640 8.223 0.417 19582
172 1 2 . 1 1 23 23 GLY CA C 23 46.900 46.900 47.285 -0.385 19582
173 1 2 . 1 1 23 23 GLY H H 23 8.320 8.320 8.585 -0.265 19582
174 1 2 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.574 2.026 19582
175 1 2 . 1 1 24 24 GLY H H 24 7.620 7.620 7.451 0.169 19582
176 1 2 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.353 -0.123 19582
177 1 2 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.270 -0.170 19582
178 1 2 . 1 1 25 25 LEU H H 25 8.050 8.050 7.635 0.415 19582
179 1 2 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.780 0.050 19582
180 1 2 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.034 0.266 19582
181 1 2 . 1 1 26 26 VAL CB C 26 32.000 32.000 32.569 -0.569 19582
182 1 2 . 1 1 26 26 VAL H H 26 8.310 8.310 8.137 0.173 19582
183 1 2 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.196 0.024 19582
184 1 2 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.567 1.133 19582
185 1 2 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.359 0.141 19582
186 1 2 . 1 1 27 27 LYS H H 27 7.850 7.850 8.417 -0.567 19582
187 1 3 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.653 -0.223 19582
188 1 3 . 1 1 2 2 LYS CA C 2 56.600 56.600 56.065 0.535 19582
189 1 3 . 1 1 2 2 LYS CB C 2 33.500 33.500 33.544 -0.044 19582
190 1 3 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.553 -0.173 19582
191 1 3 . 1 1 3 3 LYS CA C 3 56.700 56.700 55.469 1.231 19582
192 1 3 . 1 1 3 3 LYS CB C 3 33.300 33.300 34.143 -0.843 19582
193 1 3 . 1 1 3 3 LYS H H 3 8.380 8.380 8.396 -0.016 19582
194 1 3 . 1 1 4 4 ASN CB C 4 39.500 39.500 39.450 0.050 19582
195 1 3 . 1 1 4 4 ASN H H 4 8.570 8.570 8.596 -0.026 19582
196 1 3 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.372 0.088 19582
197 1 3 . 1 1 5 5 TRP CA C 5 59.200 59.200 59.266 -0.066 19582
198 1 3 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.613 0.587 19582
199 1 3 . 1 1 5 5 TRP H H 5 8.000 8.000 8.938 -0.938 19582
200 1 3 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.696 0.584 19582
201 1 3 . 1 1 6 6 PHE CA C 6 59.000 59.000 60.693 -1.693 19582
202 1 3 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.398 0.102 19582
203 1 3 . 1 1 6 6 PHE H H 6 7.400 7.400 7.313 0.087 19582
204 1 3 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.494 0.096 19582
205 1 3 . 1 1 7 7 ASP CA C 7 55.700 55.700 57.772 -2.072 19582
206 1 3 . 1 1 7 7 ASP CB C 7 41.400 41.400 40.819 0.581 19582
207 1 3 . 1 1 7 7 ASP H H 7 7.860 7.860 7.908 -0.048 19582
208 1 3 . 1 1 8 8 ILE HA H 8 4.050 4.050 4.117 -0.067 19582
209 1 3 . 1 1 8 8 ILE CA C 8 65.400 65.400 63.391 2.010 19582
210 1 3 . 1 1 8 8 ILE CB C 8 38.600 38.600 37.302 1.298 19582
211 1 3 . 1 1 8 8 ILE H H 8 7.840 7.840 7.315 0.525 19582
212 1 3 . 1 1 9 9 THR HA H 9 4.050 4.050 3.971 0.079 19582
213 1 3 . 1 1 9 9 THR CA C 9 64.000 64.000 66.500 -2.500 19582
214 1 3 . 1 1 9 9 THR CB C 9 69.100 69.100 68.203 0.897 19582
215 1 3 . 1 1 9 9 THR H H 9 8.080 8.080 8.425 -0.345 19582
216 1 3 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.567 0.083 19582
217 1 3 . 1 1 10 10 ASN CB C 10 38.700 38.700 38.197 0.503 19582
218 1 3 . 1 1 10 10 ASN H H 10 7.930 7.930 7.623 0.307 19582
219 1 3 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.151 0.599 19582
220 1 3 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.329 0.171 19582
221 1 3 . 1 1 11 11 TRP H H 11 7.910 7.910 7.258 0.652 19582
222 1 3 . 1 1 12 12 LEU HA H 12 4.050 4.050 3.905 0.145 19582
223 1 3 . 1 1 12 12 LEU CA C 12 57.900 57.900 58.125 -0.225 19582
224 1 3 . 1 1 12 12 LEU CB C 12 41.800 41.800 41.966 -0.166 19582
225 1 3 . 1 1 12 12 LEU H H 12 8.000 8.000 8.008 -0.008 19582
226 1 3 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.414 -0.164 19582
227 1 3 . 1 1 13 13 TRP CA C 13 60.300 60.300 58.756 1.544 19582
228 1 3 . 1 1 13 13 TRP CB C 13 28.700 28.700 28.836 -0.136 19582
229 1 3 . 1 1 13 13 TRP H H 13 7.850 7.850 7.418 0.432 19582
230 1 3 . 1 1 14 14 TYR HA H 14 4.050 4.050 3.531 0.519 19582
231 1 3 . 1 1 14 14 TYR CA C 14 61.300 61.300 61.641 -0.341 19582
232 1 3 . 1 1 14 14 TYR H H 14 7.400 7.400 6.896 0.504 19582
233 1 3 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.653 0.147 19582
234 1 3 . 1 1 15 15 ILE CA C 15 64.300 64.300 65.343 -1.043 19582
235 1 3 . 1 1 15 15 ILE CB C 15 37.700 37.700 37.604 0.096 19582
236 1 3 . 1 1 15 15 ILE H H 15 7.930 7.930 8.637 -0.707 19582
237 1 3 . 1 1 16 16 LYS HA H 16 3.920 3.920 4.103 -0.183 19582
238 1 3 . 1 1 16 16 LYS CA C 16 60.100 60.100 59.364 0.736 19582
239 1 3 . 1 1 16 16 LYS CB C 16 32.000 32.000 32.263 -0.263 19582
240 1 3 . 1 1 16 16 LYS H H 16 7.880 7.880 7.672 0.208 19582
241 1 3 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.980 0.100 19582
242 1 3 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.454 0.746 19582
243 1 3 . 1 1 17 17 LEU CB C 17 41.700 41.700 41.575 0.124 19582
244 1 3 . 1 1 17 17 LEU H H 17 7.580 7.580 7.697 -0.117 19582
245 1 3 . 1 1 18 18 PHE HA H 18 4.140 4.140 4.072 0.068 19582
246 1 3 . 1 1 18 18 PHE CA C 18 61.900 61.900 61.937 -0.037 19582
247 1 3 . 1 1 18 18 PHE CB C 18 38.900 38.900 39.159 -0.259 19582
248 1 3 . 1 1 18 18 PHE H H 18 8.140 8.140 7.655 0.485 19582
249 1 3 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.501 0.089 19582
250 1 3 . 1 1 19 19 ILE CA C 19 65.100 65.100 65.349 -0.249 19582
251 1 3 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.852 0.048 19582
252 1 3 . 1 1 19 19 ILE H H 19 8.470 8.470 7.529 0.941 19582
253 1 3 . 1 1 20 20 MET HA H 20 4.130 4.130 4.106 0.024 19582
254 1 3 . 1 1 20 20 MET CA C 20 59.100 59.100 58.872 0.228 19582
255 1 3 . 1 1 20 20 MET CB C 20 32.600 32.600 32.362 0.238 19582
256 1 3 . 1 1 20 20 MET H H 20 8.110 8.110 7.753 0.357 19582
257 1 3 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.691 0.119 19582
258 1 3 . 1 1 21 21 ILE CA C 21 65.100 65.100 64.703 0.397 19582
259 1 3 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.844 0.456 19582
260 1 3 . 1 1 21 21 ILE H H 21 8.550 8.550 7.649 0.901 19582
261 1 3 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.497 0.103 19582
262 1 3 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.244 0.656 19582
263 1 3 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.409 0.791 19582
264 1 3 . 1 1 22 22 VAL H H 22 8.640 8.640 8.338 0.302 19582
265 1 3 . 1 1 23 23 GLY CA C 23 46.900 46.900 47.034 -0.134 19582
266 1 3 . 1 1 23 23 GLY H H 23 8.320 8.320 8.596 -0.276 19582
267 1 3 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.708 1.892 19582
268 1 3 . 1 1 24 24 GLY H H 24 7.620 7.620 7.576 0.044 19582
269 1 3 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.457 -0.227 19582
270 1 3 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.484 -0.384 19582
271 1 3 . 1 1 25 25 LEU H H 25 8.050 8.050 7.743 0.307 19582
272 1 3 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.749 0.081 19582
273 1 3 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.602 -0.302 19582
274 1 3 . 1 1 26 26 VAL CB C 26 32.000 32.000 32.245 -0.245 19582
275 1 3 . 1 1 26 26 VAL H H 26 8.310 8.310 8.417 -0.107 19582
276 1 3 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.294 -0.074 19582
277 1 3 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.808 0.892 19582
278 1 3 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.269 0.231 19582
279 1 3 . 1 1 27 27 LYS H H 27 7.850 7.850 8.494 -0.644 19582
280 1 4 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.522 -0.092 19582
281 1 4 . 1 1 2 2 LYS CA C 2 56.600 56.600 55.988 0.612 19582
282 1 4 . 1 1 2 2 LYS CB C 2 33.500 33.500 33.116 0.384 19582
283 1 4 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.585 -0.205 19582
284 1 4 . 1 1 3 3 LYS CA C 3 56.700 56.700 56.444 0.256 19582
285 1 4 . 1 1 3 3 LYS CB C 3 33.300 33.300 33.445 -0.145 19582
286 1 4 . 1 1 3 3 LYS H H 3 8.380 8.380 8.377 0.003 19582
287 1 4 . 1 1 4 4 ASN CB C 4 39.500 39.500 40.517 -1.017 19582
288 1 4 . 1 1 4 4 ASN H H 4 8.570 8.570 8.077 0.493 19582
289 1 4 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.519 -0.059 19582
290 1 4 . 1 1 5 5 TRP CA C 5 59.200 59.200 58.983 0.217 19582
291 1 4 . 1 1 5 5 TRP CB C 5 29.200 29.200 29.094 0.106 19582
292 1 4 . 1 1 5 5 TRP H H 5 8.000 8.000 9.066 -1.066 19582
293 1 4 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.793 0.486 19582
294 1 4 . 1 1 6 6 PHE CA C 6 59.000 59.000 60.289 -1.289 19582
295 1 4 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.677 -0.177 19582
296 1 4 . 1 1 6 6 PHE H H 6 7.400 7.400 7.074 0.326 19582
297 1 4 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.496 0.094 19582
298 1 4 . 1 1 7 7 ASP CA C 7 55.700 55.700 57.223 -1.523 19582
299 1 4 . 1 1 7 7 ASP CB C 7 41.400 41.400 40.578 0.823 19582
300 1 4 . 1 1 7 7 ASP H H 7 7.860 7.860 7.694 0.166 19582
301 1 4 . 1 1 8 8 ILE HA H 8 4.050 4.050 4.061 -0.011 19582
302 1 4 . 1 1 8 8 ILE CA C 8 65.400 65.400 63.145 2.255 19582
303 1 4 . 1 1 8 8 ILE CB C 8 38.600 38.600 36.649 1.951 19582
304 1 4 . 1 1 8 8 ILE H H 8 7.840 7.840 7.504 0.336 19582
305 1 4 . 1 1 9 9 THR HA H 9 4.050 4.050 3.931 0.119 19582
306 1 4 . 1 1 9 9 THR CA C 9 64.000 64.000 66.118 -2.118 19582
307 1 4 . 1 1 9 9 THR CB C 9 69.100 69.100 68.361 0.739 19582
308 1 4 . 1 1 9 9 THR H H 9 8.080 8.080 7.714 0.366 19582
309 1 4 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.557 0.093 19582
310 1 4 . 1 1 10 10 ASN CB C 10 38.700 38.700 38.624 0.076 19582
311 1 4 . 1 1 10 10 ASN H H 10 7.930 7.930 7.650 0.280 19582
312 1 4 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.485 0.265 19582
313 1 4 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.418 0.082 19582
314 1 4 . 1 1 11 11 TRP H H 11 7.910 7.910 7.577 0.333 19582
315 1 4 . 1 1 12 12 LEU HA H 12 4.050 4.050 3.997 0.053 19582
316 1 4 . 1 1 12 12 LEU CA C 12 57.900 57.900 58.385 -0.485 19582
317 1 4 . 1 1 12 12 LEU CB C 12 41.800 41.800 41.727 0.073 19582
318 1 4 . 1 1 12 12 LEU H H 12 8.000 8.000 7.960 0.040 19582
319 1 4 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.228 0.022 19582
320 1 4 . 1 1 13 13 TRP CA C 13 60.300 60.300 62.236 -1.936 19582
321 1 4 . 1 1 13 13 TRP CB C 13 28.700 28.700 29.259 -0.559 19582
322 1 4 . 1 1 13 13 TRP H H 13 7.850 7.850 7.587 0.263 19582
323 1 4 . 1 1 14 14 TYR HA H 14 4.050 4.050 4.158 -0.108 19582
324 1 4 . 1 1 14 14 TYR CA C 14 61.300 61.300 61.962 -0.662 19582
325 1 4 . 1 1 14 14 TYR H H 14 7.400 7.400 7.833 -0.433 19582
326 1 4 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.562 0.238 19582
327 1 4 . 1 1 15 15 ILE CA C 15 64.300 64.300 65.813 -1.513 19582
328 1 4 . 1 1 15 15 ILE CB C 15 37.700 37.700 37.881 -0.181 19582
329 1 4 . 1 1 15 15 ILE H H 15 7.930 7.930 8.197 -0.267 19582
330 1 4 . 1 1 16 16 LYS HA H 16 3.920 3.920 4.033 -0.113 19582
331 1 4 . 1 1 16 16 LYS CA C 16 60.100 60.100 58.649 1.451 19582
332 1 4 . 1 1 16 16 LYS CB C 16 32.000 32.000 32.155 -0.155 19582
333 1 4 . 1 1 16 16 LYS H H 16 7.880 7.880 8.077 -0.197 19582
334 1 4 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.742 0.338 19582
335 1 4 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.705 0.495 19582
336 1 4 . 1 1 17 17 LEU CB C 17 41.700 41.700 41.277 0.423 19582
337 1 4 . 1 1 17 17 LEU H H 17 7.580 7.580 7.797 -0.217 19582
338 1 4 . 1 1 18 18 PHE HA H 18 4.140 4.140 3.854 0.286 19582
339 1 4 . 1 1 18 18 PHE CA C 18 61.900 61.900 62.400 -0.500 19582
340 1 4 . 1 1 18 18 PHE CB C 18 38.900 38.900 38.997 -0.097 19582
341 1 4 . 1 1 18 18 PHE H H 18 8.140 8.140 8.018 0.122 19582
342 1 4 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.461 0.129 19582
343 1 4 . 1 1 19 19 ILE CA C 19 65.100 65.100 65.331 -0.231 19582
344 1 4 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.848 0.052 19582
345 1 4 . 1 1 19 19 ILE H H 19 8.470 8.470 7.506 0.964 19582
346 1 4 . 1 1 20 20 MET HA H 20 4.130 4.130 4.035 0.095 19582
347 1 4 . 1 1 20 20 MET CA C 20 59.100 59.100 58.850 0.250 19582
348 1 4 . 1 1 20 20 MET CB C 20 32.600 32.600 32.273 0.327 19582
349 1 4 . 1 1 20 20 MET H H 20 8.110 8.110 7.783 0.327 19582
350 1 4 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.622 0.188 19582
351 1 4 . 1 1 21 21 ILE CA C 21 65.100 65.100 64.763 0.337 19582
352 1 4 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.845 0.455 19582
353 1 4 . 1 1 21 21 ILE H H 21 8.550 8.550 7.557 0.993 19582
354 1 4 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.390 0.210 19582
355 1 4 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.585 0.315 19582
356 1 4 . 1 1 22 22 VAL CB C 22 31.200 31.200 31.113 0.087 19582
357 1 4 . 1 1 22 22 VAL H H 22 8.640 8.640 8.168 0.472 19582
358 1 4 . 1 1 23 23 GLY CA C 23 46.900 46.900 47.293 -0.393 19582
359 1 4 . 1 1 23 23 GLY H H 23 8.320 8.320 8.557 -0.237 19582
360 1 4 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.685 1.915 19582
361 1 4 . 1 1 24 24 GLY H H 24 7.620 7.620 7.462 0.158 19582
362 1 4 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.440 -0.210 19582
363 1 4 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.334 -0.234 19582
364 1 4 . 1 1 25 25 LEU H H 25 8.050 8.050 7.624 0.426 19582
365 1 4 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.727 0.103 19582
366 1 4 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.100 0.200 19582
367 1 4 . 1 1 26 26 VAL CB C 26 32.000 32.000 32.159 -0.159 19582
368 1 4 . 1 1 26 26 VAL H H 26 8.310 8.310 8.255 0.055 19582
369 1 4 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.188 0.032 19582
370 1 4 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.667 1.032 19582
371 1 4 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.351 0.149 19582
372 1 4 . 1 1 27 27 LYS H H 27 7.850 7.850 8.392 -0.542 19582
373 1 5 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.224 0.206 19582
374 1 5 . 1 1 2 2 LYS CA C 2 56.600 56.600 57.096 -0.496 19582
375 1 5 . 1 1 2 2 LYS CB C 2 33.500 33.500 32.061 1.439 19582
376 1 5 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.479 -0.099 19582
377 1 5 . 1 1 3 3 LYS CA C 3 56.700 56.700 56.240 0.460 19582
378 1 5 . 1 1 3 3 LYS CB C 3 33.300 33.300 33.950 -0.650 19582
379 1 5 . 1 1 3 3 LYS H H 3 8.380 8.380 8.603 -0.223 19582
380 1 5 . 1 1 4 4 ASN CB C 4 39.500 39.500 40.718 -1.218 19582
381 1 5 . 1 1 4 4 ASN H H 4 8.570 8.570 8.239 0.331 19582
382 1 5 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.485 -0.025 19582
383 1 5 . 1 1 5 5 TRP CA C 5 59.200 59.200 59.140 0.060 19582
384 1 5 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.962 0.238 19582
385 1 5 . 1 1 5 5 TRP H H 5 8.000 8.000 8.967 -0.967 19582
386 1 5 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.628 0.652 19582
387 1 5 . 1 1 6 6 PHE CA C 6 59.000 59.000 60.311 -1.311 19582
388 1 5 . 1 1 6 6 PHE CB C 6 38.500 38.500 37.904 0.596 19582
389 1 5 . 1 1 6 6 PHE H H 6 7.400 7.400 7.303 0.097 19582
390 1 5 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.675 -0.085 19582
391 1 5 . 1 1 7 7 ASP CA C 7 55.700 55.700 56.595 -0.895 19582
392 1 5 . 1 1 7 7 ASP CB C 7 41.400 41.400 41.933 -0.533 19582
393 1 5 . 1 1 7 7 ASP H H 7 7.860 7.860 7.796 0.064 19582
394 1 5 . 1 1 8 8 ILE HA H 8 4.050 4.050 3.952 0.098 19582
395 1 5 . 1 1 8 8 ILE CA C 8 65.400 65.400 64.282 1.118 19582
396 1 5 . 1 1 8 8 ILE CB C 8 38.600 38.600 37.036 1.564 19582
397 1 5 . 1 1 8 8 ILE H H 8 7.840 7.840 7.674 0.166 19582
398 1 5 . 1 1 9 9 THR HA H 9 4.050 4.050 4.035 0.015 19582
399 1 5 . 1 1 9 9 THR CA C 9 64.000 64.000 66.828 -2.828 19582
400 1 5 . 1 1 9 9 THR CB C 9 69.100 69.100 68.614 0.486 19582
401 1 5 . 1 1 9 9 THR H H 9 8.080 8.080 8.721 -0.641 19582
402 1 5 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.466 0.184 19582
403 1 5 . 1 1 10 10 ASN CB C 10 38.700 38.700 37.817 0.883 19582
404 1 5 . 1 1 10 10 ASN H H 10 7.930 7.930 7.606 0.324 19582
405 1 5 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.460 0.290 19582
406 1 5 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.555 -0.055 19582
407 1 5 . 1 1 11 11 TRP H H 11 7.910 7.910 7.840 0.070 19582
408 1 5 . 1 1 12 12 LEU HA H 12 4.050 4.050 4.058 -0.008 19582
409 1 5 . 1 1 12 12 LEU CA C 12 57.900 57.900 58.580 -0.680 19582
410 1 5 . 1 1 12 12 LEU CB C 12 41.800 41.800 41.964 -0.164 19582
411 1 5 . 1 1 12 12 LEU H H 12 8.000 8.000 8.867 -0.867 19582
412 1 5 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.303 -0.053 19582
413 1 5 . 1 1 13 13 TRP CA C 13 60.300 60.300 62.208 -1.908 19582
414 1 5 . 1 1 13 13 TRP CB C 13 28.700 28.700 29.293 -0.593 19582
415 1 5 . 1 1 13 13 TRP H H 13 7.850 7.850 7.808 0.042 19582
416 1 5 . 1 1 14 14 TYR HA H 14 4.050 4.050 4.146 -0.096 19582
417 1 5 . 1 1 14 14 TYR CA C 14 61.300 61.300 62.138 -0.838 19582
418 1 5 . 1 1 14 14 TYR H H 14 7.400 7.400 7.975 -0.575 19582
419 1 5 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.589 0.211 19582
420 1 5 . 1 1 15 15 ILE CA C 15 64.300 64.300 64.768 -0.468 19582
421 1 5 . 1 1 15 15 ILE CB C 15 37.700 37.700 37.689 0.011 19582
422 1 5 . 1 1 15 15 ILE H H 15 7.930 7.930 7.725 0.205 19582
423 1 5 . 1 1 16 16 LYS HA H 16 3.920 3.920 3.966 -0.046 19582
424 1 5 . 1 1 16 16 LYS CA C 16 60.100 60.100 59.165 0.935 19582
425 1 5 . 1 1 16 16 LYS CB C 16 32.000 32.000 31.912 0.088 19582
426 1 5 . 1 1 16 16 LYS H H 16 7.880 7.880 8.038 -0.158 19582
427 1 5 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.727 0.353 19582
428 1 5 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.722 0.478 19582
429 1 5 . 1 1 17 17 LEU CB C 17 41.700 41.700 41.518 0.182 19582
430 1 5 . 1 1 17 17 LEU H H 17 7.580 7.580 8.021 -0.441 19582
431 1 5 . 1 1 18 18 PHE HA H 18 4.140 4.140 3.991 0.149 19582
432 1 5 . 1 1 18 18 PHE CA C 18 61.900 61.900 61.383 0.517 19582
433 1 5 . 1 1 18 18 PHE CB C 18 38.900 38.900 38.881 0.019 19582
434 1 5 . 1 1 18 18 PHE H H 18 8.140 8.140 7.422 0.718 19582
435 1 5 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.311 0.279 19582
436 1 5 . 1 1 19 19 ILE CA C 19 65.100 65.100 65.357 -0.257 19582
437 1 5 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.767 0.133 19582
438 1 5 . 1 1 19 19 ILE H H 19 8.470 8.470 7.875 0.595 19582
439 1 5 . 1 1 20 20 MET HA H 20 4.130 4.130 4.044 0.086 19582
440 1 5 . 1 1 20 20 MET CA C 20 59.100 59.100 58.833 0.267 19582
441 1 5 . 1 1 20 20 MET CB C 20 32.600 32.600 32.334 0.266 19582
442 1 5 . 1 1 20 20 MET H H 20 8.110 8.110 8.002 0.108 19582
443 1 5 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.650 0.160 19582
444 1 5 . 1 1 21 21 ILE CA C 21 65.100 65.100 64.742 0.358 19582
445 1 5 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.960 0.340 19582
446 1 5 . 1 1 21 21 ILE H H 21 8.550 8.550 7.548 1.002 19582
447 1 5 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.354 0.246 19582
448 1 5 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.550 0.350 19582
449 1 5 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.946 0.254 19582
450 1 5 . 1 1 22 22 VAL H H 22 8.640 8.640 8.206 0.434 19582
451 1 5 . 1 1 23 23 GLY CA C 23 46.900 46.900 46.984 -0.084 19582
452 1 5 . 1 1 23 23 GLY H H 23 8.320 8.320 8.461 -0.141 19582
453 1 5 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.618 1.982 19582
454 1 5 . 1 1 24 24 GLY H H 24 7.620 7.620 7.482 0.138 19582
455 1 5 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.427 -0.197 19582
456 1 5 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.468 -0.368 19582
457 1 5 . 1 1 25 25 LEU H H 25 8.050 8.050 7.489 0.561 19582
458 1 5 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.628 0.202 19582
459 1 5 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.772 -0.471 19582
460 1 5 . 1 1 26 26 VAL CB C 26 32.000 32.000 31.904 0.096 19582
461 1 5 . 1 1 26 26 VAL H H 26 8.310 8.310 8.371 -0.061 19582
462 1 5 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.233 -0.013 19582
463 1 5 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.158 1.542 19582
464 1 5 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.492 0.008 19582
465 1 5 . 1 1 27 27 LYS H H 27 7.850 7.850 8.235 -0.385 19582
466 1 6 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.380 0.050 19582
467 1 6 . 1 1 2 2 LYS CA C 2 56.600 56.600 56.529 0.071 19582
468 1 6 . 1 1 2 2 LYS CB C 2 33.500 33.500 32.994 0.506 19582
469 1 6 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.308 0.072 19582
470 1 6 . 1 1 3 3 LYS CA C 3 56.700 56.700 56.136 0.564 19582
471 1 6 . 1 1 3 3 LYS CB C 3 33.300 33.300 33.080 0.221 19582
472 1 6 . 1 1 3 3 LYS H H 3 8.380 8.380 7.704 0.676 19582
473 1 6 . 1 1 4 4 ASN CB C 4 39.500 39.500 38.608 0.892 19582
474 1 6 . 1 1 4 4 ASN H H 4 8.570 8.570 8.709 -0.139 19582
475 1 6 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.374 0.086 19582
476 1 6 . 1 1 5 5 TRP CA C 5 59.200 59.200 59.090 0.110 19582
477 1 6 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.691 0.509 19582
478 1 6 . 1 1 5 5 TRP H H 5 8.000 8.000 8.918 -0.918 19582
479 1 6 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.502 0.778 19582
480 1 6 . 1 1 6 6 PHE CA C 6 59.000 59.000 61.072 -2.072 19582
481 1 6 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.605 -0.105 19582
482 1 6 . 1 1 6 6 PHE H H 6 7.400 7.400 7.490 -0.090 19582
483 1 6 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.552 0.038 19582
484 1 6 . 1 1 7 7 ASP CA C 7 55.700 55.700 57.522 -1.822 19582
485 1 6 . 1 1 7 7 ASP CB C 7 41.400 41.400 41.241 0.159 19582
486 1 6 . 1 1 7 7 ASP H H 7 7.860 7.860 7.900 -0.040 19582
487 1 6 . 1 1 8 8 ILE HA H 8 4.050 4.050 4.156 -0.106 19582
488 1 6 . 1 1 8 8 ILE CA C 8 65.400 65.400 63.484 1.916 19582
489 1 6 . 1 1 8 8 ILE CB C 8 38.600 38.600 37.017 1.583 19582
490 1 6 . 1 1 8 8 ILE H H 8 7.840 7.840 7.441 0.399 19582
491 1 6 . 1 1 9 9 THR HA H 9 4.050 4.050 4.006 0.044 19582
492 1 6 . 1 1 9 9 THR CA C 9 64.000 64.000 66.752 -2.752 19582
493 1 6 . 1 1 9 9 THR CB C 9 69.100 69.100 67.893 1.207 19582
494 1 6 . 1 1 9 9 THR H H 9 8.080 8.080 8.587 -0.507 19582
495 1 6 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.497 0.153 19582
496 1 6 . 1 1 10 10 ASN CB C 10 38.700 38.700 38.242 0.458 19582
497 1 6 . 1 1 10 10 ASN H H 10 7.930 7.930 7.789 0.141 19582
498 1 6 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.441 0.309 19582
499 1 6 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.334 0.166 19582
500 1 6 . 1 1 11 11 TRP H H 11 7.910 7.910 7.516 0.394 19582
501 1 6 . 1 1 12 12 LEU HA H 12 4.050 4.050 4.025 0.025 19582
502 1 6 . 1 1 12 12 LEU CA C 12 57.900 57.900 58.245 -0.345 19582
503 1 6 . 1 1 12 12 LEU CB C 12 41.800 41.800 41.877 -0.077 19582
504 1 6 . 1 1 12 12 LEU H H 12 8.000 8.000 7.774 0.226 19582
505 1 6 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.301 -0.051 19582
506 1 6 . 1 1 13 13 TRP CA C 13 60.300 60.300 61.629 -1.329 19582
507 1 6 . 1 1 13 13 TRP CB C 13 28.700 28.700 29.506 -0.806 19582
508 1 6 . 1 1 13 13 TRP H H 13 7.850 7.850 8.423 -0.573 19582
509 1 6 . 1 1 14 14 TYR HA H 14 4.050 4.050 4.116 -0.066 19582
510 1 6 . 1 1 14 14 TYR CA C 14 61.300 61.300 61.772 -0.472 19582
511 1 6 . 1 1 14 14 TYR H H 14 7.400 7.400 7.963 -0.563 19582
512 1 6 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.623 0.177 19582
513 1 6 . 1 1 15 15 ILE CA C 15 64.300 64.300 65.111 -0.811 19582
514 1 6 . 1 1 15 15 ILE CB C 15 37.700 37.700 37.625 0.075 19582
515 1 6 . 1 1 15 15 ILE H H 15 7.930 7.930 7.647 0.283 19582
516 1 6 . 1 1 16 16 LYS HA H 16 3.920 3.920 4.043 -0.123 19582
517 1 6 . 1 1 16 16 LYS CA C 16 60.100 60.100 58.678 1.421 19582
518 1 6 . 1 1 16 16 LYS CB C 16 32.000 32.000 31.980 0.020 19582
519 1 6 . 1 1 16 16 LYS H H 16 7.880 7.880 7.445 0.435 19582
520 1 6 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.778 0.302 19582
521 1 6 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.474 0.726 19582
522 1 6 . 1 1 17 17 LEU CB C 17 41.700 41.700 41.034 0.666 19582
523 1 6 . 1 1 17 17 LEU H H 17 7.580 7.580 7.339 0.241 19582
524 1 6 . 1 1 18 18 PHE HA H 18 4.140 4.140 3.851 0.289 19582
525 1 6 . 1 1 18 18 PHE CA C 18 61.900 61.900 62.268 -0.368 19582
526 1 6 . 1 1 18 18 PHE CB C 18 38.900 38.900 38.787 0.113 19582
527 1 6 . 1 1 18 18 PHE H H 18 8.140 8.140 7.920 0.220 19582
528 1 6 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.440 0.150 19582
529 1 6 . 1 1 19 19 ILE CA C 19 65.100 65.100 65.162 -0.062 19582
530 1 6 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.722 0.178 19582
531 1 6 . 1 1 19 19 ILE H H 19 8.470 8.470 7.435 1.035 19582
532 1 6 . 1 1 20 20 MET HA H 20 4.130 4.130 3.976 0.154 19582
533 1 6 . 1 1 20 20 MET CA C 20 59.100 59.100 58.922 0.178 19582
534 1 6 . 1 1 20 20 MET CB C 20 32.600 32.600 32.246 0.354 19582
535 1 6 . 1 1 20 20 MET H H 20 8.110 8.110 7.455 0.655 19582
536 1 6 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.610 0.200 19582
537 1 6 . 1 1 21 21 ILE CA C 21 65.100 65.100 65.250 -0.150 19582
538 1 6 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.725 0.575 19582
539 1 6 . 1 1 21 21 ILE H H 21 8.550 8.550 8.392 0.158 19582
540 1 6 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.546 0.054 19582
541 1 6 . 1 1 22 22 VAL CA C 22 66.900 66.900 65.947 0.953 19582
542 1 6 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.189 1.011 19582
543 1 6 . 1 1 22 22 VAL H H 22 8.640 8.640 8.264 0.376 19582
544 1 6 . 1 1 23 23 GLY CA C 23 46.900 46.900 47.333 -0.433 19582
545 1 6 . 1 1 23 23 GLY H H 23 8.320 8.320 8.233 0.087 19582
546 1 6 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.920 1.680 19582
547 1 6 . 1 1 24 24 GLY H H 24 7.620 7.620 7.267 0.353 19582
548 1 6 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.367 -0.137 19582
549 1 6 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.492 -0.392 19582
550 1 6 . 1 1 25 25 LEU H H 25 8.050 8.050 7.659 0.391 19582
551 1 6 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.652 0.178 19582
552 1 6 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.410 -0.110 19582
553 1 6 . 1 1 26 26 VAL CB C 26 32.000 32.000 32.069 -0.069 19582
554 1 6 . 1 1 26 26 VAL H H 26 8.310 8.310 8.338 -0.028 19582
555 1 6 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.186 0.034 19582
556 1 6 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.654 1.046 19582
557 1 6 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.435 0.065 19582
558 1 6 . 1 1 27 27 LYS H H 27 7.850 7.850 8.359 -0.509 19582
559 1 7 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.555 -0.125 19582
560 1 7 . 1 1 2 2 LYS CA C 2 56.600 56.600 55.928 0.672 19582
561 1 7 . 1 1 2 2 LYS CB C 2 33.500 33.500 33.199 0.301 19582
562 1 7 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.386 -0.006 19582
563 1 7 . 1 1 3 3 LYS CA C 3 56.700 56.700 56.479 0.221 19582
564 1 7 . 1 1 3 3 LYS CB C 3 33.300 33.300 33.724 -0.424 19582
565 1 7 . 1 1 3 3 LYS H H 3 8.380 8.380 8.789 -0.409 19582
566 1 7 . 1 1 4 4 ASN CB C 4 39.500 39.500 40.097 -0.597 19582
567 1 7 . 1 1 4 4 ASN H H 4 8.570 8.570 7.809 0.761 19582
568 1 7 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.412 0.048 19582
569 1 7 . 1 1 5 5 TRP CA C 5 59.200 59.200 59.516 -0.316 19582
570 1 7 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.888 0.312 19582
571 1 7 . 1 1 5 5 TRP H H 5 8.000 8.000 8.774 -0.774 19582
572 1 7 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.708 0.572 19582
573 1 7 . 1 1 6 6 PHE CA C 6 59.000 59.000 60.816 -1.816 19582
574 1 7 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.559 -0.059 19582
575 1 7 . 1 1 6 6 PHE H H 6 7.400 7.400 7.162 0.238 19582
576 1 7 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.418 0.172 19582
577 1 7 . 1 1 7 7 ASP CA C 7 55.700 55.700 57.348 -1.648 19582
578 1 7 . 1 1 7 7 ASP CB C 7 41.400 41.400 41.579 -0.179 19582
579 1 7 . 1 1 7 7 ASP H H 7 7.860 7.860 7.882 -0.022 19582
580 1 7 . 1 1 8 8 ILE HA H 8 4.050 4.050 4.062 -0.012 19582
581 1 7 . 1 1 8 8 ILE CA C 8 65.400 65.400 63.443 1.957 19582
582 1 7 . 1 1 8 8 ILE CB C 8 38.600 38.600 36.879 1.721 19582
583 1 7 . 1 1 8 8 ILE H H 8 7.840 7.840 7.428 0.412 19582
584 1 7 . 1 1 9 9 THR HA H 9 4.050 4.050 4.001 0.049 19582
585 1 7 . 1 1 9 9 THR CA C 9 64.000 64.000 66.534 -2.534 19582
586 1 7 . 1 1 9 9 THR CB C 9 69.100 69.100 68.450 0.650 19582
587 1 7 . 1 1 9 9 THR H H 9 8.080 8.080 8.325 -0.245 19582
588 1 7 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.442 0.208 19582
589 1 7 . 1 1 10 10 ASN CB C 10 38.700 38.700 38.031 0.669 19582
590 1 7 . 1 1 10 10 ASN H H 10 7.930 7.930 7.712 0.218 19582
591 1 7 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.436 0.314 19582
592 1 7 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.429 0.071 19582
593 1 7 . 1 1 11 11 TRP H H 11 7.910 7.910 7.560 0.350 19582
594 1 7 . 1 1 12 12 LEU HA H 12 4.050 4.050 3.971 0.079 19582
595 1 7 . 1 1 12 12 LEU CA C 12 57.900 57.900 58.099 -0.199 19582
596 1 7 . 1 1 12 12 LEU CB C 12 41.800 41.800 41.536 0.264 19582
597 1 7 . 1 1 12 12 LEU H H 12 8.000 8.000 8.250 -0.250 19582
598 1 7 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.244 0.006 19582
599 1 7 . 1 1 13 13 TRP CA C 13 60.300 60.300 62.592 -2.292 19582
600 1 7 . 1 1 13 13 TRP CB C 13 28.700 28.700 29.281 -0.581 19582
601 1 7 . 1 1 13 13 TRP H H 13 7.850 7.850 7.939 -0.089 19582
602 1 7 . 1 1 14 14 TYR HA H 14 4.050 4.050 4.119 -0.069 19582
603 1 7 . 1 1 14 14 TYR CA C 14 61.300 61.300 61.847 -0.547 19582
604 1 7 . 1 1 14 14 TYR H H 14 7.400 7.400 7.722 -0.322 19582
605 1 7 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.642 0.158 19582
606 1 7 . 1 1 15 15 ILE CA C 15 64.300 64.300 65.217 -0.917 19582
607 1 7 . 1 1 15 15 ILE CB C 15 37.700 37.700 37.912 -0.212 19582
608 1 7 . 1 1 15 15 ILE H H 15 7.930 7.930 7.721 0.209 19582
609 1 7 . 1 1 16 16 LYS HA H 16 3.920 3.920 3.959 -0.039 19582
610 1 7 . 1 1 16 16 LYS CA C 16 60.100 60.100 59.129 0.971 19582
611 1 7 . 1 1 16 16 LYS CB C 16 32.000 32.000 31.835 0.165 19582
612 1 7 . 1 1 16 16 LYS H H 16 7.880 7.880 8.131 -0.251 19582
613 1 7 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.759 0.321 19582
614 1 7 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.616 0.584 19582
615 1 7 . 1 1 17 17 LEU CB C 17 41.700 41.700 41.449 0.251 19582
616 1 7 . 1 1 17 17 LEU H H 17 7.580 7.580 7.751 -0.171 19582
617 1 7 . 1 1 18 18 PHE HA H 18 4.140 4.140 4.016 0.124 19582
618 1 7 . 1 1 18 18 PHE CA C 18 61.900 61.900 61.408 0.492 19582
619 1 7 . 1 1 18 18 PHE CB C 18 38.900 38.900 38.969 -0.070 19582
620 1 7 . 1 1 18 18 PHE H H 18 8.140 8.140 7.399 0.741 19582
621 1 7 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.324 0.267 19582
622 1 7 . 1 1 19 19 ILE CA C 19 65.100 65.100 65.342 -0.242 19582
623 1 7 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.778 0.122 19582
624 1 7 . 1 1 19 19 ILE H H 19 8.470 8.470 7.899 0.571 19582
625 1 7 . 1 1 20 20 MET HA H 20 4.130 4.130 4.038 0.092 19582
626 1 7 . 1 1 20 20 MET CA C 20 59.100 59.100 58.840 0.259 19582
627 1 7 . 1 1 20 20 MET CB C 20 32.600 32.600 32.322 0.279 19582
628 1 7 . 1 1 20 20 MET H H 20 8.110 8.110 7.948 0.162 19582
629 1 7 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.643 0.167 19582
630 1 7 . 1 1 21 21 ILE CA C 21 65.100 65.100 64.870 0.230 19582
631 1 7 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.916 0.384 19582
632 1 7 . 1 1 21 21 ILE H H 21 8.550 8.550 7.522 1.028 19582
633 1 7 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.368 0.232 19582
634 1 7 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.510 0.390 19582
635 1 7 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.886 0.314 19582
636 1 7 . 1 1 22 22 VAL H H 22 8.640 8.640 8.204 0.436 19582
637 1 7 . 1 1 23 23 GLY CA C 23 46.900 46.900 47.058 -0.158 19582
638 1 7 . 1 1 23 23 GLY H H 23 8.320 8.320 8.500 -0.180 19582
639 1 7 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.754 1.846 19582
640 1 7 . 1 1 24 24 GLY H H 24 7.620 7.620 7.523 0.097 19582
641 1 7 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.221 0.009 19582
642 1 7 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.260 -0.160 19582
643 1 7 . 1 1 25 25 LEU H H 25 8.050 8.050 7.827 0.223 19582
644 1 7 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.661 0.169 19582
645 1 7 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.419 -0.119 19582
646 1 7 . 1 1 26 26 VAL CB C 26 32.000 32.000 32.121 -0.121 19582
647 1 7 . 1 1 26 26 VAL H H 26 8.310 8.310 8.350 -0.040 19582
648 1 7 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.261 -0.041 19582
649 1 7 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.659 1.041 19582
650 1 7 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.447 0.053 19582
651 1 7 . 1 1 27 27 LYS H H 27 7.850 7.850 8.352 -0.502 19582
652 1 8 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.196 0.234 19582
653 1 8 . 1 1 2 2 LYS CA C 2 56.600 56.600 57.175 -0.575 19582
654 1 8 . 1 1 2 2 LYS CB C 2 33.500 33.500 32.439 1.061 19582
655 1 8 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.628 -0.248 19582
656 1 8 . 1 1 3 3 LYS CA C 3 56.700 56.700 54.523 2.177 19582
657 1 8 . 1 1 3 3 LYS CB C 3 33.300 33.300 35.520 -2.220 19582
658 1 8 . 1 1 3 3 LYS H H 3 8.380 8.380 8.313 0.067 19582
659 1 8 . 1 1 4 4 ASN CB C 4 39.500 39.500 39.264 0.236 19582
660 1 8 . 1 1 4 4 ASN H H 4 8.570 8.570 8.601 -0.031 19582
661 1 8 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.436 0.024 19582
662 1 8 . 1 1 5 5 TRP CA C 5 59.200 59.200 58.294 0.906 19582
663 1 8 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.825 0.375 19582
664 1 8 . 1 1 5 5 TRP H H 5 8.000 8.000 8.624 -0.624 19582
665 1 8 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.546 0.734 19582
666 1 8 . 1 1 6 6 PHE CA C 6 59.000 59.000 61.383 -2.383 19582
667 1 8 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.465 0.035 19582
668 1 8 . 1 1 6 6 PHE H H 6 7.400 7.400 6.997 0.403 19582
669 1 8 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.499 0.091 19582
670 1 8 . 1 1 7 7 ASP CA C 7 55.700 55.700 57.411 -1.711 19582
671 1 8 . 1 1 7 7 ASP CB C 7 41.400 41.400 41.154 0.246 19582
672 1 8 . 1 1 7 7 ASP H H 7 7.860 7.860 7.838 0.022 19582
673 1 8 . 1 1 8 8 ILE HA H 8 4.050 4.050 4.148 -0.098 19582
674 1 8 . 1 1 8 8 ILE CA C 8 65.400 65.400 63.512 1.888 19582
675 1 8 . 1 1 8 8 ILE CB C 8 38.600 38.600 36.698 1.902 19582
676 1 8 . 1 1 8 8 ILE H H 8 7.840 7.840 7.627 0.213 19582
677 1 8 . 1 1 9 9 THR HA H 9 4.050 4.050 3.994 0.056 19582
678 1 8 . 1 1 9 9 THR CA C 9 64.000 64.000 66.731 -2.731 19582
679 1 8 . 1 1 9 9 THR CB C 9 69.100 69.100 68.421 0.679 19582
680 1 8 . 1 1 9 9 THR H H 9 8.080 8.080 8.002 0.078 19582
681 1 8 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.471 0.179 19582
682 1 8 . 1 1 10 10 ASN CB C 10 38.700 38.700 38.507 0.193 19582
683 1 8 . 1 1 10 10 ASN H H 10 7.930 7.930 7.692 0.238 19582
684 1 8 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.482 0.268 19582
685 1 8 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.541 -0.041 19582
686 1 8 . 1 1 11 11 TRP H H 11 7.910 7.910 7.505 0.405 19582
687 1 8 . 1 1 12 12 LEU HA H 12 4.050 4.050 4.029 0.021 19582
688 1 8 . 1 1 12 12 LEU CA C 12 57.900 57.900 57.962 -0.062 19582
689 1 8 . 1 1 12 12 LEU CB C 12 41.800 41.800 41.753 0.047 19582
690 1 8 . 1 1 12 12 LEU H H 12 8.000 8.000 8.504 -0.504 19582
691 1 8 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.344 -0.094 19582
692 1 8 . 1 1 13 13 TRP CA C 13 60.300 60.300 61.640 -1.340 19582
693 1 8 . 1 1 13 13 TRP CB C 13 28.700 28.700 29.645 -0.945 19582
694 1 8 . 1 1 13 13 TRP H H 13 7.850 7.850 8.234 -0.384 19582
695 1 8 . 1 1 14 14 TYR HA H 14 4.050 4.050 4.254 -0.204 19582
696 1 8 . 1 1 14 14 TYR CA C 14 61.300 61.300 60.569 0.731 19582
697 1 8 . 1 1 14 14 TYR H H 14 7.400 7.400 7.741 -0.341 19582
698 1 8 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.399 0.401 19582
699 1 8 . 1 1 15 15 ILE CA C 15 64.300 64.300 64.945 -0.645 19582
700 1 8 . 1 1 15 15 ILE CB C 15 37.700 37.700 37.535 0.165 19582
701 1 8 . 1 1 15 15 ILE H H 15 7.930 7.930 7.534 0.396 19582
702 1 8 . 1 1 16 16 LYS HA H 16 3.920 3.920 4.001 -0.081 19582
703 1 8 . 1 1 16 16 LYS CA C 16 60.100 60.100 58.945 1.155 19582
704 1 8 . 1 1 16 16 LYS CB C 16 32.000 32.000 31.805 0.195 19582
705 1 8 . 1 1 16 16 LYS H H 16 7.880 7.880 7.478 0.402 19582
706 1 8 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.881 0.199 19582
707 1 8 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.748 0.452 19582
708 1 8 . 1 1 17 17 LEU CB C 17 41.700 41.700 40.961 0.739 19582
709 1 8 . 1 1 17 17 LEU H H 17 7.580 7.580 7.297 0.283 19582
710 1 8 . 1 1 18 18 PHE HA H 18 4.140 4.140 3.945 0.195 19582
711 1 8 . 1 1 18 18 PHE CA C 18 61.900 61.900 62.520 -0.620 19582
712 1 8 . 1 1 18 18 PHE CB C 18 38.900 38.900 38.545 0.355 19582
713 1 8 . 1 1 18 18 PHE H H 18 8.140 8.140 7.654 0.486 19582
714 1 8 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.556 0.034 19582
715 1 8 . 1 1 19 19 ILE CA C 19 65.100 65.100 64.918 0.182 19582
716 1 8 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.753 0.147 19582
717 1 8 . 1 1 19 19 ILE H H 19 8.470 8.470 7.365 1.105 19582
718 1 8 . 1 1 20 20 MET HA H 20 4.130 4.130 4.018 0.112 19582
719 1 8 . 1 1 20 20 MET CA C 20 59.100 59.100 58.687 0.413 19582
720 1 8 . 1 1 20 20 MET CB C 20 32.600 32.600 32.133 0.467 19582
721 1 8 . 1 1 20 20 MET H H 20 8.110 8.110 7.411 0.699 19582
722 1 8 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.622 0.188 19582
723 1 8 . 1 1 21 21 ILE CA C 21 65.100 65.100 65.340 -0.240 19582
724 1 8 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.662 0.638 19582
725 1 8 . 1 1 21 21 ILE H H 21 8.550 8.550 8.449 0.101 19582
726 1 8 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.523 0.077 19582
727 1 8 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.571 0.329 19582
728 1 8 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.651 0.549 19582
729 1 8 . 1 1 22 22 VAL H H 22 8.640 8.640 8.163 0.477 19582
730 1 8 . 1 1 23 23 GLY CA C 23 46.900 46.900 47.201 -0.301 19582
731 1 8 . 1 1 23 23 GLY H H 23 8.320 8.320 8.191 0.129 19582
732 1 8 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.661 1.939 19582
733 1 8 . 1 1 24 24 GLY H H 24 7.620 7.620 7.302 0.318 19582
734 1 8 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.524 -0.294 19582
735 1 8 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.487 -0.387 19582
736 1 8 . 1 1 25 25 LEU H H 25 8.050 8.050 7.690 0.360 19582
737 1 8 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.712 0.118 19582
738 1 8 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.757 -0.457 19582
739 1 8 . 1 1 26 26 VAL CB C 26 32.000 32.000 31.738 0.261 19582
740 1 8 . 1 1 26 26 VAL H H 26 8.310 8.310 8.427 -0.117 19582
741 1 8 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.286 -0.066 19582
742 1 8 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.597 1.103 19582
743 1 8 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.232 0.268 19582
744 1 8 . 1 1 27 27 LYS H H 27 7.850 7.850 8.523 -0.673 19582
745 1 9 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.381 0.049 19582
746 1 9 . 1 1 2 2 LYS CA C 2 56.600 56.600 56.547 0.053 19582
747 1 9 . 1 1 2 2 LYS CB C 2 33.500 33.500 32.288 1.212 19582
748 1 9 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.583 -0.203 19582
749 1 9 . 1 1 3 3 LYS CA C 3 56.700 56.700 55.120 1.580 19582
750 1 9 . 1 1 3 3 LYS CB C 3 33.300 33.300 35.170 -1.870 19582
751 1 9 . 1 1 3 3 LYS H H 3 8.380 8.380 8.117 0.263 19582
752 1 9 . 1 1 4 4 ASN CB C 4 39.500 39.500 39.104 0.396 19582
753 1 9 . 1 1 4 4 ASN H H 4 8.570 8.570 8.739 -0.169 19582
754 1 9 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.372 0.088 19582
755 1 9 . 1 1 5 5 TRP CA C 5 59.200 59.200 59.528 -0.328 19582
756 1 9 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.774 0.426 19582
757 1 9 . 1 1 5 5 TRP H H 5 8.000 8.000 9.006 -1.006 19582
758 1 9 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.568 0.712 19582
759 1 9 . 1 1 6 6 PHE CA C 6 59.000 59.000 60.683 -1.683 19582
760 1 9 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.605 -0.105 19582
761 1 9 . 1 1 6 6 PHE H H 6 7.400 7.400 7.432 -0.032 19582
762 1 9 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.521 0.069 19582
763 1 9 . 1 1 7 7 ASP CA C 7 55.700 55.700 57.530 -1.830 19582
764 1 9 . 1 1 7 7 ASP CB C 7 41.400 41.400 41.321 0.079 19582
765 1 9 . 1 1 7 7 ASP H H 7 7.860 7.860 7.860 0.000 19582
766 1 9 . 1 1 8 8 ILE HA H 8 4.050 4.050 3.986 0.064 19582
767 1 9 . 1 1 8 8 ILE CA C 8 65.400 65.400 64.026 1.374 19582
768 1 9 . 1 1 8 8 ILE CB C 8 38.600 38.600 37.074 1.526 19582
769 1 9 . 1 1 8 8 ILE H H 8 7.840 7.840 7.730 0.110 19582
770 1 9 . 1 1 9 9 THR HA H 9 4.050 4.050 3.997 0.053 19582
771 1 9 . 1 1 9 9 THR CA C 9 64.000 64.000 66.678 -2.678 19582
772 1 9 . 1 1 9 9 THR CB C 9 69.100 69.100 68.217 0.883 19582
773 1 9 . 1 1 9 9 THR H H 9 8.080 8.080 8.660 -0.580 19582
774 1 9 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.291 0.359 19582
775 1 9 . 1 1 10 10 ASN CB C 10 38.700 38.700 38.326 0.374 19582
776 1 9 . 1 1 10 10 ASN H H 10 7.930 7.930 7.517 0.413 19582
777 1 9 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.544 0.206 19582
778 1 9 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.662 -0.162 19582
779 1 9 . 1 1 11 11 TRP H H 11 7.910 7.910 7.604 0.306 19582
780 1 9 . 1 1 12 12 LEU HA H 12 4.050 4.050 4.086 -0.036 19582
781 1 9 . 1 1 12 12 LEU CA C 12 57.900 57.900 57.897 0.003 19582
782 1 9 . 1 1 12 12 LEU CB C 12 41.800 41.800 41.968 -0.168 19582
783 1 9 . 1 1 12 12 LEU H H 12 8.000 8.000 8.505 -0.505 19582
784 1 9 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.269 -0.019 19582
785 1 9 . 1 1 13 13 TRP CA C 13 60.300 60.300 62.127 -1.827 19582
786 1 9 . 1 1 13 13 TRP CB C 13 28.700 28.700 29.385 -0.685 19582
787 1 9 . 1 1 13 13 TRP H H 13 7.850 7.850 8.444 -0.594 19582
788 1 9 . 1 1 14 14 TYR HA H 14 4.050 4.050 4.217 -0.167 19582
789 1 9 . 1 1 14 14 TYR CA C 14 61.300 61.300 60.889 0.411 19582
790 1 9 . 1 1 14 14 TYR H H 14 7.400 7.400 7.886 -0.486 19582
791 1 9 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.550 0.250 19582
792 1 9 . 1 1 15 15 ILE CA C 15 64.300 64.300 63.475 0.825 19582
793 1 9 . 1 1 15 15 ILE CB C 15 37.700 37.700 36.813 0.887 19582
794 1 9 . 1 1 15 15 ILE H H 15 7.930 7.930 7.778 0.152 19582
795 1 9 . 1 1 16 16 LYS HA H 16 3.920 3.920 3.996 -0.076 19582
796 1 9 . 1 1 16 16 LYS CA C 16 60.100 60.100 59.015 1.085 19582
797 1 9 . 1 1 16 16 LYS CB C 16 32.000 32.000 32.026 -0.026 19582
798 1 9 . 1 1 16 16 LYS H H 16 7.880 7.880 7.326 0.554 19582
799 1 9 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.848 0.232 19582
800 1 9 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.819 0.381 19582
801 1 9 . 1 1 17 17 LEU CB C 17 41.700 41.700 40.853 0.847 19582
802 1 9 . 1 1 17 17 LEU H H 17 7.580 7.580 7.233 0.347 19582
803 1 9 . 1 1 18 18 PHE HA H 18 4.140 4.140 3.942 0.198 19582
804 1 9 . 1 1 18 18 PHE CA C 18 61.900 61.900 62.052 -0.152 19582
805 1 9 . 1 1 18 18 PHE CB C 18 38.900 38.900 38.688 0.212 19582
806 1 9 . 1 1 18 18 PHE H H 18 8.140 8.140 7.597 0.543 19582
807 1 9 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.395 0.195 19582
808 1 9 . 1 1 19 19 ILE CA C 19 65.100 65.100 65.192 -0.091 19582
809 1 9 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.657 0.243 19582
810 1 9 . 1 1 19 19 ILE H H 19 8.470 8.470 7.394 1.076 19582
811 1 9 . 1 1 20 20 MET HA H 20 4.130 4.130 3.978 0.152 19582
812 1 9 . 1 1 20 20 MET CA C 20 59.100 59.100 59.219 -0.119 19582
813 1 9 . 1 1 20 20 MET CB C 20 32.600 32.600 32.550 0.050 19582
814 1 9 . 1 1 20 20 MET H H 20 8.110 8.110 7.516 0.594 19582
815 1 9 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.618 0.192 19582
816 1 9 . 1 1 21 21 ILE CA C 21 65.100 65.100 65.424 -0.324 19582
817 1 9 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.773 0.527 19582
818 1 9 . 1 1 21 21 ILE H H 21 8.550 8.550 8.213 0.337 19582
819 1 9 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.439 0.161 19582
820 1 9 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.235 0.665 19582
821 1 9 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.852 0.348 19582
822 1 9 . 1 1 22 22 VAL H H 22 8.640 8.640 8.252 0.388 19582
823 1 9 . 1 1 23 23 GLY CA C 23 46.900 46.900 47.044 -0.144 19582
824 1 9 . 1 1 23 23 GLY H H 23 8.320 8.320 8.228 0.092 19582
825 1 9 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.734 1.866 19582
826 1 9 . 1 1 24 24 GLY H H 24 7.620 7.620 7.465 0.155 19582
827 1 9 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.414 -0.184 19582
828 1 9 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.330 -0.230 19582
829 1 9 . 1 1 25 25 LEU H H 25 8.050 8.050 7.682 0.368 19582
830 1 9 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.692 0.138 19582
831 1 9 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.768 -0.468 19582
832 1 9 . 1 1 26 26 VAL CB C 26 32.000 32.000 32.183 -0.183 19582
833 1 9 . 1 1 26 26 VAL H H 26 8.310 8.310 8.345 -0.035 19582
834 1 9 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.259 -0.039 19582
835 1 9 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.783 0.917 19582
836 1 9 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.382 0.118 19582
837 1 9 . 1 1 27 27 LYS H H 27 7.850 7.850 8.460 -0.610 19582
838 1 10 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.322 0.108 19582
839 1 10 . 1 1 2 2 LYS CA C 2 56.600 56.600 56.616 -0.016 19582
840 1 10 . 1 1 2 2 LYS CB C 2 33.500 33.500 32.960 0.540 19582
841 1 10 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.332 0.048 19582
842 1 10 . 1 1 3 3 LYS CA C 3 56.700 56.700 56.280 0.420 19582
843 1 10 . 1 1 3 3 LYS CB C 3 33.300 33.300 33.279 0.021 19582
844 1 10 . 1 1 3 3 LYS H H 3 8.380 8.380 8.589 -0.209 19582
845 1 10 . 1 1 4 4 ASN CB C 4 39.500 39.500 40.151 -0.651 19582
846 1 10 . 1 1 4 4 ASN H H 4 8.570 8.570 8.503 0.067 19582
847 1 10 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.436 0.024 19582
848 1 10 . 1 1 5 5 TRP CA C 5 59.200 59.200 58.749 0.451 19582
849 1 10 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.604 0.596 19582
850 1 10 . 1 1 5 5 TRP H H 5 8.000 8.000 9.199 -1.199 19582
851 1 10 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.668 0.612 19582
852 1 10 . 1 1 6 6 PHE CA C 6 59.000 59.000 60.907 -1.907 19582
853 1 10 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.330 0.170 19582
854 1 10 . 1 1 6 6 PHE H H 6 7.400 7.400 7.509 -0.109 19582
855 1 10 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.511 0.079 19582
856 1 10 . 1 1 7 7 ASP CA C 7 55.700 55.700 57.316 -1.616 19582
857 1 10 . 1 1 7 7 ASP CB C 7 41.400 41.400 41.322 0.078 19582
858 1 10 . 1 1 7 7 ASP H H 7 7.860 7.860 8.090 -0.230 19582
859 1 10 . 1 1 8 8 ILE HA H 8 4.050 4.050 3.985 0.065 19582
860 1 10 . 1 1 8 8 ILE CA C 8 65.400 65.400 63.827 1.573 19582
861 1 10 . 1 1 8 8 ILE CB C 8 38.600 38.600 37.100 1.500 19582
862 1 10 . 1 1 8 8 ILE H H 8 7.840 7.840 7.531 0.309 19582
863 1 10 . 1 1 9 9 THR HA H 9 4.050 4.050 3.961 0.089 19582
864 1 10 . 1 1 9 9 THR CA C 9 64.000 64.000 66.391 -2.391 19582
865 1 10 . 1 1 9 9 THR CB C 9 69.100 69.100 68.234 0.866 19582
866 1 10 . 1 1 9 9 THR H H 9 8.080 8.080 8.641 -0.561 19582
867 1 10 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.342 0.308 19582
868 1 10 . 1 1 10 10 ASN CB C 10 38.700 38.700 38.285 0.415 19582
869 1 10 . 1 1 10 10 ASN H H 10 7.930 7.930 7.578 0.352 19582
870 1 10 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.523 0.227 19582
871 1 10 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.639 -0.139 19582
872 1 10 . 1 1 11 11 TRP H H 11 7.910 7.910 7.588 0.322 19582
873 1 10 . 1 1 12 12 LEU HA H 12 4.050 4.050 4.067 -0.017 19582
874 1 10 . 1 1 12 12 LEU CA C 12 57.900 57.900 57.723 0.177 19582
875 1 10 . 1 1 12 12 LEU CB C 12 41.800 41.800 41.611 0.189 19582
876 1 10 . 1 1 12 12 LEU H H 12 8.000 8.000 8.226 -0.226 19582
877 1 10 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.302 -0.052 19582
878 1 10 . 1 1 13 13 TRP CA C 13 60.300 60.300 61.984 -1.684 19582
879 1 10 . 1 1 13 13 TRP CB C 13 28.700 28.700 29.380 -0.680 19582
880 1 10 . 1 1 13 13 TRP H H 13 7.850 7.850 8.451 -0.601 19582
881 1 10 . 1 1 14 14 TYR HA H 14 4.050 4.050 4.222 -0.172 19582
882 1 10 . 1 1 14 14 TYR CA C 14 61.300 61.300 60.889 0.411 19582
883 1 10 . 1 1 14 14 TYR H H 14 7.400 7.400 7.932 -0.532 19582
884 1 10 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.581 0.219 19582
885 1 10 . 1 1 15 15 ILE CA C 15 64.300 64.300 63.431 0.869 19582
886 1 10 . 1 1 15 15 ILE CB C 15 37.700 37.700 36.699 1.001 19582
887 1 10 . 1 1 15 15 ILE H H 15 7.930 7.930 7.661 0.269 19582
888 1 10 . 1 1 16 16 LYS HA H 16 3.920 3.920 4.042 -0.122 19582
889 1 10 . 1 1 16 16 LYS CA C 16 60.100 60.100 58.691 1.409 19582
890 1 10 . 1 1 16 16 LYS CB C 16 32.000 32.000 32.062 -0.062 19582
891 1 10 . 1 1 16 16 LYS H H 16 7.880 7.880 7.324 0.556 19582
892 1 10 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.887 0.193 19582
893 1 10 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.610 0.590 19582
894 1 10 . 1 1 17 17 LEU CB C 17 41.700 41.700 40.884 0.816 19582
895 1 10 . 1 1 17 17 LEU H H 17 7.580 7.580 7.265 0.315 19582
896 1 10 . 1 1 18 18 PHE HA H 18 4.140 4.140 3.923 0.217 19582
897 1 10 . 1 1 18 18 PHE CA C 18 61.900 61.900 62.089 -0.189 19582
898 1 10 . 1 1 18 18 PHE CB C 18 38.900 38.900 38.661 0.239 19582
899 1 10 . 1 1 18 18 PHE H H 18 8.140 8.140 7.656 0.484 19582
900 1 10 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.417 0.173 19582
901 1 10 . 1 1 19 19 ILE CA C 19 65.100 65.100 65.206 -0.106 19582
902 1 10 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.734 0.166 19582
903 1 10 . 1 1 19 19 ILE H H 19 8.470 8.470 7.430 1.040 19582
904 1 10 . 1 1 20 20 MET HA H 20 4.130 4.130 3.998 0.132 19582
905 1 10 . 1 1 20 20 MET CA C 20 59.100 59.100 59.064 0.036 19582
906 1 10 . 1 1 20 20 MET CB C 20 32.600 32.600 32.444 0.156 19582
907 1 10 . 1 1 20 20 MET H H 20 8.110 8.110 7.322 0.788 19582
908 1 10 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.635 0.175 19582
909 1 10 . 1 1 21 21 ILE CA C 21 65.100 65.100 65.366 -0.266 19582
910 1 10 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.814 0.486 19582
911 1 10 . 1 1 21 21 ILE H H 21 8.550 8.550 8.189 0.361 19582
912 1 10 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.425 0.175 19582
913 1 10 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.375 0.525 19582
914 1 10 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.940 0.260 19582
915 1 10 . 1 1 22 22 VAL H H 22 8.640 8.640 8.228 0.412 19582
916 1 10 . 1 1 23 23 GLY CA C 23 46.900 46.900 47.002 -0.102 19582
917 1 10 . 1 1 23 23 GLY H H 23 8.320 8.320 8.243 0.077 19582
918 1 10 . 1 1 24 24 GLY CA C 24 46.600 46.600 45.061 1.539 19582
919 1 10 . 1 1 24 24 GLY H H 24 7.620 7.620 7.527 0.093 19582
920 1 10 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.476 -0.246 19582
921 1 10 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.536 -0.436 19582
922 1 10 . 1 1 25 25 LEU H H 25 8.050 8.050 7.551 0.499 19582
923 1 10 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.698 0.132 19582
924 1 10 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.467 -0.167 19582
925 1 10 . 1 1 26 26 VAL CB C 26 32.000 32.000 32.026 -0.027 19582
926 1 10 . 1 1 26 26 VAL H H 26 8.310 8.310 8.376 -0.066 19582
927 1 10 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.316 -0.096 19582
928 1 10 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.547 1.153 19582
929 1 10 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.435 0.065 19582
930 1 10 . 1 1 27 27 LYS H H 27 7.850 7.850 8.419 -0.569 19582
931 1 11 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.215 0.215 19582
932 1 11 . 1 1 2 2 LYS CA C 2 56.600 56.600 56.434 0.166 19582
933 1 11 . 1 1 2 2 LYS CB C 2 33.500 33.500 31.786 1.714 19582
934 1 11 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.312 0.068 19582
935 1 11 . 1 1 3 3 LYS CA C 3 56.700 56.700 56.241 0.459 19582
936 1 11 . 1 1 3 3 LYS CB C 3 33.300 33.300 33.234 0.066 19582
937 1 11 . 1 1 3 3 LYS H H 3 8.380 8.380 7.937 0.443 19582
938 1 11 . 1 1 4 4 ASN CB C 4 39.500 39.500 39.307 0.193 19582
939 1 11 . 1 1 4 4 ASN H H 4 8.570 8.570 8.613 -0.043 19582
940 1 11 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.468 -0.008 19582
941 1 11 . 1 1 5 5 TRP CA C 5 59.200 59.200 59.331 -0.131 19582
942 1 11 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.607 0.593 19582
943 1 11 . 1 1 5 5 TRP H H 5 8.000 8.000 8.901 -0.901 19582
944 1 11 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.739 0.541 19582
945 1 11 . 1 1 6 6 PHE CA C 6 59.000 59.000 60.370 -1.371 19582
946 1 11 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.419 0.081 19582
947 1 11 . 1 1 6 6 PHE H H 6 7.400 7.400 7.121 0.279 19582
948 1 11 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.507 0.083 19582
949 1 11 . 1 1 7 7 ASP CA C 7 55.700 55.700 57.074 -1.374 19582
950 1 11 . 1 1 7 7 ASP CB C 7 41.400 41.400 40.949 0.451 19582
951 1 11 . 1 1 7 7 ASP H H 7 7.860 7.860 7.782 0.078 19582
952 1 11 . 1 1 8 8 ILE HA H 8 4.050 4.050 4.106 -0.056 19582
953 1 11 . 1 1 8 8 ILE CA C 8 65.400 65.400 63.042 2.358 19582
954 1 11 . 1 1 8 8 ILE CB C 8 38.600 38.600 36.497 2.103 19582
955 1 11 . 1 1 8 8 ILE H H 8 7.840 7.840 7.458 0.382 19582
956 1 11 . 1 1 9 9 THR HA H 9 4.050 4.050 4.038 0.012 19582
957 1 11 . 1 1 9 9 THR CA C 9 64.000 64.000 66.988 -2.988 19582
958 1 11 . 1 1 9 9 THR CB C 9 69.100 69.100 68.846 0.254 19582
959 1 11 . 1 1 9 9 THR H H 9 8.080 8.080 7.974 0.106 19582
960 1 11 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.711 -0.061 19582
961 1 11 . 1 1 10 10 ASN CB C 10 38.700 38.700 38.650 0.050 19582
962 1 11 . 1 1 10 10 ASN H H 10 7.930 7.930 7.934 -0.004 19582
963 1 11 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.253 0.497 19582
964 1 11 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.369 0.131 19582
965 1 11 . 1 1 11 11 TRP H H 11 7.910 7.910 7.269 0.641 19582
966 1 11 . 1 1 12 12 LEU HA H 12 4.050 4.050 3.913 0.137 19582
967 1 11 . 1 1 12 12 LEU CA C 12 57.900 57.900 58.649 -0.749 19582
968 1 11 . 1 1 12 12 LEU CB C 12 41.800 41.800 42.029 -0.229 19582
969 1 11 . 1 1 12 12 LEU H H 12 8.000 8.000 8.549 -0.549 19582
970 1 11 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.459 -0.209 19582
971 1 11 . 1 1 13 13 TRP CA C 13 60.300 60.300 58.622 1.678 19582
972 1 11 . 1 1 13 13 TRP CB C 13 28.700 28.700 28.830 -0.130 19582
973 1 11 . 1 1 13 13 TRP H H 13 7.850 7.850 7.424 0.426 19582
974 1 11 . 1 1 14 14 TYR HA H 14 4.050 4.050 3.547 0.503 19582
975 1 11 . 1 1 14 14 TYR CA C 14 61.300 61.300 61.786 -0.486 19582
976 1 11 . 1 1 14 14 TYR H H 14 7.400 7.400 6.779 0.621 19582
977 1 11 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.718 0.082 19582
978 1 11 . 1 1 15 15 ILE CA C 15 64.300 64.300 65.236 -0.935 19582
979 1 11 . 1 1 15 15 ILE CB C 15 37.700 37.700 37.673 0.027 19582
980 1 11 . 1 1 15 15 ILE H H 15 7.930 7.930 8.490 -0.560 19582
981 1 11 . 1 1 16 16 LYS HA H 16 3.920 3.920 4.147 -0.227 19582
982 1 11 . 1 1 16 16 LYS CA C 16 60.100 60.100 59.126 0.974 19582
983 1 11 . 1 1 16 16 LYS CB C 16 32.000 32.000 31.995 0.005 19582
984 1 11 . 1 1 16 16 LYS H H 16 7.880 7.880 7.482 0.398 19582
985 1 11 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.964 0.116 19582
986 1 11 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.567 0.633 19582
987 1 11 . 1 1 17 17 LEU CB C 17 41.700 41.700 41.304 0.396 19582
988 1 11 . 1 1 17 17 LEU H H 17 7.580 7.580 7.520 0.060 19582
989 1 11 . 1 1 18 18 PHE HA H 18 4.140 4.140 4.097 0.043 19582
990 1 11 . 1 1 18 18 PHE CA C 18 61.900 61.900 62.133 -0.233 19582
991 1 11 . 1 1 18 18 PHE CB C 18 38.900 38.900 38.881 0.019 19582
992 1 11 . 1 1 18 18 PHE H H 18 8.140 8.140 7.526 0.614 19582
993 1 11 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.564 0.026 19582
994 1 11 . 1 1 19 19 ILE CA C 19 65.100 65.100 65.058 0.042 19582
995 1 11 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.827 0.073 19582
996 1 11 . 1 1 19 19 ILE H H 19 8.470 8.470 7.481 0.989 19582
997 1 11 . 1 1 20 20 MET HA H 20 4.130 4.130 4.053 0.077 19582
998 1 11 . 1 1 20 20 MET CA C 20 59.100 59.100 59.165 -0.065 19582
999 1 11 . 1 1 20 20 MET CB C 20 32.600 32.600 32.590 0.010 19582
1000 1 11 . 1 1 20 20 MET H H 20 8.110 8.110 7.438 0.672 19582
1001 1 11 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.637 0.173 19582
1002 1 11 . 1 1 21 21 ILE CA C 21 65.100 65.100 65.327 -0.227 19582
1003 1 11 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.728 0.572 19582
1004 1 11 . 1 1 21 21 ILE H H 21 8.550 8.550 8.312 0.238 19582
1005 1 11 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.498 0.102 19582
1006 1 11 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.635 0.265 19582
1007 1 11 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.657 0.543 19582
1008 1 11 . 1 1 22 22 VAL H H 22 8.640 8.640 8.302 0.338 19582
1009 1 11 . 1 1 23 23 GLY CA C 23 46.900 46.900 46.998 -0.098 19582
1010 1 11 . 1 1 23 23 GLY H H 23 8.320 8.320 8.266 0.054 19582
1011 1 11 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.854 1.746 19582
1012 1 11 . 1 1 24 24 GLY H H 24 7.620 7.620 7.511 0.109 19582
1013 1 11 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.352 -0.122 19582
1014 1 11 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.236 -0.136 19582
1015 1 11 . 1 1 25 25 LEU H H 25 8.050 8.050 7.889 0.161 19582
1016 1 11 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.684 0.146 19582
1017 1 11 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.986 -0.686 19582
1018 1 11 . 1 1 26 26 VAL CB C 26 32.000 32.000 32.132 -0.132 19582
1019 1 11 . 1 1 26 26 VAL H H 26 8.310 8.310 8.392 -0.082 19582
1020 1 11 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.242 -0.022 19582
1021 1 11 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.147 1.553 19582
1022 1 11 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.497 0.003 19582
1023 1 11 . 1 1 27 27 LYS H H 27 7.850 7.850 8.288 -0.438 19582
1024 1 12 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.296 0.134 19582
1025 1 12 . 1 1 2 2 LYS CA C 2 56.600 56.600 56.394 0.206 19582
1026 1 12 . 1 1 2 2 LYS CB C 2 33.500 33.500 33.544 -0.044 19582
1027 1 12 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.251 0.129 19582
1028 1 12 . 1 1 3 3 LYS CA C 3 56.700 56.700 57.682 -0.982 19582
1029 1 12 . 1 1 3 3 LYS CB C 3 33.300 33.300 32.942 0.358 19582
1030 1 12 . 1 1 3 3 LYS H H 3 8.380 8.380 8.486 -0.106 19582
1031 1 12 . 1 1 4 4 ASN CB C 4 39.500 39.500 39.696 -0.195 19582
1032 1 12 . 1 1 4 4 ASN H H 4 8.570 8.570 7.992 0.578 19582
1033 1 12 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.412 0.048 19582
1034 1 12 . 1 1 5 5 TRP CA C 5 59.200 59.200 58.891 0.309 19582
1035 1 12 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.919 0.281 19582
1036 1 12 . 1 1 5 5 TRP H H 5 8.000 8.000 9.015 -1.015 19582
1037 1 12 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.633 0.647 19582
1038 1 12 . 1 1 6 6 PHE CA C 6 59.000 59.000 60.022 -1.022 19582
1039 1 12 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.600 -0.100 19582
1040 1 12 . 1 1 6 6 PHE H H 6 7.400 7.400 7.852 -0.452 19582
1041 1 12 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.538 0.052 19582
1042 1 12 . 1 1 7 7 ASP CA C 7 55.700 55.700 56.071 -0.371 19582
1043 1 12 . 1 1 7 7 ASP CB C 7 41.400 41.400 41.333 0.068 19582
1044 1 12 . 1 1 7 7 ASP H H 7 7.860 7.860 7.770 0.090 19582
1045 1 12 . 1 1 8 8 ILE HA H 8 4.050 4.050 4.121 -0.071 19582
1046 1 12 . 1 1 8 8 ILE CA C 8 65.400 65.400 63.735 1.665 19582
1047 1 12 . 1 1 8 8 ILE CB C 8 38.600 38.600 36.689 1.911 19582
1048 1 12 . 1 1 8 8 ILE H H 8 7.840 7.840 7.475 0.365 19582
1049 1 12 . 1 1 9 9 THR HA H 9 4.050 4.050 4.006 0.044 19582
1050 1 12 . 1 1 9 9 THR CA C 9 64.000 64.000 66.481 -2.481 19582
1051 1 12 . 1 1 9 9 THR CB C 9 69.100 69.100 68.096 1.004 19582
1052 1 12 . 1 1 9 9 THR H H 9 8.080 8.080 7.954 0.126 19582
1053 1 12 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.456 0.194 19582
1054 1 12 . 1 1 10 10 ASN CB C 10 38.700 38.700 37.709 0.991 19582
1055 1 12 . 1 1 10 10 ASN H H 10 7.930 7.930 7.804 0.126 19582
1056 1 12 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.504 0.246 19582
1057 1 12 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.269 0.231 19582
1058 1 12 . 1 1 11 11 TRP H H 11 7.910 7.910 7.843 0.067 19582
1059 1 12 . 1 1 12 12 LEU HA H 12 4.050 4.050 3.981 0.069 19582
1060 1 12 . 1 1 12 12 LEU CA C 12 57.900 57.900 58.044 -0.144 19582
1061 1 12 . 1 1 12 12 LEU CB C 12 41.800 41.800 41.505 0.295 19582
1062 1 12 . 1 1 12 12 LEU H H 12 8.000 8.000 8.016 -0.016 19582
1063 1 12 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.271 -0.021 19582
1064 1 12 . 1 1 13 13 TRP CA C 13 60.300 60.300 62.295 -1.996 19582
1065 1 12 . 1 1 13 13 TRP CB C 13 28.700 28.700 29.434 -0.734 19582
1066 1 12 . 1 1 13 13 TRP H H 13 7.850 7.850 8.544 -0.694 19582
1067 1 12 . 1 1 14 14 TYR HA H 14 4.050 4.050 4.084 -0.034 19582
1068 1 12 . 1 1 14 14 TYR CA C 14 61.300 61.300 62.437 -1.137 19582
1069 1 12 . 1 1 14 14 TYR H H 14 7.400 7.400 7.779 -0.379 19582
1070 1 12 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.707 0.093 19582
1071 1 12 . 1 1 15 15 ILE CA C 15 64.300 64.300 64.965 -0.665 19582
1072 1 12 . 1 1 15 15 ILE CB C 15 37.700 37.700 37.885 -0.185 19582
1073 1 12 . 1 1 15 15 ILE H H 15 7.930 7.930 7.683 0.247 19582
1074 1 12 . 1 1 16 16 LYS HA H 16 3.920 3.920 3.925 -0.005 19582
1075 1 12 . 1 1 16 16 LYS CA C 16 60.100 60.100 59.769 0.331 19582
1076 1 12 . 1 1 16 16 LYS CB C 16 32.000 32.000 32.136 -0.136 19582
1077 1 12 . 1 1 16 16 LYS H H 16 7.880 7.880 7.668 0.212 19582
1078 1 12 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.731 0.349 19582
1079 1 12 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.748 0.452 19582
1080 1 12 . 1 1 17 17 LEU CB C 17 41.700 41.700 41.442 0.258 19582
1081 1 12 . 1 1 17 17 LEU H H 17 7.580 7.580 7.616 -0.036 19582
1082 1 12 . 1 1 18 18 PHE HA H 18 4.140 4.140 4.036 0.104 19582
1083 1 12 . 1 1 18 18 PHE CA C 18 61.900 61.900 61.571 0.329 19582
1084 1 12 . 1 1 18 18 PHE CB C 18 38.900 38.900 39.030 -0.130 19582
1085 1 12 . 1 1 18 18 PHE H H 18 8.140 8.140 7.372 0.768 19582
1086 1 12 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.495 0.095 19582
1087 1 12 . 1 1 19 19 ILE CA C 19 65.100 65.100 65.443 -0.343 19582
1088 1 12 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.681 0.219 19582
1089 1 12 . 1 1 19 19 ILE H H 19 8.470 8.470 7.685 0.785 19582
1090 1 12 . 1 1 20 20 MET HA H 20 4.130 4.130 3.963 0.167 19582
1091 1 12 . 1 1 20 20 MET CA C 20 59.100 59.100 59.204 -0.104 19582
1092 1 12 . 1 1 20 20 MET CB C 20 32.600 32.600 32.409 0.191 19582
1093 1 12 . 1 1 20 20 MET H H 20 8.110 8.110 7.388 0.722 19582
1094 1 12 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.565 0.245 19582
1095 1 12 . 1 1 21 21 ILE CA C 21 65.100 65.100 65.212 -0.112 19582
1096 1 12 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.513 0.787 19582
1097 1 12 . 1 1 21 21 ILE H H 21 8.550 8.550 8.036 0.514 19582
1098 1 12 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.508 0.092 19582
1099 1 12 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.149 0.751 19582
1100 1 12 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.314 0.886 19582
1101 1 12 . 1 1 22 22 VAL H H 22 8.640 8.640 8.253 0.387 19582
1102 1 12 . 1 1 23 23 GLY CA C 23 46.900 46.900 47.365 -0.465 19582
1103 1 12 . 1 1 23 23 GLY H H 23 8.320 8.320 8.431 -0.111 19582
1104 1 12 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.855 1.745 19582
1105 1 12 . 1 1 24 24 GLY H H 24 7.620 7.620 7.343 0.277 19582
1106 1 12 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.270 -0.040 19582
1107 1 12 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.270 -0.170 19582
1108 1 12 . 1 1 25 25 LEU H H 25 8.050 8.050 7.905 0.145 19582
1109 1 12 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.764 0.066 19582
1110 1 12 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.142 0.158 19582
1111 1 12 . 1 1 26 26 VAL CB C 26 32.000 32.000 31.994 0.006 19582
1112 1 12 . 1 1 26 26 VAL H H 26 8.310 8.310 8.368 -0.058 19582
1113 1 12 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.204 0.016 19582
1114 1 12 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.232 1.468 19582
1115 1 12 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.528 -0.028 19582
1116 1 12 . 1 1 27 27 LYS H H 27 7.850 7.850 8.295 -0.445 19582
1117 1 13 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.198 0.232 19582
1118 1 13 . 1 1 2 2 LYS CA C 2 56.600 56.600 57.110 -0.510 19582
1119 1 13 . 1 1 2 2 LYS CB C 2 33.500 33.500 32.467 1.033 19582
1120 1 13 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.278 0.102 19582
1121 1 13 . 1 1 3 3 LYS CA C 3 56.700 56.700 56.312 0.388 19582
1122 1 13 . 1 1 3 3 LYS CB C 3 33.300 33.300 33.100 0.200 19582
1123 1 13 . 1 1 3 3 LYS H H 3 8.380 8.380 7.895 0.485 19582
1124 1 13 . 1 1 4 4 ASN CB C 4 39.500 39.500 39.746 -0.246 19582
1125 1 13 . 1 1 4 4 ASN H H 4 8.570 8.570 8.480 0.090 19582
1126 1 13 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.426 0.034 19582
1127 1 13 . 1 1 5 5 TRP CA C 5 59.200 59.200 59.365 -0.165 19582
1128 1 13 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.706 0.495 19582
1129 1 13 . 1 1 5 5 TRP H H 5 8.000 8.000 9.022 -1.022 19582
1130 1 13 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.522 0.758 19582
1131 1 13 . 1 1 6 6 PHE CA C 6 59.000 59.000 60.545 -1.545 19582
1132 1 13 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.351 0.149 19582
1133 1 13 . 1 1 6 6 PHE H H 6 7.400 7.400 7.430 -0.030 19582
1134 1 13 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.734 -0.144 19582
1135 1 13 . 1 1 7 7 ASP CA C 7 55.700 55.700 55.961 -0.261 19582
1136 1 13 . 1 1 7 7 ASP CB C 7 41.400 41.400 41.637 -0.237 19582
1137 1 13 . 1 1 7 7 ASP H H 7 7.860 7.860 7.931 -0.071 19582
1138 1 13 . 1 1 8 8 ILE HA H 8 4.050 4.050 3.981 0.069 19582
1139 1 13 . 1 1 8 8 ILE CA C 8 65.400 65.400 63.527 1.873 19582
1140 1 13 . 1 1 8 8 ILE CB C 8 38.600 38.600 36.679 1.921 19582
1141 1 13 . 1 1 8 8 ILE H H 8 7.840 7.840 8.021 -0.181 19582
1142 1 13 . 1 1 9 9 THR HA H 9 4.050 4.050 4.112 -0.062 19582
1143 1 13 . 1 1 9 9 THR CA C 9 64.000 64.000 66.705 -2.705 19582
1144 1 13 . 1 1 9 9 THR CB C 9 69.100 69.100 68.480 0.620 19582
1145 1 13 . 1 1 9 9 THR H H 9 8.080 8.080 8.689 -0.609 19582
1146 1 13 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.785 -0.135 19582
1147 1 13 . 1 1 10 10 ASN CB C 10 38.700 38.700 38.024 0.676 19582
1148 1 13 . 1 1 10 10 ASN H H 10 7.930 7.930 8.096 -0.166 19582
1149 1 13 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.410 0.340 19582
1150 1 13 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.231 0.269 19582
1151 1 13 . 1 1 11 11 TRP H H 11 7.910 7.910 8.199 -0.289 19582
1152 1 13 . 1 1 12 12 LEU HA H 12 4.050 4.050 3.937 0.113 19582
1153 1 13 . 1 1 12 12 LEU CA C 12 57.900 57.900 58.284 -0.384 19582
1154 1 13 . 1 1 12 12 LEU CB C 12 41.800 41.800 42.138 -0.338 19582
1155 1 13 . 1 1 12 12 LEU H H 12 8.000 8.000 7.783 0.217 19582
1156 1 13 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.462 -0.212 19582
1157 1 13 . 1 1 13 13 TRP CA C 13 60.300 60.300 58.854 1.446 19582
1158 1 13 . 1 1 13 13 TRP CB C 13 28.700 28.700 28.831 -0.131 19582
1159 1 13 . 1 1 13 13 TRP H H 13 7.850 7.850 7.574 0.276 19582
1160 1 13 . 1 1 14 14 TYR HA H 14 4.050 4.050 3.536 0.514 19582
1161 1 13 . 1 1 14 14 TYR CA C 14 61.300 61.300 61.234 0.066 19582
1162 1 13 . 1 1 14 14 TYR H H 14 7.400 7.400 6.779 0.621 19582
1163 1 13 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.520 0.280 19582
1164 1 13 . 1 1 15 15 ILE CA C 15 64.300 64.300 65.075 -0.775 19582
1165 1 13 . 1 1 15 15 ILE CB C 15 37.700 37.700 37.588 0.112 19582
1166 1 13 . 1 1 15 15 ILE H H 15 7.930 7.930 8.524 -0.594 19582
1167 1 13 . 1 1 16 16 LYS HA H 16 3.920 3.920 4.099 -0.179 19582
1168 1 13 . 1 1 16 16 LYS CA C 16 60.100 60.100 59.192 0.908 19582
1169 1 13 . 1 1 16 16 LYS CB C 16 32.000 32.000 32.167 -0.167 19582
1170 1 13 . 1 1 16 16 LYS H H 16 7.880 7.880 7.683 0.197 19582
1171 1 13 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.975 0.105 19582
1172 1 13 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.349 0.851 19582
1173 1 13 . 1 1 17 17 LEU CB C 17 41.700 41.700 41.454 0.246 19582
1174 1 13 . 1 1 17 17 LEU H H 17 7.580 7.580 7.550 0.030 19582
1175 1 13 . 1 1 18 18 PHE HA H 18 4.140 4.140 3.989 0.151 19582
1176 1 13 . 1 1 18 18 PHE CA C 18 61.900 61.900 61.823 0.077 19582
1177 1 13 . 1 1 18 18 PHE CB C 18 38.900 38.900 39.020 -0.120 19582
1178 1 13 . 1 1 18 18 PHE H H 18 8.140 8.140 7.600 0.540 19582
1179 1 13 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.488 0.102 19582
1180 1 13 . 1 1 19 19 ILE CA C 19 65.100 65.100 65.181 -0.081 19582
1181 1 13 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.732 0.168 19582
1182 1 13 . 1 1 19 19 ILE H H 19 8.470 8.470 7.542 0.928 19582
1183 1 13 . 1 1 20 20 MET HA H 20 4.130 4.130 4.028 0.102 19582
1184 1 13 . 1 1 20 20 MET CA C 20 59.100 59.100 59.182 -0.082 19582
1185 1 13 . 1 1 20 20 MET CB C 20 32.600 32.600 32.504 0.096 19582
1186 1 13 . 1 1 20 20 MET H H 20 8.110 8.110 7.386 0.724 19582
1187 1 13 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.630 0.180 19582
1188 1 13 . 1 1 21 21 ILE CA C 21 65.100 65.100 65.265 -0.165 19582
1189 1 13 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.728 0.572 19582
1190 1 13 . 1 1 21 21 ILE H H 21 8.550 8.550 8.410 0.140 19582
1191 1 13 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.523 0.077 19582
1192 1 13 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.355 0.545 19582
1193 1 13 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.488 0.713 19582
1194 1 13 . 1 1 22 22 VAL H H 22 8.640 8.640 8.271 0.369 19582
1195 1 13 . 1 1 23 23 GLY CA C 23 46.900 46.900 46.997 -0.097 19582
1196 1 13 . 1 1 23 23 GLY H H 23 8.320 8.320 8.087 0.233 19582
1197 1 13 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.743 1.857 19582
1198 1 13 . 1 1 24 24 GLY H H 24 7.620 7.620 7.515 0.105 19582
1199 1 13 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.398 -0.168 19582
1200 1 13 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.327 -0.227 19582
1201 1 13 . 1 1 25 25 LEU H H 25 8.050 8.050 7.644 0.406 19582
1202 1 13 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.676 0.154 19582
1203 1 13 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.851 -0.551 19582
1204 1 13 . 1 1 26 26 VAL CB C 26 32.000 32.000 32.107 -0.107 19582
1205 1 13 . 1 1 26 26 VAL H H 26 8.310 8.310 8.376 -0.066 19582
1206 1 13 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.250 -0.030 19582
1207 1 13 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.100 1.600 19582
1208 1 13 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.426 0.074 19582
1209 1 13 . 1 1 27 27 LYS H H 27 7.850 7.850 8.270 -0.420 19582
1210 1 14 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.273 0.157 19582
1211 1 14 . 1 1 2 2 LYS CA C 2 56.600 56.600 56.486 0.114 19582
1212 1 14 . 1 1 2 2 LYS CB C 2 33.500 33.500 32.651 0.849 19582
1213 1 14 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.295 0.086 19582
1214 1 14 . 1 1 3 3 LYS CA C 3 56.700 56.700 55.827 0.873 19582
1215 1 14 . 1 1 3 3 LYS CB C 3 33.300 33.300 33.811 -0.511 19582
1216 1 14 . 1 1 3 3 LYS H H 3 8.380 8.380 8.507 -0.127 19582
1217 1 14 . 1 1 4 4 ASN CB C 4 39.500 39.500 41.636 -2.136 19582
1218 1 14 . 1 1 4 4 ASN H H 4 8.570 8.570 8.540 0.030 19582
1219 1 14 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.500 -0.040 19582
1220 1 14 . 1 1 5 5 TRP CA C 5 59.200 59.200 59.416 -0.216 19582
1221 1 14 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.683 0.517 19582
1222 1 14 . 1 1 5 5 TRP H H 5 8.000 8.000 9.082 -1.082 19582
1223 1 14 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.461 0.819 19582
1224 1 14 . 1 1 6 6 PHE CA C 6 59.000 59.000 61.598 -2.598 19582
1225 1 14 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.470 0.030 19582
1226 1 14 . 1 1 6 6 PHE H H 6 7.400 7.400 7.559 -0.159 19582
1227 1 14 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.260 0.330 19582
1228 1 14 . 1 1 7 7 ASP CA C 7 55.700 55.700 57.428 -1.728 19582
1229 1 14 . 1 1 7 7 ASP CB C 7 41.400 41.400 40.718 0.683 19582
1230 1 14 . 1 1 7 7 ASP H H 7 7.860 7.860 7.670 0.190 19582
1231 1 14 . 1 1 8 8 ILE HA H 8 4.050 4.050 4.142 -0.092 19582
1232 1 14 . 1 1 8 8 ILE CA C 8 65.400 65.400 63.562 1.838 19582
1233 1 14 . 1 1 8 8 ILE CB C 8 38.600 38.600 37.198 1.402 19582
1234 1 14 . 1 1 8 8 ILE H H 8 7.840 7.840 7.346 0.494 19582
1235 1 14 . 1 1 9 9 THR HA H 9 4.050 4.050 4.018 0.032 19582
1236 1 14 . 1 1 9 9 THR CA C 9 64.000 64.000 66.194 -2.194 19582
1237 1 14 . 1 1 9 9 THR CB C 9 69.100 69.100 68.464 0.636 19582
1238 1 14 . 1 1 9 9 THR H H 9 8.080 8.080 8.243 -0.163 19582
1239 1 14 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.329 0.321 19582
1240 1 14 . 1 1 10 10 ASN CB C 10 38.700 38.700 38.043 0.657 19582
1241 1 14 . 1 1 10 10 ASN H H 10 7.930 7.930 7.756 0.174 19582
1242 1 14 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.500 0.250 19582
1243 1 14 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.543 -0.043 19582
1244 1 14 . 1 1 11 11 TRP H H 11 7.910 7.910 7.326 0.584 19582
1245 1 14 . 1 1 12 12 LEU HA H 12 4.050 4.050 4.005 0.045 19582
1246 1 14 . 1 1 12 12 LEU CA C 12 57.900 57.900 57.812 0.088 19582
1247 1 14 . 1 1 12 12 LEU CB C 12 41.800 41.800 41.891 -0.091 19582
1248 1 14 . 1 1 12 12 LEU H H 12 8.000 8.000 7.555 0.445 19582
1249 1 14 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.189 0.061 19582
1250 1 14 . 1 1 13 13 TRP CA C 13 60.300 60.300 62.777 -2.477 19582
1251 1 14 . 1 1 13 13 TRP CB C 13 28.700 28.700 29.493 -0.793 19582
1252 1 14 . 1 1 13 13 TRP H H 13 7.850 7.850 8.189 -0.339 19582
1253 1 14 . 1 1 14 14 TYR HA H 14 4.050 4.050 4.161 -0.111 19582
1254 1 14 . 1 1 14 14 TYR CA C 14 61.300 61.300 62.417 -1.117 19582
1255 1 14 . 1 1 14 14 TYR H H 14 7.400 7.400 7.841 -0.441 19582
1256 1 14 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.563 0.237 19582
1257 1 14 . 1 1 15 15 ILE CA C 15 64.300 64.300 65.332 -1.032 19582
1258 1 14 . 1 1 15 15 ILE CB C 15 37.700 37.700 37.786 -0.086 19582
1259 1 14 . 1 1 15 15 ILE H H 15 7.930 7.930 7.600 0.330 19582
1260 1 14 . 1 1 16 16 LYS HA H 16 3.920 3.920 3.906 0.014 19582
1261 1 14 . 1 1 16 16 LYS CA C 16 60.100 60.100 59.420 0.680 19582
1262 1 14 . 1 1 16 16 LYS CB C 16 32.000 32.000 32.126 -0.126 19582
1263 1 14 . 1 1 16 16 LYS H H 16 7.880 7.880 7.393 0.487 19582
1264 1 14 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.671 0.409 19582
1265 1 14 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.720 0.480 19582
1266 1 14 . 1 1 17 17 LEU CB C 17 41.700 41.700 41.311 0.389 19582
1267 1 14 . 1 1 17 17 LEU H H 17 7.580 7.580 8.026 -0.446 19582
1268 1 14 . 1 1 18 18 PHE HA H 18 4.140 4.140 3.835 0.305 19582
1269 1 14 . 1 1 18 18 PHE CA C 18 61.900 61.900 62.245 -0.345 19582
1270 1 14 . 1 1 18 18 PHE CB C 18 38.900 38.900 38.911 -0.011 19582
1271 1 14 . 1 1 18 18 PHE H H 18 8.140 8.140 8.103 0.037 19582
1272 1 14 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.425 0.165 19582
1273 1 14 . 1 1 19 19 ILE CA C 19 65.100 65.100 65.618 -0.518 19582
1274 1 14 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.772 0.128 19582
1275 1 14 . 1 1 19 19 ILE H H 19 8.470 8.470 7.920 0.550 19582
1276 1 14 . 1 1 20 20 MET HA H 20 4.130 4.130 3.972 0.158 19582
1277 1 14 . 1 1 20 20 MET CA C 20 59.100 59.100 58.575 0.525 19582
1278 1 14 . 1 1 20 20 MET CB C 20 32.600 32.600 32.025 0.575 19582
1279 1 14 . 1 1 20 20 MET H H 20 8.110 8.110 7.732 0.378 19582
1280 1 14 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.587 0.223 19582
1281 1 14 . 1 1 21 21 ILE CA C 21 65.100 65.100 65.161 -0.061 19582
1282 1 14 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.714 0.586 19582
1283 1 14 . 1 1 21 21 ILE H H 21 8.550 8.550 8.113 0.437 19582
1284 1 14 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.380 0.220 19582
1285 1 14 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.407 0.493 19582
1286 1 14 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.962 0.239 19582
1287 1 14 . 1 1 22 22 VAL H H 22 8.640 8.640 8.197 0.444 19582
1288 1 14 . 1 1 23 23 GLY CA C 23 46.900 46.900 46.998 -0.098 19582
1289 1 14 . 1 1 23 23 GLY H H 23 8.320 8.320 8.389 -0.069 19582
1290 1 14 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.696 1.904 19582
1291 1 14 . 1 1 24 24 GLY H H 24 7.620 7.620 7.573 0.047 19582
1292 1 14 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.367 -0.137 19582
1293 1 14 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.464 -0.364 19582
1294 1 14 . 1 1 25 25 LEU H H 25 8.050 8.050 7.697 0.353 19582
1295 1 14 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.705 0.125 19582
1296 1 14 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.436 -0.136 19582
1297 1 14 . 1 1 26 26 VAL CB C 26 32.000 32.000 32.188 -0.188 19582
1298 1 14 . 1 1 26 26 VAL H H 26 8.310 8.310 8.209 0.101 19582
1299 1 14 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.182 0.038 19582
1300 1 14 . 1 1 27 27 LYS CA C 27 57.700 57.700 57.531 0.169 19582
1301 1 14 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.597 -0.097 19582
1302 1 14 . 1 1 27 27 LYS H H 27 7.850 7.850 8.732 -0.882 19582
1303 1 15 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.533 -0.103 19582
1304 1 15 . 1 1 2 2 LYS CA C 2 56.600 56.600 56.069 0.531 19582
1305 1 15 . 1 1 2 2 LYS CB C 2 33.500 33.500 33.459 0.042 19582
1306 1 15 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.326 0.054 19582
1307 1 15 . 1 1 3 3 LYS CA C 3 56.700 56.700 56.714 -0.014 19582
1308 1 15 . 1 1 3 3 LYS CB C 3 33.300 33.300 33.233 0.066 19582
1309 1 15 . 1 1 3 3 LYS H H 3 8.380 8.380 8.481 -0.101 19582
1310 1 15 . 1 1 4 4 ASN CB C 4 39.500 39.500 40.853 -1.353 19582
1311 1 15 . 1 1 4 4 ASN H H 4 8.570 8.570 8.752 -0.182 19582
1312 1 15 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.483 -0.023 19582
1313 1 15 . 1 1 5 5 TRP CA C 5 59.200 59.200 59.074 0.126 19582
1314 1 15 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.773 0.427 19582
1315 1 15 . 1 1 5 5 TRP H H 5 8.000 8.000 9.022 -1.022 19582
1316 1 15 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.506 0.774 19582
1317 1 15 . 1 1 6 6 PHE CA C 6 59.000 59.000 60.064 -1.064 19582
1318 1 15 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.097 0.403 19582
1319 1 15 . 1 1 6 6 PHE H H 6 7.400 7.400 7.324 0.076 19582
1320 1 15 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.398 0.192 19582
1321 1 15 . 1 1 7 7 ASP CA C 7 55.700 55.700 56.447 -0.747 19582
1322 1 15 . 1 1 7 7 ASP CB C 7 41.400 41.400 40.898 0.502 19582
1323 1 15 . 1 1 7 7 ASP H H 7 7.860 7.860 7.746 0.114 19582
1324 1 15 . 1 1 8 8 ILE HA H 8 4.050 4.050 4.172 -0.122 19582
1325 1 15 . 1 1 8 8 ILE CA C 8 65.400 65.400 64.382 1.018 19582
1326 1 15 . 1 1 8 8 ILE CB C 8 38.600 38.600 36.980 1.620 19582
1327 1 15 . 1 1 8 8 ILE H H 8 7.840 7.840 7.346 0.494 19582
1328 1 15 . 1 1 9 9 THR HA H 9 4.050 4.050 4.014 0.036 19582
1329 1 15 . 1 1 9 9 THR CA C 9 64.000 64.000 66.454 -2.454 19582
1330 1 15 . 1 1 9 9 THR CB C 9 69.100 69.100 68.528 0.573 19582
1331 1 15 . 1 1 9 9 THR H H 9 8.080 8.080 7.789 0.291 19582
1332 1 15 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.377 0.273 19582
1333 1 15 . 1 1 10 10 ASN CB C 10 38.700 38.700 37.588 1.112 19582
1334 1 15 . 1 1 10 10 ASN H H 10 7.930 7.930 7.765 0.165 19582
1335 1 15 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.533 0.217 19582
1336 1 15 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.628 -0.128 19582
1337 1 15 . 1 1 11 11 TRP H H 11 7.910 7.910 7.320 0.590 19582
1338 1 15 . 1 1 12 12 LEU HA H 12 4.050 4.050 4.046 0.004 19582
1339 1 15 . 1 1 12 12 LEU CA C 12 57.900 57.900 57.873 0.027 19582
1340 1 15 . 1 1 12 12 LEU CB C 12 41.800 41.800 41.696 0.104 19582
1341 1 15 . 1 1 12 12 LEU H H 12 8.000 8.000 8.496 -0.496 19582
1342 1 15 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.328 -0.078 19582
1343 1 15 . 1 1 13 13 TRP CA C 13 60.300 60.300 62.378 -2.078 19582
1344 1 15 . 1 1 13 13 TRP CB C 13 28.700 28.700 29.403 -0.703 19582
1345 1 15 . 1 1 13 13 TRP H H 13 7.850 7.850 8.285 -0.435 19582
1346 1 15 . 1 1 14 14 TYR HA H 14 4.050 4.050 4.142 -0.092 19582
1347 1 15 . 1 1 14 14 TYR CA C 14 61.300 61.300 61.410 -0.110 19582
1348 1 15 . 1 1 14 14 TYR H H 14 7.400 7.400 7.900 -0.500 19582
1349 1 15 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.689 0.111 19582
1350 1 15 . 1 1 15 15 ILE CA C 15 64.300 64.300 63.868 0.432 19582
1351 1 15 . 1 1 15 15 ILE CB C 15 37.700 37.700 36.661 1.039 19582
1352 1 15 . 1 1 15 15 ILE H H 15 7.930 7.930 7.633 0.297 19582
1353 1 15 . 1 1 16 16 LYS HA H 16 3.920 3.920 4.063 -0.143 19582
1354 1 15 . 1 1 16 16 LYS CA C 16 60.100 60.100 58.830 1.270 19582
1355 1 15 . 1 1 16 16 LYS CB C 16 32.000 32.000 32.182 -0.182 19582
1356 1 15 . 1 1 16 16 LYS H H 16 7.880 7.880 7.469 0.411 19582
1357 1 15 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.789 0.291 19582
1358 1 15 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.524 0.676 19582
1359 1 15 . 1 1 17 17 LEU CB C 17 41.700 41.700 41.118 0.582 19582
1360 1 15 . 1 1 17 17 LEU H H 17 7.580 7.580 7.400 0.180 19582
1361 1 15 . 1 1 18 18 PHE HA H 18 4.140 4.140 3.841 0.299 19582
1362 1 15 . 1 1 18 18 PHE CA C 18 61.900 61.900 62.553 -0.652 19582
1363 1 15 . 1 1 18 18 PHE CB C 18 38.900 38.900 38.659 0.241 19582
1364 1 15 . 1 1 18 18 PHE H H 18 8.140 8.140 7.859 0.281 19582
1365 1 15 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.529 0.061 19582
1366 1 15 . 1 1 19 19 ILE CA C 19 65.100 65.100 64.862 0.238 19582
1367 1 15 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.697 0.203 19582
1368 1 15 . 1 1 19 19 ILE H H 19 8.470 8.470 7.314 1.156 19582
1369 1 15 . 1 1 20 20 MET HA H 20 4.130 4.130 4.004 0.126 19582
1370 1 15 . 1 1 20 20 MET CA C 20 59.100 59.100 58.362 0.738 19582
1371 1 15 . 1 1 20 20 MET CB C 20 32.600 32.600 31.875 0.725 19582
1372 1 15 . 1 1 20 20 MET H H 20 8.110 8.110 7.360 0.750 19582
1373 1 15 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.588 0.222 19582
1374 1 15 . 1 1 21 21 ILE CA C 21 65.100 65.100 65.490 -0.390 19582
1375 1 15 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.687 0.613 19582
1376 1 15 . 1 1 21 21 ILE H H 21 8.550 8.550 8.211 0.339 19582
1377 1 15 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.433 0.167 19582
1378 1 15 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.326 0.574 19582
1379 1 15 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.899 0.301 19582
1380 1 15 . 1 1 22 22 VAL H H 22 8.640 8.640 8.221 0.419 19582
1381 1 15 . 1 1 23 23 GLY CA C 23 46.900 46.900 47.347 -0.447 19582
1382 1 15 . 1 1 23 23 GLY H H 23 8.320 8.320 8.267 0.053 19582
1383 1 15 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.919 1.681 19582
1384 1 15 . 1 1 24 24 GLY H H 24 7.620 7.620 7.346 0.274 19582
1385 1 15 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.234 -0.004 19582
1386 1 15 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.226 -0.126 19582
1387 1 15 . 1 1 25 25 LEU H H 25 8.050 8.050 7.952 0.098 19582
1388 1 15 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.786 0.044 19582
1389 1 15 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.281 0.019 19582
1390 1 15 . 1 1 26 26 VAL CB C 26 32.000 32.000 31.853 0.147 19582
1391 1 15 . 1 1 26 26 VAL H H 26 8.310 8.310 8.178 0.132 19582
1392 1 15 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.197 0.023 19582
1393 1 15 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.405 1.295 19582
1394 1 15 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.533 -0.033 19582
1395 1 15 . 1 1 27 27 LYS H H 27 7.850 7.850 8.216 -0.366 19582
1396 1 16 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.348 0.082 19582
1397 1 16 . 1 1 2 2 LYS CA C 2 56.600 56.600 56.673 -0.073 19582
1398 1 16 . 1 1 2 2 LYS CB C 2 33.500 33.500 32.933 0.567 19582
1399 1 16 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.363 0.017 19582
1400 1 16 . 1 1 3 3 LYS CA C 3 56.700 56.700 56.140 0.560 19582
1401 1 16 . 1 1 3 3 LYS CB C 3 33.300 33.300 33.538 -0.238 19582
1402 1 16 . 1 1 3 3 LYS H H 3 8.380 8.380 8.777 -0.397 19582
1403 1 16 . 1 1 4 4 ASN CB C 4 39.500 39.500 40.041 -0.541 19582
1404 1 16 . 1 1 4 4 ASN H H 4 8.570 8.570 7.782 0.788 19582
1405 1 16 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.467 -0.007 19582
1406 1 16 . 1 1 5 5 TRP CA C 5 59.200 59.200 59.025 0.175 19582
1407 1 16 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.930 0.271 19582
1408 1 16 . 1 1 5 5 TRP H H 5 8.000 8.000 9.046 -1.046 19582
1409 1 16 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.586 0.694 19582
1410 1 16 . 1 1 6 6 PHE CA C 6 59.000 59.000 60.142 -1.142 19582
1411 1 16 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.407 0.093 19582
1412 1 16 . 1 1 6 6 PHE H H 6 7.400 7.400 7.370 0.030 19582
1413 1 16 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.367 0.223 19582
1414 1 16 . 1 1 7 7 ASP CA C 7 55.700 55.700 56.915 -1.215 19582
1415 1 16 . 1 1 7 7 ASP CB C 7 41.400 41.400 40.603 0.797 19582
1416 1 16 . 1 1 7 7 ASP H H 7 7.860 7.860 8.370 -0.510 19582
1417 1 16 . 1 1 8 8 ILE HA H 8 4.050 4.050 4.119 -0.069 19582
1418 1 16 . 1 1 8 8 ILE CA C 8 65.400 65.400 63.580 1.820 19582
1419 1 16 . 1 1 8 8 ILE CB C 8 38.600 38.600 36.888 1.712 19582
1420 1 16 . 1 1 8 8 ILE H H 8 7.840 7.840 7.823 0.017 19582
1421 1 16 . 1 1 9 9 THR HA H 9 4.050 4.050 3.997 0.053 19582
1422 1 16 . 1 1 9 9 THR CA C 9 64.000 64.000 65.629 -1.629 19582
1423 1 16 . 1 1 9 9 THR CB C 9 69.100 69.100 68.175 0.924 19582
1424 1 16 . 1 1 9 9 THR H H 9 8.080 8.080 7.532 0.548 19582
1425 1 16 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.438 0.212 19582
1426 1 16 . 1 1 10 10 ASN CB C 10 38.700 38.700 38.400 0.300 19582
1427 1 16 . 1 1 10 10 ASN H H 10 7.930 7.930 7.727 0.203 19582
1428 1 16 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.472 0.278 19582
1429 1 16 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.452 0.048 19582
1430 1 16 . 1 1 11 11 TRP H H 11 7.910 7.910 7.578 0.332 19582
1431 1 16 . 1 1 12 12 LEU HA H 12 4.050 4.050 3.939 0.111 19582
1432 1 16 . 1 1 12 12 LEU CA C 12 57.900 57.900 58.471 -0.571 19582
1433 1 16 . 1 1 12 12 LEU CB C 12 41.800 41.800 41.648 0.152 19582
1434 1 16 . 1 1 12 12 LEU H H 12 8.000 8.000 7.676 0.324 19582
1435 1 16 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.228 0.022 19582
1436 1 16 . 1 1 13 13 TRP CA C 13 60.300 60.300 62.640 -2.340 19582
1437 1 16 . 1 1 13 13 TRP CB C 13 28.700 28.700 29.394 -0.694 19582
1438 1 16 . 1 1 13 13 TRP H H 13 7.850 7.850 8.331 -0.481 19582
1439 1 16 . 1 1 14 14 TYR HA H 14 4.050 4.050 4.179 -0.129 19582
1440 1 16 . 1 1 14 14 TYR CA C 14 61.300 61.300 62.182 -0.882 19582
1441 1 16 . 1 1 14 14 TYR H H 14 7.400 7.400 7.620 -0.220 19582
1442 1 16 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.601 0.199 19582
1443 1 16 . 1 1 15 15 ILE CA C 15 64.300 64.300 65.895 -1.595 19582
1444 1 16 . 1 1 15 15 ILE CB C 15 37.700 37.700 37.896 -0.196 19582
1445 1 16 . 1 1 15 15 ILE H H 15 7.930 7.930 8.244 -0.314 19582
1446 1 16 . 1 1 16 16 LYS HA H 16 3.920 3.920 4.003 -0.083 19582
1447 1 16 . 1 1 16 16 LYS CA C 16 60.100 60.100 59.289 0.811 19582
1448 1 16 . 1 1 16 16 LYS CB C 16 32.000 32.000 32.322 -0.322 19582
1449 1 16 . 1 1 16 16 LYS H H 16 7.880 7.880 7.633 0.247 19582
1450 1 16 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.711 0.369 19582
1451 1 16 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.600 0.600 19582
1452 1 16 . 1 1 17 17 LEU CB C 17 41.700 41.700 41.309 0.392 19582
1453 1 16 . 1 1 17 17 LEU H H 17 7.580 7.580 7.920 -0.340 19582
1454 1 16 . 1 1 18 18 PHE HA H 18 4.140 4.140 3.967 0.173 19582
1455 1 16 . 1 1 18 18 PHE CA C 18 61.900 61.900 62.615 -0.715 19582
1456 1 16 . 1 1 18 18 PHE CB C 18 38.900 38.900 38.844 0.056 19582
1457 1 16 . 1 1 18 18 PHE H H 18 8.140 8.140 8.291 -0.151 19582
1458 1 16 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.523 0.067 19582
1459 1 16 . 1 1 19 19 ILE CA C 19 65.100 65.100 64.906 0.193 19582
1460 1 16 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.714 0.186 19582
1461 1 16 . 1 1 19 19 ILE H H 19 8.470 8.470 7.374 1.096 19582
1462 1 16 . 1 1 20 20 MET HA H 20 4.130 4.130 4.007 0.123 19582
1463 1 16 . 1 1 20 20 MET CA C 20 59.100 59.100 58.373 0.726 19582
1464 1 16 . 1 1 20 20 MET CB C 20 32.600 32.600 31.924 0.676 19582
1465 1 16 . 1 1 20 20 MET H H 20 8.110 8.110 7.316 0.794 19582
1466 1 16 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.599 0.211 19582
1467 1 16 . 1 1 21 21 ILE CA C 21 65.100 65.100 65.226 -0.126 19582
1468 1 16 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.683 0.617 19582
1469 1 16 . 1 1 21 21 ILE H H 21 8.550 8.550 8.243 0.307 19582
1470 1 16 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.505 0.095 19582
1471 1 16 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.394 0.506 19582
1472 1 16 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.550 0.650 19582
1473 1 16 . 1 1 22 22 VAL H H 22 8.640 8.640 8.208 0.432 19582
1474 1 16 . 1 1 23 23 GLY CA C 23 46.900 46.900 47.006 -0.106 19582
1475 1 16 . 1 1 23 23 GLY H H 23 8.320 8.320 8.222 0.098 19582
1476 1 16 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.985 1.615 19582
1477 1 16 . 1 1 24 24 GLY H H 24 7.620 7.620 7.516 0.104 19582
1478 1 16 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.399 -0.169 19582
1479 1 16 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.379 -0.279 19582
1480 1 16 . 1 1 25 25 LEU H H 25 8.050 8.050 7.650 0.400 19582
1481 1 16 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.703 0.127 19582
1482 1 16 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.771 -0.471 19582
1483 1 16 . 1 1 26 26 VAL CB C 26 32.000 32.000 31.694 0.306 19582
1484 1 16 . 1 1 26 26 VAL H H 26 8.310 8.310 8.392 -0.082 19582
1485 1 16 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.272 -0.052 19582
1486 1 16 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.979 0.721 19582
1487 1 16 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.493 0.007 19582
1488 1 16 . 1 1 27 27 LYS H H 27 7.850 7.850 8.678 -0.828 19582
1489 1 17 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.303 0.127 19582
1490 1 17 . 1 1 2 2 LYS CA C 2 56.600 56.600 56.890 -0.290 19582
1491 1 17 . 1 1 2 2 LYS CB C 2 33.500 33.500 32.352 1.148 19582
1492 1 17 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.536 -0.156 19582
1493 1 17 . 1 1 3 3 LYS CA C 3 56.700 56.700 55.355 1.345 19582
1494 1 17 . 1 1 3 3 LYS CB C 3 33.300 33.300 34.376 -1.076 19582
1495 1 17 . 1 1 3 3 LYS H H 3 8.380 8.380 8.507 -0.127 19582
1496 1 17 . 1 1 4 4 ASN CB C 4 39.500 39.500 40.211 -0.711 19582
1497 1 17 . 1 1 4 4 ASN H H 4 8.570 8.570 8.767 -0.197 19582
1498 1 17 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.539 -0.079 19582
1499 1 17 . 1 1 5 5 TRP CA C 5 59.200 59.200 58.269 0.931 19582
1500 1 17 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.930 0.270 19582
1501 1 17 . 1 1 5 5 TRP H H 5 8.000 8.000 8.598 -0.598 19582
1502 1 17 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.732 0.548 19582
1503 1 17 . 1 1 6 6 PHE CA C 6 59.000 59.000 60.880 -1.880 19582
1504 1 17 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.731 -0.231 19582
1505 1 17 . 1 1 6 6 PHE H H 6 7.400 7.400 8.231 -0.831 19582
1506 1 17 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.423 0.167 19582
1507 1 17 . 1 1 7 7 ASP CA C 7 55.700 55.700 57.269 -1.569 19582
1508 1 17 . 1 1 7 7 ASP CB C 7 41.400 41.400 40.665 0.735 19582
1509 1 17 . 1 1 7 7 ASP H H 7 7.860 7.860 7.824 0.036 19582
1510 1 17 . 1 1 8 8 ILE HA H 8 4.050 4.050 3.983 0.067 19582
1511 1 17 . 1 1 8 8 ILE CA C 8 65.400 65.400 63.244 2.156 19582
1512 1 17 . 1 1 8 8 ILE CB C 8 38.600 38.600 36.642 1.958 19582
1513 1 17 . 1 1 8 8 ILE H H 8 7.840 7.840 7.502 0.338 19582
1514 1 17 . 1 1 9 9 THR HA H 9 4.050 4.050 3.909 0.141 19582
1515 1 17 . 1 1 9 9 THR CA C 9 64.000 64.000 66.190 -2.190 19582
1516 1 17 . 1 1 9 9 THR CB C 9 69.100 69.100 68.195 0.905 19582
1517 1 17 . 1 1 9 9 THR H H 9 8.080 8.080 7.771 0.309 19582
1518 1 17 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.471 0.179 19582
1519 1 17 . 1 1 10 10 ASN CB C 10 38.700 38.700 38.302 0.398 19582
1520 1 17 . 1 1 10 10 ASN H H 10 7.930 7.930 7.648 0.282 19582
1521 1 17 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.384 0.366 19582
1522 1 17 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.412 0.088 19582
1523 1 17 . 1 1 11 11 TRP H H 11 7.910 7.910 7.693 0.217 19582
1524 1 17 . 1 1 12 12 LEU HA H 12 4.050 4.050 3.970 0.080 19582
1525 1 17 . 1 1 12 12 LEU CA C 12 57.900 57.900 58.161 -0.261 19582
1526 1 17 . 1 1 12 12 LEU CB C 12 41.800 41.800 41.844 -0.044 19582
1527 1 17 . 1 1 12 12 LEU H H 12 8.000 8.000 8.217 -0.217 19582
1528 1 17 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.264 -0.014 19582
1529 1 17 . 1 1 13 13 TRP CA C 13 60.300 60.300 62.252 -1.952 19582
1530 1 17 . 1 1 13 13 TRP CB C 13 28.700 28.700 29.335 -0.635 19582
1531 1 17 . 1 1 13 13 TRP H H 13 7.850 7.850 7.786 0.064 19582
1532 1 17 . 1 1 14 14 TYR HA H 14 4.050 4.050 4.033 0.017 19582
1533 1 17 . 1 1 14 14 TYR CA C 14 61.300 61.300 62.667 -1.367 19582
1534 1 17 . 1 1 14 14 TYR H H 14 7.400 7.400 7.857 -0.457 19582
1535 1 17 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.672 0.128 19582
1536 1 17 . 1 1 15 15 ILE CA C 15 64.300 64.300 65.037 -0.737 19582
1537 1 17 . 1 1 15 15 ILE CB C 15 37.700 37.700 37.848 -0.148 19582
1538 1 17 . 1 1 15 15 ILE H H 15 7.930 7.930 7.579 0.351 19582
1539 1 17 . 1 1 16 16 LYS HA H 16 3.920 3.920 3.964 -0.044 19582
1540 1 17 . 1 1 16 16 LYS CA C 16 60.100 60.100 58.812 1.288 19582
1541 1 17 . 1 1 16 16 LYS CB C 16 32.000 32.000 31.700 0.300 19582
1542 1 17 . 1 1 16 16 LYS H H 16 7.880 7.880 7.752 0.128 19582
1543 1 17 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.688 0.392 19582
1544 1 17 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.635 0.565 19582
1545 1 17 . 1 1 17 17 LEU CB C 17 41.700 41.700 41.495 0.205 19582
1546 1 17 . 1 1 17 17 LEU H H 17 7.580 7.580 8.075 -0.495 19582
1547 1 17 . 1 1 18 18 PHE HA H 18 4.140 4.140 3.919 0.221 19582
1548 1 17 . 1 1 18 18 PHE CA C 18 61.900 61.900 61.994 -0.094 19582
1549 1 17 . 1 1 18 18 PHE CB C 18 38.900 38.900 39.095 -0.195 19582
1550 1 17 . 1 1 18 18 PHE H H 18 8.140 8.140 7.587 0.553 19582
1551 1 17 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.470 0.120 19582
1552 1 17 . 1 1 19 19 ILE CA C 19 65.100 65.100 65.499 -0.399 19582
1553 1 17 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.797 0.103 19582
1554 1 17 . 1 1 19 19 ILE H H 19 8.470 8.470 7.904 0.566 19582
1555 1 17 . 1 1 20 20 MET HA H 20 4.130 4.130 3.982 0.148 19582
1556 1 17 . 1 1 20 20 MET CA C 20 59.100 59.100 58.811 0.289 19582
1557 1 17 . 1 1 20 20 MET CB C 20 32.600 32.600 32.138 0.462 19582
1558 1 17 . 1 1 20 20 MET H H 20 8.110 8.110 7.495 0.615 19582
1559 1 17 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.564 0.246 19582
1560 1 17 . 1 1 21 21 ILE CA C 21 65.100 65.100 65.407 -0.307 19582
1561 1 17 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.647 0.653 19582
1562 1 17 . 1 1 21 21 ILE H H 21 8.550 8.550 8.250 0.300 19582
1563 1 17 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.444 0.156 19582
1564 1 17 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.307 0.593 19582
1565 1 17 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.964 0.236 19582
1566 1 17 . 1 1 22 22 VAL H H 22 8.640 8.640 8.118 0.522 19582
1567 1 17 . 1 1 23 23 GLY CA C 23 46.900 46.900 47.185 -0.285 19582
1568 1 17 . 1 1 23 23 GLY H H 23 8.320 8.320 8.176 0.144 19582
1569 1 17 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.720 1.880 19582
1570 1 17 . 1 1 24 24 GLY H H 24 7.620 7.620 7.356 0.264 19582
1571 1 17 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.336 -0.106 19582
1572 1 17 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.388 -0.288 19582
1573 1 17 . 1 1 25 25 LEU H H 25 8.050 8.050 7.648 0.402 19582
1574 1 17 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.749 0.081 19582
1575 1 17 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.182 0.118 19582
1576 1 17 . 1 1 26 26 VAL CB C 26 32.000 32.000 31.922 0.078 19582
1577 1 17 . 1 1 26 26 VAL H H 26 8.310 8.310 8.262 0.048 19582
1578 1 17 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.208 0.012 19582
1579 1 17 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.319 1.381 19582
1580 1 17 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.559 -0.059 19582
1581 1 17 . 1 1 27 27 LYS H H 27 7.850 7.850 8.381 -0.531 19582
1582 1 18 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.620 -0.190 19582
1583 1 18 . 1 1 2 2 LYS CA C 2 56.600 56.600 56.418 0.182 19582
1584 1 18 . 1 1 2 2 LYS CB C 2 33.500 33.500 33.395 0.105 19582
1585 1 18 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.490 -0.110 19582
1586 1 18 . 1 1 3 3 LYS CA C 3 56.700 56.700 56.605 0.095 19582
1587 1 18 . 1 1 3 3 LYS CB C 3 33.300 33.300 33.377 -0.077 19582
1588 1 18 . 1 1 3 3 LYS H H 3 8.380 8.380 8.634 -0.254 19582
1589 1 18 . 1 1 4 4 ASN CB C 4 39.500 39.500 40.595 -1.095 19582
1590 1 18 . 1 1 4 4 ASN H H 4 8.570 8.570 8.112 0.458 19582
1591 1 18 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.405 0.055 19582
1592 1 18 . 1 1 5 5 TRP CA C 5 59.200 59.200 59.115 0.085 19582
1593 1 18 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.878 0.322 19582
1594 1 18 . 1 1 5 5 TRP H H 5 8.000 8.000 8.968 -0.968 19582
1595 1 18 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.405 0.875 19582
1596 1 18 . 1 1 6 6 PHE CA C 6 59.000 59.000 61.524 -2.524 19582
1597 1 18 . 1 1 6 6 PHE CB C 6 38.500 38.500 37.713 0.787 19582
1598 1 18 . 1 1 6 6 PHE H H 6 7.400 7.400 7.321 0.079 19582
1599 1 18 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.326 0.264 19582
1600 1 18 . 1 1 7 7 ASP CA C 7 55.700 55.700 57.479 -1.779 19582
1601 1 18 . 1 1 7 7 ASP CB C 7 41.400 41.400 40.457 0.943 19582
1602 1 18 . 1 1 7 7 ASP H H 7 7.860 7.860 7.715 0.145 19582
1603 1 18 . 1 1 8 8 ILE HA H 8 4.050 4.050 3.937 0.113 19582
1604 1 18 . 1 1 8 8 ILE CA C 8 65.400 65.400 63.910 1.490 19582
1605 1 18 . 1 1 8 8 ILE CB C 8 38.600 38.600 37.066 1.534 19582
1606 1 18 . 1 1 8 8 ILE H H 8 7.840 7.840 7.355 0.485 19582
1607 1 18 . 1 1 9 9 THR HA H 9 4.050 4.050 4.035 0.015 19582
1608 1 18 . 1 1 9 9 THR CA C 9 64.000 64.000 66.501 -2.501 19582
1609 1 18 . 1 1 9 9 THR CB C 9 69.100 69.100 68.589 0.511 19582
1610 1 18 . 1 1 9 9 THR H H 9 8.080 8.080 8.662 -0.582 19582
1611 1 18 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.358 0.292 19582
1612 1 18 . 1 1 10 10 ASN CB C 10 38.700 38.700 37.703 0.997 19582
1613 1 18 . 1 1 10 10 ASN H H 10 7.930 7.930 7.906 0.024 19582
1614 1 18 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.509 0.241 19582
1615 1 18 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.527 -0.027 19582
1616 1 18 . 1 1 11 11 TRP H H 11 7.910 7.910 7.375 0.535 19582
1617 1 18 . 1 1 12 12 LEU HA H 12 4.050 4.050 4.051 -0.001 19582
1618 1 18 . 1 1 12 12 LEU CA C 12 57.900 57.900 57.957 -0.057 19582
1619 1 18 . 1 1 12 12 LEU CB C 12 41.800 41.800 42.000 -0.200 19582
1620 1 18 . 1 1 12 12 LEU H H 12 8.000 8.000 7.625 0.375 19582
1621 1 18 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.346 -0.096 19582
1622 1 18 . 1 1 13 13 TRP CA C 13 60.300 60.300 61.902 -1.602 19582
1623 1 18 . 1 1 13 13 TRP CB C 13 28.700 28.700 29.283 -0.583 19582
1624 1 18 . 1 1 13 13 TRP H H 13 7.850 7.850 8.130 -0.280 19582
1625 1 18 . 1 1 14 14 TYR HA H 14 4.050 4.050 4.105 -0.055 19582
1626 1 18 . 1 1 14 14 TYR CA C 14 61.300 61.300 62.377 -1.077 19582
1627 1 18 . 1 1 14 14 TYR H H 14 7.400 7.400 7.881 -0.481 19582
1628 1 18 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.686 0.114 19582
1629 1 18 . 1 1 15 15 ILE CA C 15 64.300 64.300 64.981 -0.681 19582
1630 1 18 . 1 1 15 15 ILE CB C 15 37.700 37.700 37.765 -0.065 19582
1631 1 18 . 1 1 15 15 ILE H H 15 7.930 7.930 7.704 0.226 19582
1632 1 18 . 1 1 16 16 LYS HA H 16 3.920 3.920 4.031 -0.111 19582
1633 1 18 . 1 1 16 16 LYS CA C 16 60.100 60.100 58.780 1.320 19582
1634 1 18 . 1 1 16 16 LYS CB C 16 32.000 32.000 31.992 0.008 19582
1635 1 18 . 1 1 16 16 LYS H H 16 7.880 7.880 7.303 0.577 19582
1636 1 18 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.704 0.376 19582
1637 1 18 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.501 0.699 19582
1638 1 18 . 1 1 17 17 LEU CB C 17 41.700 41.700 41.381 0.319 19582
1639 1 18 . 1 1 17 17 LEU H H 17 7.580 7.580 8.028 -0.448 19582
1640 1 18 . 1 1 18 18 PHE HA H 18 4.140 4.140 3.984 0.156 19582
1641 1 18 . 1 1 18 18 PHE CA C 18 61.900 61.900 62.485 -0.585 19582
1642 1 18 . 1 1 18 18 PHE CB C 18 38.900 38.900 38.997 -0.097 19582
1643 1 18 . 1 1 18 18 PHE H H 18 8.140 8.140 7.625 0.515 19582
1644 1 18 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.634 -0.044 19582
1645 1 18 . 1 1 19 19 ILE CA C 19 65.100 65.100 65.244 -0.144 19582
1646 1 18 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.581 0.320 19582
1647 1 18 . 1 1 19 19 ILE H H 19 8.470 8.470 7.430 1.040 19582
1648 1 18 . 1 1 20 20 MET HA H 20 4.130 4.130 4.078 0.052 19582
1649 1 18 . 1 1 20 20 MET CA C 20 59.100 59.100 58.498 0.601 19582
1650 1 18 . 1 1 20 20 MET CB C 20 32.600 32.600 31.859 0.741 19582
1651 1 18 . 1 1 20 20 MET H H 20 8.110 8.110 7.231 0.879 19582
1652 1 18 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.582 0.228 19582
1653 1 18 . 1 1 21 21 ILE CA C 21 65.100 65.100 65.391 -0.291 19582
1654 1 18 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.679 0.621 19582
1655 1 18 . 1 1 21 21 ILE H H 21 8.550 8.550 8.136 0.414 19582
1656 1 18 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.457 0.143 19582
1657 1 18 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.239 0.661 19582
1658 1 18 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.970 0.230 19582
1659 1 18 . 1 1 22 22 VAL H H 22 8.640 8.640 8.198 0.442 19582
1660 1 18 . 1 1 23 23 GLY CA C 23 46.900 46.900 47.096 -0.196 19582
1661 1 18 . 1 1 23 23 GLY H H 23 8.320 8.320 8.127 0.193 19582
1662 1 18 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.781 1.819 19582
1663 1 18 . 1 1 24 24 GLY H H 24 7.620 7.620 7.393 0.227 19582
1664 1 18 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.239 -0.009 19582
1665 1 18 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.320 -0.220 19582
1666 1 18 . 1 1 25 25 LEU H H 25 8.050 8.050 7.688 0.362 19582
1667 1 18 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.716 0.114 19582
1668 1 18 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.461 -0.161 19582
1669 1 18 . 1 1 26 26 VAL CB C 26 32.000 32.000 32.217 -0.217 19582
1670 1 18 . 1 1 26 26 VAL H H 26 8.310 8.310 8.262 0.048 19582
1671 1 18 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.236 -0.016 19582
1672 1 18 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.341 1.359 19582
1673 1 18 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.518 -0.018 19582
1674 1 18 . 1 1 27 27 LYS H H 27 7.850 7.850 8.337 -0.487 19582
1675 1 19 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.537 -0.107 19582
1676 1 19 . 1 1 2 2 LYS CA C 2 56.600 56.600 56.376 0.224 19582
1677 1 19 . 1 1 2 2 LYS CB C 2 33.500 33.500 32.686 0.814 19582
1678 1 19 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.170 0.210 19582
1679 1 19 . 1 1 3 3 LYS CA C 3 56.700 56.700 57.920 -1.220 19582
1680 1 19 . 1 1 3 3 LYS CB C 3 33.300 33.300 32.818 0.482 19582
1681 1 19 . 1 1 3 3 LYS H H 3 8.380 8.380 8.695 -0.315 19582
1682 1 19 . 1 1 4 4 ASN CB C 4 39.500 39.500 39.828 -0.328 19582
1683 1 19 . 1 1 4 4 ASN H H 4 8.570 8.570 7.771 0.799 19582
1684 1 19 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.512 -0.052 19582
1685 1 19 . 1 1 5 5 TRP CA C 5 59.200 59.200 59.163 0.037 19582
1686 1 19 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.984 0.216 19582
1687 1 19 . 1 1 5 5 TRP H H 5 8.000 8.000 8.856 -0.856 19582
1688 1 19 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.483 0.797 19582
1689 1 19 . 1 1 6 6 PHE CA C 6 59.000 59.000 60.061 -1.061 19582
1690 1 19 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.322 0.178 19582
1691 1 19 . 1 1 6 6 PHE H H 6 7.400 7.400 7.281 0.119 19582
1692 1 19 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.249 0.341 19582
1693 1 19 . 1 1 7 7 ASP CA C 7 55.700 55.700 56.696 -0.996 19582
1694 1 19 . 1 1 7 7 ASP CB C 7 41.400 41.400 40.676 0.724 19582
1695 1 19 . 1 1 7 7 ASP H H 7 7.860 7.860 7.769 0.091 19582
1696 1 19 . 1 1 8 8 ILE HA H 8 4.050 4.050 4.186 -0.136 19582
1697 1 19 . 1 1 8 8 ILE CA C 8 65.400 65.400 63.493 1.907 19582
1698 1 19 . 1 1 8 8 ILE CB C 8 38.600 38.600 37.228 1.371 19582
1699 1 19 . 1 1 8 8 ILE H H 8 7.840 7.840 7.581 0.259 19582
1700 1 19 . 1 1 9 9 THR HA H 9 4.050 4.050 3.913 0.137 19582
1701 1 19 . 1 1 9 9 THR CA C 9 64.000 64.000 65.944 -1.944 19582
1702 1 19 . 1 1 9 9 THR CB C 9 69.100 69.100 67.885 1.215 19582
1703 1 19 . 1 1 9 9 THR H H 9 8.080 8.080 7.587 0.493 19582
1704 1 19 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.156 0.494 19582
1705 1 19 . 1 1 10 10 ASN CB C 10 38.700 38.700 38.020 0.680 19582
1706 1 19 . 1 1 10 10 ASN H H 10 7.930 7.930 7.446 0.484 19582
1707 1 19 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.506 0.244 19582
1708 1 19 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.393 0.107 19582
1709 1 19 . 1 1 11 11 TRP H H 11 7.910 7.910 7.415 0.495 19582
1710 1 19 . 1 1 12 12 LEU HA H 12 4.050 4.050 4.016 0.034 19582
1711 1 19 . 1 1 12 12 LEU CA C 12 57.900 57.900 59.120 -1.220 19582
1712 1 19 . 1 1 12 12 LEU CB C 12 41.800 41.800 41.525 0.275 19582
1713 1 19 . 1 1 12 12 LEU H H 12 8.000 8.000 7.543 0.457 19582
1714 1 19 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.260 -0.010 19582
1715 1 19 . 1 1 13 13 TRP CA C 13 60.300 60.300 62.285 -1.985 19582
1716 1 19 . 1 1 13 13 TRP CB C 13 28.700 28.700 29.187 -0.487 19582
1717 1 19 . 1 1 13 13 TRP H H 13 7.850 7.850 7.962 -0.112 19582
1718 1 19 . 1 1 14 14 TYR HA H 14 4.050 4.050 4.083 -0.033 19582
1719 1 19 . 1 1 14 14 TYR CA C 14 61.300 61.300 62.438 -1.138 19582
1720 1 19 . 1 1 14 14 TYR H H 14 7.400 7.400 7.772 -0.372 19582
1721 1 19 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.566 0.234 19582
1722 1 19 . 1 1 15 15 ILE CA C 15 64.300 64.300 64.988 -0.688 19582
1723 1 19 . 1 1 15 15 ILE CB C 15 37.700 37.700 37.880 -0.180 19582
1724 1 19 . 1 1 15 15 ILE H H 15 7.930 7.930 7.558 0.372 19582
1725 1 19 . 1 1 16 16 LYS HA H 16 3.920 3.920 3.950 -0.030 19582
1726 1 19 . 1 1 16 16 LYS CA C 16 60.100 60.100 59.767 0.333 19582
1727 1 19 . 1 1 16 16 LYS CB C 16 32.000 32.000 32.214 -0.214 19582
1728 1 19 . 1 1 16 16 LYS H H 16 7.880 7.880 7.818 0.062 19582
1729 1 19 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.703 0.377 19582
1730 1 19 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.581 0.619 19582
1731 1 19 . 1 1 17 17 LEU CB C 17 41.700 41.700 41.532 0.168 19582
1732 1 19 . 1 1 17 17 LEU H H 17 7.580 7.580 8.032 -0.452 19582
1733 1 19 . 1 1 18 18 PHE HA H 18 4.140 4.140 3.923 0.217 19582
1734 1 19 . 1 1 18 18 PHE CA C 18 61.900 61.900 61.962 -0.062 19582
1735 1 19 . 1 1 18 18 PHE CB C 18 38.900 38.900 39.034 -0.134 19582
1736 1 19 . 1 1 18 18 PHE H H 18 8.140 8.140 7.485 0.655 19582
1737 1 19 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.478 0.112 19582
1738 1 19 . 1 1 19 19 ILE CA C 19 65.100 65.100 65.375 -0.275 19582
1739 1 19 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.693 0.207 19582
1740 1 19 . 1 1 19 19 ILE H H 19 8.470 8.470 7.645 0.825 19582
1741 1 19 . 1 1 20 20 MET HA H 20 4.130 4.130 4.026 0.104 19582
1742 1 19 . 1 1 20 20 MET CA C 20 59.100 59.100 58.768 0.332 19582
1743 1 19 . 1 1 20 20 MET CB C 20 32.600 32.600 32.259 0.341 19582
1744 1 19 . 1 1 20 20 MET H H 20 8.110 8.110 7.386 0.724 19582
1745 1 19 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.569 0.241 19582
1746 1 19 . 1 1 21 21 ILE CA C 21 65.100 65.100 65.339 -0.239 19582
1747 1 19 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.611 0.689 19582
1748 1 19 . 1 1 21 21 ILE H H 21 8.550 8.550 8.364 0.186 19582
1749 1 19 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.544 0.056 19582
1750 1 19 . 1 1 22 22 VAL CA C 22 66.900 66.900 65.911 0.989 19582
1751 1 19 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.246 0.954 19582
1752 1 19 . 1 1 22 22 VAL H H 22 8.640 8.640 8.211 0.429 19582
1753 1 19 . 1 1 23 23 GLY CA C 23 46.900 46.900 47.045 -0.145 19582
1754 1 19 . 1 1 23 23 GLY H H 23 8.320 8.320 8.238 0.082 19582
1755 1 19 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.741 1.859 19582
1756 1 19 . 1 1 24 24 GLY H H 24 7.620 7.620 7.428 0.192 19582
1757 1 19 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.405 -0.175 19582
1758 1 19 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.376 -0.276 19582
1759 1 19 . 1 1 25 25 LEU H H 25 8.050 8.050 7.685 0.365 19582
1760 1 19 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.758 0.072 19582
1761 1 19 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.278 0.022 19582
1762 1 19 . 1 1 26 26 VAL CB C 26 32.000 32.000 32.366 -0.366 19582
1763 1 19 . 1 1 26 26 VAL H H 26 8.310 8.310 8.341 -0.031 19582
1764 1 19 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.261 -0.041 19582
1765 1 19 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.591 1.109 19582
1766 1 19 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.302 0.198 19582
1767 1 19 . 1 1 27 27 LYS H H 27 7.850 7.850 8.365 -0.515 19582
1768 1 20 . 1 1 2 2 LYS HA H 2 4.430 4.430 4.796 -0.366 19582
1769 1 20 . 1 1 2 2 LYS CA C 2 56.600 56.600 55.638 0.962 19582
1770 1 20 . 1 1 2 2 LYS CB C 2 33.500 33.500 34.654 -1.154 19582
1771 1 20 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.566 -0.186 19582
1772 1 20 . 1 1 3 3 LYS CA C 3 56.700 56.700 56.724 -0.024 19582
1773 1 20 . 1 1 3 3 LYS CB C 3 33.300 33.300 33.242 0.058 19582
1774 1 20 . 1 1 3 3 LYS H H 3 8.380 8.380 8.642 -0.262 19582
1775 1 20 . 1 1 4 4 ASN CB C 4 39.500 39.500 39.934 -0.434 19582
1776 1 20 . 1 1 4 4 ASN H H 4 8.570 8.570 8.109 0.461 19582
1777 1 20 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.534 -0.074 19582
1778 1 20 . 1 1 5 5 TRP CA C 5 59.200 59.200 59.198 0.002 19582
1779 1 20 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.973 0.227 19582
1780 1 20 . 1 1 5 5 TRP H H 5 8.000 8.000 8.963 -0.963 19582
1781 1 20 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.707 0.573 19582
1782 1 20 . 1 1 6 6 PHE CA C 6 59.000 59.000 59.966 -0.966 19582
1783 1 20 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.632 -0.132 19582
1784 1 20 . 1 1 6 6 PHE H H 6 7.400 7.400 7.301 0.099 19582
1785 1 20 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.166 0.424 19582
1786 1 20 . 1 1 7 7 ASP CA C 7 55.700 55.700 57.901 -2.201 19582
1787 1 20 . 1 1 7 7 ASP CB C 7 41.400 41.400 40.931 0.469 19582
1788 1 20 . 1 1 7 7 ASP H H 7 7.860 7.860 7.695 0.165 19582
1789 1 20 . 1 1 8 8 ILE HA H 8 4.050 4.050 4.097 -0.047 19582
1790 1 20 . 1 1 8 8 ILE CA C 8 65.400 65.400 63.955 1.445 19582
1791 1 20 . 1 1 8 8 ILE CB C 8 38.600 38.600 36.969 1.631 19582
1792 1 20 . 1 1 8 8 ILE H H 8 7.840 7.840 7.437 0.403 19582
1793 1 20 . 1 1 9 9 THR HA H 9 4.050 4.050 4.002 0.048 19582
1794 1 20 . 1 1 9 9 THR CA C 9 64.000 64.000 66.422 -2.422 19582
1795 1 20 . 1 1 9 9 THR CB C 9 69.100 69.100 68.128 0.972 19582
1796 1 20 . 1 1 9 9 THR H H 9 8.080 8.080 7.980 0.100 19582
1797 1 20 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.231 0.419 19582
1798 1 20 . 1 1 10 10 ASN CB C 10 38.700 38.700 37.435 1.264 19582
1799 1 20 . 1 1 10 10 ASN H H 10 7.930 7.930 7.439 0.491 19582
1800 1 20 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.522 0.228 19582
1801 1 20 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.379 0.121 19582
1802 1 20 . 1 1 11 11 TRP H H 11 7.910 7.910 7.112 0.798 19582
1803 1 20 . 1 1 12 12 LEU HA H 12 4.050 4.050 4.119 -0.069 19582
1804 1 20 . 1 1 12 12 LEU CA C 12 57.900 57.900 57.896 0.004 19582
1805 1 20 . 1 1 12 12 LEU CB C 12 41.800 41.800 41.055 0.745 19582
1806 1 20 . 1 1 12 12 LEU H H 12 8.000 8.000 8.085 -0.085 19582
1807 1 20 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.278 -0.028 19582
1808 1 20 . 1 1 13 13 TRP CA C 13 60.300 60.300 61.996 -1.696 19582
1809 1 20 . 1 1 13 13 TRP CB C 13 28.700 28.700 29.300 -0.600 19582
1810 1 20 . 1 1 13 13 TRP H H 13 7.850 7.850 7.819 0.031 19582
1811 1 20 . 1 1 14 14 TYR HA H 14 4.050 4.050 4.159 -0.109 19582
1812 1 20 . 1 1 14 14 TYR CA C 14 61.300 61.300 61.925 -0.625 19582
1813 1 20 . 1 1 14 14 TYR H H 14 7.400 7.400 7.993 -0.593 19582
1814 1 20 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.661 0.139 19582
1815 1 20 . 1 1 15 15 ILE CA C 15 64.300 64.300 62.917 1.383 19582
1816 1 20 . 1 1 15 15 ILE CB C 15 37.700 37.700 36.857 0.843 19582
1817 1 20 . 1 1 15 15 ILE H H 15 7.930 7.930 7.646 0.284 19582
1818 1 20 . 1 1 16 16 LYS HA H 16 3.920 3.920 3.983 -0.063 19582
1819 1 20 . 1 1 16 16 LYS CA C 16 60.100 60.100 59.330 0.770 19582
1820 1 20 . 1 1 16 16 LYS CB C 16 32.000 32.000 32.066 -0.067 19582
1821 1 20 . 1 1 16 16 LYS H H 16 7.880 7.880 7.319 0.561 19582
1822 1 20 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.647 0.433 19582
1823 1 20 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.708 0.492 19582
1824 1 20 . 1 1 17 17 LEU CB C 17 41.700 41.700 41.489 0.211 19582
1825 1 20 . 1 1 17 17 LEU H H 17 7.580 7.580 7.793 -0.213 19582
1826 1 20 . 1 1 18 18 PHE HA H 18 4.140 4.140 3.914 0.226 19582
1827 1 20 . 1 1 18 18 PHE CA C 18 61.900 61.900 61.961 -0.061 19582
1828 1 20 . 1 1 18 18 PHE CB C 18 38.900 38.900 39.022 -0.121 19582
1829 1 20 . 1 1 18 18 PHE H H 18 8.140 8.140 7.504 0.636 19582
1830 1 20 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.426 0.164 19582
1831 1 20 . 1 1 19 19 ILE CA C 19 65.100 65.100 65.198 -0.098 19582
1832 1 20 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.689 0.211 19582
1833 1 20 . 1 1 19 19 ILE H H 19 8.470 8.470 7.387 1.083 19582
1834 1 20 . 1 1 20 20 MET HA H 20 4.130 4.130 3.927 0.203 19582
1835 1 20 . 1 1 20 20 MET CA C 20 59.100 59.100 59.344 -0.244 19582
1836 1 20 . 1 1 20 20 MET CB C 20 32.600 32.600 32.454 0.146 19582
1837 1 20 . 1 1 20 20 MET H H 20 8.110 8.110 7.580 0.530 19582
1838 1 20 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.598 0.212 19582
1839 1 20 . 1 1 21 21 ILE CA C 21 65.100 65.100 65.240 -0.140 19582
1840 1 20 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.664 0.636 19582
1841 1 20 . 1 1 21 21 ILE H H 21 8.550 8.550 8.151 0.399 19582
1842 1 20 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.519 0.081 19582
1843 1 20 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.310 0.590 19582
1844 1 20 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.519 0.681 19582
1845 1 20 . 1 1 22 22 VAL H H 22 8.640 8.640 8.176 0.464 19582
1846 1 20 . 1 1 23 23 GLY CA C 23 46.900 46.900 47.156 -0.256 19582
1847 1 20 . 1 1 23 23 GLY H H 23 8.320 8.320 8.077 0.243 19582
1848 1 20 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.847 1.753 19582
1849 1 20 . 1 1 24 24 GLY H H 24 7.620 7.620 7.386 0.234 19582
1850 1 20 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.330 -0.100 19582
1851 1 20 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.261 -0.161 19582
1852 1 20 . 1 1 25 25 LEU H H 25 8.050 8.050 7.709 0.341 19582
1853 1 20 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.696 0.134 19582
1854 1 20 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.454 -0.154 19582
1855 1 20 . 1 1 26 26 VAL CB C 26 32.000 32.000 32.041 -0.041 19582
1856 1 20 . 1 1 26 26 VAL H H 26 8.310 8.310 8.203 0.107 19582
1857 1 20 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.256 -0.036 19582
1858 1 20 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.520 1.179 19582
1859 1 20 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.664 -0.164 19582
1860 1 20 . 1 1 27 27 LYS H H 27 7.850 7.850 8.152 -0.302 19582
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 19582
2 1 1 "Average Difference" HA 27 0.175 -0.058 0.168 19582
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19582
4 1 1 "Average Difference" CA 22 1.124 0.023 1.150 19582
5 1 1 "Average Difference" CB 23 0.612 -0.160 0.604 19582
6 1 1 "Average Difference" HN 25 0.446 -0.151 0.429 19582
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19582
8 1 2 "Average Difference" HA 27 0.249 -0.077 0.241 19582
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19582
10 1 2 "Average Difference" CA 22 1.016 -0.020 1.040 19582
11 1 2 "Average Difference" CB 23 0.507 -0.265 0.442 19582
12 1 2 "Average Difference" HN 25 0.487 -0.129 0.479 19582
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19582
14 1 3 "Average Difference" HA 27 0.231 -0.062 0.227 19582
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19582
16 1 3 "Average Difference" CA 22 1.152 -0.100 1.174 19582
17 1 3 "Average Difference" CB 23 0.491 -0.167 0.472 19582
18 1 3 "Average Difference" HN 25 0.471 -0.113 0.467 19582
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19582
20 1 4 "Average Difference" HA 27 0.206 -0.069 0.197 19582
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19582
22 1 4 "Average Difference" CA 22 1.140 0.060 1.166 19582
23 1 4 "Average Difference" CB 23 0.562 -0.131 0.559 19582
24 1 4 "Average Difference" HN 25 0.455 -0.127 0.446 19582
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19582
26 1 5 "Average Difference" HA 27 0.217 -0.095 0.199 19582
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19582
28 1 5 "Average Difference" CA 22 1.077 0.099 1.098 19582
29 1 5 "Average Difference" CB 23 0.625 -0.131 0.624 19582
30 1 5 "Average Difference" HN 25 0.472 -0.016 0.482 19582
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19582
32 1 6 "Average Difference" HA 27 0.219 -0.094 0.202 19582
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19582
34 1 6 "Average Difference" CA 22 1.162 0.094 1.186 19582
35 1 6 "Average Difference" CB 23 0.604 -0.318 0.525 19582
36 1 6 "Average Difference" HN 25 0.456 -0.108 0.452 19582
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19582
38 1 7 "Average Difference" HA 27 0.195 -0.108 0.165 19582
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19582
40 1 7 "Average Difference" CA 22 1.162 0.096 1.185 19582
41 1 7 "Average Difference" CB 23 0.490 -0.137 0.481 19582
42 1 7 "Average Difference" HN 25 0.429 -0.088 0.429 19582
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19582
44 1 8 "Average Difference" HA 27 0.231 -0.059 0.227 19582
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19582
46 1 8 "Average Difference" CA 22 1.276 -0.010 1.306 19582
47 1 8 "Average Difference" CB 23 0.761 -0.216 0.746 19582
48 1 8 "Average Difference" HN 25 0.431 -0.140 0.416 19582
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19582
50 1 9 "Average Difference" HA 27 0.216 -0.091 0.200 19582
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19582
52 1 9 "Average Difference" CA 22 1.138 0.022 1.165 19582
53 1 9 "Average Difference" CB 23 0.698 -0.204 0.682 19582
54 1 9 "Average Difference" HN 25 0.475 -0.067 0.479 19582
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19582
56 1 10 "Average Difference" HA 27 0.194 -0.099 0.170 19582
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19582
58 1 10 "Average Difference" CA 22 1.068 -0.032 1.092 19582
59 1 10 "Average Difference" CB 23 0.555 -0.242 0.510 19582
60 1 10 "Average Difference" HN 25 0.498 -0.066 0.504 19582
61 1 11 "Average Difference" N 0 0.000 0.000 0.000 19582
62 1 11 "Average Difference" HA 27 0.211 -0.080 0.199 19582
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19582
64 1 11 "Average Difference" CA 22 1.177 -0.024 1.204 19582
65 1 11 "Average Difference" CB 23 0.623 -0.289 0.565 19582
66 1 11 "Average Difference" HN 25 0.457 -0.161 0.437 19582
67 1 12 "Average Difference" N 0 0.000 0.000 0.000 19582
68 1 12 "Average Difference" HA 27 0.195 -0.093 0.175 19582
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19582
70 1 12 "Average Difference" CA 22 1.034 0.109 1.052 19582
71 1 12 "Average Difference" CB 23 0.598 -0.251 0.556 19582
72 1 12 "Average Difference" HN 25 0.445 -0.084 0.446 19582
73 1 13 "Average Difference" N 0 0.000 0.000 0.000 19582
74 1 13 "Average Difference" HA 27 0.236 -0.087 0.224 19582
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19582
76 1 13 "Average Difference" CA 22 1.061 -0.104 1.081 19582
77 1 13 "Average Difference" CB 23 0.563 -0.251 0.515 19582
78 1 13 "Average Difference" HN 25 0.445 -0.077 0.448 19582
79 1 14 "Average Difference" N 0 0.000 0.000 0.000 19582
80 1 14 "Average Difference" HA 27 0.250 -0.136 0.214 19582
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19582
82 1 14 "Average Difference" CA 22 1.215 0.243 1.219 19582
83 1 14 "Average Difference" CB 23 0.686 -0.097 0.694 19582
84 1 14 "Average Difference" HN 25 0.434 -0.055 0.439 19582
85 1 15 "Average Difference" N 0 0.000 0.000 0.000 19582
86 1 15 "Average Difference" HA 27 0.221 -0.090 0.206 19582
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19582
88 1 15 "Average Difference" CA 22 0.996 -0.030 1.019 19582
89 1 15 "Average Difference" CB 23 0.650 -0.268 0.606 19582
90 1 15 "Average Difference" HN 25 0.460 -0.121 0.453 19582
91 1 16 "Average Difference" N 0 0.000 0.000 0.000 19582
92 1 16 "Average Difference" HA 27 0.202 -0.107 0.175 19582
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19582
94 1 16 "Average Difference" CA 22 1.043 0.143 1.058 19582
95 1 16 "Average Difference" CB 23 0.572 -0.238 0.532 19582
96 1 16 "Average Difference" HN 25 0.500 -0.054 0.507 19582
97 1 17 "Average Difference" N 0 0.000 0.000 0.000 19582
98 1 17 "Average Difference" HA 27 0.206 -0.094 0.187 19582
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19582
100 1 17 "Average Difference" CA 22 1.219 0.036 1.247 19582
101 1 17 "Average Difference" CB 23 0.655 -0.180 0.644 19582
102 1 17 "Average Difference" HN 25 0.399 -0.067 0.402 19582
103 1 18 "Average Difference" N 0 0.000 0.000 0.000 19582
104 1 18 "Average Difference" HA 27 0.236 -0.080 0.226 19582
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19582
106 1 18 "Average Difference" CA 22 1.186 0.149 1.204 19582
107 1 18 "Average Difference" CB 23 0.594 -0.210 0.568 19582
108 1 18 "Average Difference" HN 25 0.493 -0.141 0.482 19582
109 1 19 "Average Difference" N 0 0.000 0.000 0.000 19582
110 1 19 "Average Difference" HA 27 0.245 -0.114 0.221 19582
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19582
112 1 19 "Average Difference" CA 22 1.059 0.161 1.072 19582
113 1 19 "Average Difference" CB 23 0.577 -0.289 0.511 19582
114 1 19 "Average Difference" HN 25 0.460 -0.177 0.433 19582
115 1 20 "Average Difference" N 0 0.000 0.000 0.000 19582
116 1 20 "Average Difference" HA 27 0.236 -0.074 0.228 19582
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19582
118 1 20 "Average Difference" CA 22 1.080 0.014 1.105 19582
119 1 20 "Average Difference" CB 23 0.650 -0.232 0.620 19582
120 1 20 "Average Difference" HN 25 0.476 -0.201 0.440 19582
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 19582
_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 4.430 4.430 4.420 0.010 19582
2 1 . 1 1 2 2 LYS CA C 2 56.600 56.600 56.449 0.151 19582
3 1 . 1 1 2 2 LYS CB C 2 33.500 33.500 32.930 0.570 19582
4 1 . 1 1 3 3 LYS HA H 3 4.380 4.380 4.415 -0.035 19582
5 1 . 1 1 3 3 LYS CA C 3 56.700 56.700 56.178 0.522 19582
6 1 . 1 1 3 3 LYS CB C 3 33.300 33.300 33.605 -0.305 19582
7 1 . 1 1 3 3 LYS H H 3 8.380 8.380 8.351 0.029 19582
8 1 . 1 1 4 4 ASN CB C 4 39.500 39.500 39.997 -0.497 19582
9 1 . 1 1 4 4 ASN H H 4 8.570 8.570 8.368 0.202 19582
10 1 . 1 1 5 5 TRP HA H 5 4.460 4.460 4.447 0.013 19582
11 1 . 1 1 5 5 TRP CA C 5 59.200 59.200 59.099 0.101 19582
12 1 . 1 1 5 5 TRP CB C 5 29.200 29.200 28.819 0.381 19582
13 1 . 1 1 5 5 TRP H H 5 8.000 8.000 8.946 -0.946 19582
14 1 . 1 1 6 6 PHE HA H 6 4.280 4.280 3.608 0.672 19582
15 1 . 1 1 6 6 PHE CA C 6 59.000 59.000 60.593 -1.593 19582
16 1 . 1 1 6 6 PHE CB C 6 38.500 38.500 38.396 0.104 19582
17 1 . 1 1 6 6 PHE H H 6 7.400 7.400 7.381 0.019 19582
18 1 . 1 1 7 7 ASP HA H 7 4.590 4.590 4.472 0.118 19582
19 1 . 1 1 7 7 ASP CA C 7 55.700 55.700 57.054 -1.354 19582
20 1 . 1 1 7 7 ASP CB C 7 41.400 41.400 41.118 0.282 19582
21 1 . 1 1 7 7 ASP H H 7 7.860 7.860 7.849 0.011 19582
22 1 . 1 1 8 8 ILE HA H 8 4.050 4.050 4.062 -0.012 19582
23 1 . 1 1 8 8 ILE CA C 8 65.400 65.400 63.661 1.739 19582
24 1 . 1 1 8 8 ILE CB C 8 38.600 38.600 36.909 1.691 19582
25 1 . 1 1 8 8 ILE H H 8 7.840 7.840 7.535 0.305 19582
26 1 . 1 1 9 9 THR HA H 9 4.050 4.050 4.002 0.048 19582
27 1 . 1 1 9 9 THR CA C 9 64.000 64.000 66.453 -2.453 19582
28 1 . 1 1 9 9 THR CB C 9 69.100 69.100 68.341 0.759 19582
29 1 . 1 1 9 9 THR H H 9 8.080 8.080 8.145 -0.065 19582
30 1 . 1 1 10 10 ASN HA H 10 4.650 4.650 4.457 0.193 19582
31 1 . 1 1 10 10 ASN CB C 10 38.700 38.700 38.122 0.578 19582
32 1 . 1 1 10 10 ASN H H 10 7.930 7.930 7.695 0.235 19582
33 1 . 1 1 11 11 TRP HA H 11 4.750 4.750 4.441 0.308 19582
34 1 . 1 1 11 11 TRP CB C 11 29.500 29.500 29.442 0.058 19582
35 1 . 1 1 11 11 TRP H H 11 7.910 7.910 7.547 0.363 19582
36 1 . 1 1 12 12 LEU HA H 12 4.050 4.050 4.008 0.042 19582
37 1 . 1 1 12 12 LEU CA C 12 57.900 57.900 58.212 -0.312 19582
38 1 . 1 1 12 12 LEU CB C 12 41.800 41.800 41.714 0.086 19582
39 1 . 1 1 12 12 LEU H H 12 8.000 8.000 8.091 -0.091 19582
40 1 . 1 1 13 13 TRP HA H 13 4.250 4.250 4.310 -0.060 19582
41 1 . 1 1 13 13 TRP CA C 13 60.300 60.300 61.543 -1.243 19582
42 1 . 1 1 13 13 TRP CB C 13 28.700 28.700 29.225 -0.525 19582
43 1 . 1 1 13 13 TRP H H 13 7.850 7.850 8.001 -0.151 19582
44 1 . 1 1 14 14 TYR HA H 14 4.050 4.050 4.016 0.034 19582
45 1 . 1 1 14 14 TYR CA C 14 61.300 61.300 61.864 -0.565 19582
46 1 . 1 1 14 14 TYR H H 14 7.400 7.400 7.633 -0.233 19582
47 1 . 1 1 15 15 ILE HA H 15 3.800 3.800 3.619 0.181 19582
48 1 . 1 1 15 15 ILE CA C 15 64.300 64.300 64.834 -0.534 19582
49 1 . 1 1 15 15 ILE CB C 15 37.700 37.700 37.561 0.139 19582
50 1 . 1 1 15 15 ILE H H 15 7.930 7.930 7.884 0.046 19582
51 1 . 1 1 16 16 LYS HA H 16 3.920 3.920 4.013 -0.093 19582
52 1 . 1 1 16 16 LYS CA C 16 60.100 60.100 59.119 0.981 19582
53 1 . 1 1 16 16 LYS CB C 16 32.000 32.000 32.056 -0.056 19582
54 1 . 1 1 16 16 LYS H H 16 7.880 7.880 7.620 0.260 19582
55 1 . 1 1 17 17 LEU HA H 17 4.080 4.080 3.795 0.285 19582
56 1 . 1 1 17 17 LEU CA C 17 58.200 58.200 57.646 0.554 19582
57 1 . 1 1 17 17 LEU CB C 17 41.700 41.700 41.316 0.384 19582
58 1 . 1 1 17 17 LEU H H 17 7.580 7.580 7.728 -0.148 19582
59 1 . 1 1 18 18 PHE HA H 18 4.140 4.140 3.953 0.187 19582
60 1 . 1 1 18 18 PHE CA C 18 61.900 61.900 62.085 -0.185 19582
61 1 . 1 1 18 18 PHE CB C 18 38.900 38.900 38.905 -0.005 19582
62 1 . 1 1 18 18 PHE H H 18 8.140 8.140 7.679 0.461 19582
63 1 . 1 1 19 19 ILE HA H 19 3.590 3.590 3.475 0.115 19582
64 1 . 1 1 19 19 ILE CA C 19 65.100 65.100 65.234 -0.134 19582
65 1 . 1 1 19 19 ILE CB C 19 37.900 37.900 37.738 0.162 19582
66 1 . 1 1 19 19 ILE H H 19 8.470 8.470 7.553 0.917 19582
67 1 . 1 1 20 20 MET HA H 20 4.130 4.130 4.018 0.112 19582
68 1 . 1 1 20 20 MET CA C 20 59.100 59.100 58.869 0.230 19582
69 1 . 1 1 20 20 MET CB C 20 32.600 32.600 32.269 0.331 19582
70 1 . 1 1 20 20 MET H H 20 8.110 8.110 7.536 0.574 19582
71 1 . 1 1 21 21 ILE HA H 21 3.810 3.810 3.613 0.197 19582
72 1 . 1 1 21 21 ILE CA C 21 65.100 65.100 65.180 -0.080 19582
73 1 . 1 1 21 21 ILE CB C 21 38.300 38.300 37.732 0.568 19582
74 1 . 1 1 21 21 ILE H H 21 8.550 8.550 8.080 0.470 19582
75 1 . 1 1 22 22 VAL HA H 22 3.600 3.600 3.465 0.135 19582
76 1 . 1 1 22 22 VAL CA C 22 66.900 66.900 66.329 0.571 19582
77 1 . 1 1 22 22 VAL CB C 22 31.200 31.200 30.697 0.503 19582
78 1 . 1 1 22 22 VAL H H 22 8.640 8.640 8.222 0.418 19582
79 1 . 1 1 23 23 GLY CA C 23 46.900 46.900 47.127 -0.227 19582
80 1 . 1 1 23 23 GLY H H 23 8.320 8.320 8.303 0.017 19582
81 1 . 1 1 24 24 GLY CA C 24 46.600 46.600 44.787 1.813 19582
82 1 . 1 1 24 24 GLY H H 24 7.620 7.620 7.440 0.180 19582
83 1 . 1 1 25 25 LEU HA H 25 4.230 4.230 4.368 -0.138 19582
84 1 . 1 1 25 25 LEU CB C 25 42.100 42.100 42.351 -0.251 19582
85 1 . 1 1 25 25 LEU H H 25 8.050 8.050 7.707 0.343 19582
86 1 . 1 1 26 26 VAL HA H 26 3.830 3.830 3.716 0.114 19582
87 1 . 1 1 26 26 VAL CA C 26 65.300 65.300 65.445 -0.145 19582
88 1 . 1 1 26 26 VAL CB C 26 32.000 32.000 32.089 -0.089 19582
89 1 . 1 1 26 26 VAL H H 26 8.310 8.310 8.312 -0.002 19582
90 1 . 1 1 27 27 LYS HA H 27 4.220 4.220 4.234 -0.014 19582
91 1 . 1 1 27 27 LYS CA C 27 57.700 57.700 56.558 1.142 19582
92 1 . 1 1 27 27 LYS CB C 27 32.500 32.500 32.448 0.052 19582
93 1 . 1 1 27 27 LYS H H 27 7.850 7.850 8.388 -0.538 19582
stop_
save_